    24
 Energy=    -305.518926824095
   O          0.1602501018       -2.1775750746       -1.1209215641
   H          0.4615066043       -3.0300140989       -1.4352845223
   H          0.8600802303       -1.8739983073       -0.5427254229
   O         -2.0840499410        1.1251857129       -0.6439498130
   H         -2.7944057690        1.5307831562       -1.1410586055
   H         -1.4354714279        0.8840995024       -1.3053537679
   O         -0.0883376278        2.0347865266        1.0598016973
   H         -0.8742096293        1.8629055536        0.5410590169
   H         -0.0446670113        1.3054188436        1.6781442401
   O          1.9577082483       -1.0696699493        0.5427006194
   H          2.1111686689       -0.2191772837        0.1311863853
   H          1.4283912446       -0.8705865900        1.3149837059
   O          0.0384786648       -0.3734875057        2.4254906700
   H         -0.1748778514       -0.6494139569        3.3168802765
   H         -0.6556213342       -0.7506213190        1.8849103168
   O         -1.7733767539       -1.2965761355        0.6673565192
   H         -1.2250556729       -1.7396120361        0.0198265795
   H         -2.0557692576       -0.4919800249        0.2324870990
   O          1.8853211726        1.4258768637       -0.6606192820
   H          2.5077769554        2.1486450184       -0.7405369455
   H          1.2310125253        1.7405201345       -0.0368311399
   O         -0.0959938655        0.3314595560       -2.2698588579
   H         -0.0107324009       -0.5942615613       -2.0418177748
   H          0.6708741377        0.7472930630       -1.8758692639
    24
 Energy=    -305.518219525013
   O          0.1609716903       -2.1765661026       -1.1220669316
   H          0.4608041763       -3.0304428002       -1.4338792239
   H          0.8603894820       -1.8733331350       -0.5431918501
   O         -2.0849561936        1.1245928539       -0.6432711105
   H         -2.7931813611        1.5353988746       -1.1391414217
   H         -1.4369124124        0.8835986932       -1.3052325234
   O         -0.0885115851        2.0343423765        1.0586016914
   H         -0.8743030527        1.8612686180        0.5401336754
   H         -0.0442357230        1.3057273856        1.6777879986
   O          1.9571820593       -1.0700109391        0.5434853709
   H          2.1105956785       -0.2196313314        0.1317201171
   H          1.4274455863       -0.8707838490        1.3154437090
   O          0.0387179997       -0.3725914241        2.4263989868
   H         -0.1753234542       -0.6472553647        3.3180142714
   H         -0.6551016499       -0.7502865751        1.8858506479
   O         -1.7720035944       -1.2974621326        0.6677772953
   H         -1.2236906472       -1.7395422778        0.0195875876
   H         -2.0562403511       -0.4933120462        0.2332845511
   O          1.8858225713        1.4249580275       -0.6609622890
   H          2.5104140541        2.1462099957       -0.7378577897
   H          1.2311174256        1.7398709049       -0.0377264654
   O         -0.0972501198        0.3325773077       -2.2702590374
   H         -0.0114384815       -0.5932680450       -2.0429297924
   H          0.6700954864        0.7483414777       -1.8771271059
    24
 Energy=    -305.515989534303
   O          0.1628836628       -2.1782580933       -1.1242613616
   H          0.4648301589       -3.0314244236       -1.4359781662
   H          0.8610564928       -1.8737125495       -0.5445730390
   O         -2.0872151875        1.1189865065       -0.6457273939
   H         -2.7928627258        1.5330251382       -1.1425829093
   H         -1.4364132462        0.8809363517       -1.3060461026
   O         -0.0933267307        2.0350089901        1.0573349885
   H         -0.8785715079        1.8599608322        0.5387015706
   H         -0.0478254253        1.3069599243        1.6770978697
   O          1.9555263084       -1.0683165016        0.5427694411
   H          2.1114529419       -0.2177283896        0.1323811023
   H          1.4277476737       -0.8685965900        1.3159405151
   O          0.0384798833       -0.3697658286        2.4273145308
   H         -0.1768349146       -0.6435846275        3.3188831727
   H         -0.6535069877       -0.7495745951        1.8858985066
   O         -1.7680351063       -1.3007572260        0.6686965665
   H         -1.2211874960       -1.7434740987        0.0197040382
   H         -2.0555682694       -0.4984080192        0.2330450195
   O          1.8853769847        1.4290499857       -0.6578254694
   H          2.5056037010        2.1536828592       -0.7381862752
   H          1.2291694772        1.7427110301       -0.0355391235
   O         -0.0937856322        0.3336157435       -2.2684902329
   H         -0.0081182073       -0.5926556779       -2.0428485123
   H          0.6725614123        0.7488656133       -1.8728747717
    24
 Energy=    -305.510515558898
   O          0.1634554890       -2.1793318780       -1.1265905845
   H          0.4678150179       -3.0316501645       -1.4382805837
   H          0.8607691590       -1.8727883162       -0.5469212559
   O         -2.0907153401        1.1187821706       -0.6476707271
   H         -2.7955370241        1.5342926003       -1.1444697977
   H         -1.4403664793        0.8795708581       -1.3080162028
   O         -0.0977474348        2.0332905210        1.0561410574
   H         -0.8818570829        1.8561040122        0.5365173080
   H         -0.0514261199        1.3057283771        1.6764147893
   O          1.9558344574       -1.0670901002        0.5430240785
   H          2.1124434906       -0.2157029014        0.1345570804
   H          1.4299067985       -0.8684785626        1.3177404102
   O          0.0398357789       -0.3693285943        2.4293782830
   H         -0.1753342761       -0.6432730920        3.3209432552
   H         -0.6517635381       -0.7497766671        1.8879159217
   O         -1.7646025745       -1.3005685684        0.6683749294
   H         -1.2177929294       -1.7436739840        0.0196156192
   H         -2.0527308261       -0.4988198418        0.2320116291
   O          1.8849594208        1.4303147324       -0.6545692429
   H          2.5017075133        2.1577172748       -0.7366617008
   H          1.2262407322        1.7430089717       -0.0344532521
   O         -0.0911225307        0.3334330070       -2.2682082074
   H         -0.0047725459       -0.5931096980       -2.0439446660
   H          0.6743418539        0.7488304907       -1.8710419368
    24
 Energy=    -305.508689351397
   O          0.1674822782       -2.1788677266       -1.1253884314
   H          0.4748004561       -3.0291470932       -1.4397327907
   H          0.8638693141       -1.8715715424       -0.5450040834
   O         -2.0893727005        1.1151092673       -0.6505997665
   H         -2.7953913513        1.5269472136       -1.1487553755
   H         -1.4381919439        0.8758982101       -1.3101249991
   O         -0.1023115043        2.0331989601        1.0565196997
   H         -0.8853946161        1.8535275030        0.5362016744
   H         -0.0544005370        1.3059443221        1.6770332537
   O          1.9555932205       -1.0653790758        0.5425816693
   H          2.1153307882       -0.2139262602        0.1354651600
   H          1.4318924014       -0.8658846311        1.3185786143
   O          0.0394506692       -0.3702990262        2.4300292728
   H         -0.1754964912       -0.6461270036        3.3210671424
   H         -0.6510942232       -0.7513868186        1.8876717467
   O         -1.7636570248       -1.3018789810        0.6680710963
   H         -1.2158227661       -1.7441188300        0.0195856446
   H         -2.0529837136       -0.5006761107        0.2314982297
   O          1.8828453818        1.4349925821       -0.6527785601
   H          2.4931260350        2.1672088373       -0.7402355211
   H          1.2229801474        1.7453087687       -0.0326869727
   O         -0.0902701802        0.3326278386       -2.2682974652
   H         -0.0031958497       -0.5935397972       -2.0427682844
   H          0.6738101121        0.7494818163       -1.8699936765
    24
 Energy=    -305.505626577580
   O          0.1686113968       -2.1785890025       -1.1251215799
   H          0.4770629974       -3.0279250214       -1.4409027969
   H          0.8647249874       -1.8712087444       -0.5444537867
   O         -2.0890444357        1.1128974073       -0.6512400470
   H         -2.7958373801        1.5223512834       -1.1502621879
   H         -1.4371864516        0.8739828542       -1.3102035095
   O         -0.1037265585        2.0336651675        1.0573527097
   H         -0.8865634522        1.8531809420        0.5369454825
   H         -0.0551079167        1.3064386002        1.6778441178
   O          1.9560606382       -1.0642442642        0.5429680976
   H          2.1175129586       -0.2129601668        0.1361753079
   H          1.4332393069       -0.8639343167        1.3193479147
   O          0.0388294032       -0.3702056264        2.4299081586
   H         -0.1763015194       -0.6474633340        3.3204578146
   H         -0.6513271749       -0.7508354585        1.8867353790
   O         -1.7636974294       -1.3033662468        0.6679763798
   H         -1.2151845808       -1.7458400873        0.0202245790
   H         -2.0532655994       -0.5027403059        0.2305061321
   O          1.8816513094        1.4371934112       -0.6526564816
   H          2.4887623664        2.1717163697       -0.7427898710
   H          1.2217053679        1.7460902036       -0.0319424042
   O         -0.0890177244        0.3321813110       -2.2688792223
   H         -0.0010204139       -0.5936894934       -2.0424911335
   H          0.6741209108        0.7503221609       -1.8701192779
    24
 Energy=    -305.503439545056
   O          0.1692230888       -2.1785840496       -1.1247469077
   H          0.4781751161       -3.0273412923       -1.4415932866
   H          0.8652692465       -1.8714074117       -0.5438905575
   O         -2.0885506462        1.1112851948       -0.6514245586
   H         -2.7957502510        1.5188274563       -1.1514344226
   H         -1.4354991058        0.8733779257       -1.3095701785
   O         -0.1045381547        2.0342787150        1.0582584022
   H         -0.8873649755        1.8535604174        0.5379172588
   H         -0.0555528302        1.3069758524        1.6786315350
   O          1.9561421067       -1.0633339057        0.5431446323
   H          2.1188375482       -0.2122756157        0.1363746477
   H          1.4337475408       -0.8622658845        1.3196157576
   O          0.0385167741       -0.3699346545        2.4298835268
   H         -0.1766860009       -0.6480009614        3.3201636708
   H         -0.6512063175       -0.7506526642        1.8862221486
   O         -1.7639487363       -1.3046003884        0.6676882182
   H         -1.2150023760       -1.7470250916        0.0202701805
   H         -2.0536750399       -0.5042122157        0.2298877134
   O          1.8809811188        1.4387302605       -0.6533790698
   H          2.4862092766        2.1745599819       -0.7454949651
   H          1.2215165875        1.7467826487       -0.0317343979
   O         -0.0882757048        0.3317013300       -2.2690249463
   H         -0.0003388191       -0.5939248636       -2.0416154174
   H          0.6745228582        0.7503416853       -1.8701384395
    24
 Energy=    -305.501729627622
   O          0.1694391914       -2.1785817146       -1.1245299522
   H          0.4785509995       -3.0271129121       -1.4418256142
   H          0.8654606077       -1.8715481053       -0.5435683435
   O         -2.0882894216        1.1107129455       -0.6513978872
   H         -2.7955238383        1.5174960906       -1.1519763454
   H         -1.4345290336        0.8733530820       -1.3090372186
   O         -0.1051998613        2.0346853576        1.0589601522
   H         -0.8880216364        1.8538460863        0.5386534481
   H         -0.0560551589        1.3073716090        1.6793079171
   O          1.9563015046       -1.0629963624        0.5433414667
   H          2.1195068831       -0.2120540857        0.1365330520
   H          1.4340462814       -0.8615781182        1.3198155569
   O          0.0387087810       -0.3697557839        2.4300061102
   H         -0.1766573247       -0.6482084793        3.3201259768
   H         -0.6507908547       -0.7504221670        1.8860252309
   O         -1.7643848514       -1.3051353249        0.6672258095
   H         -1.2152709064       -1.7475373459        0.0199344013
   H         -2.0542266625       -0.5048694197        0.2292782720
   O          1.8809225955        1.4391830684       -0.6540460850
   H          2.4853689437        2.1755628942       -0.7468965258
   H          1.2217371765        1.7467629695       -0.0318716498
   O         -0.0880090652        0.3314380214       -2.2691182625
   H         -0.0001516498       -0.5940902780       -2.0412799830
   H          0.6747342079        0.7502248670       -1.8702798023
    24
 Energy=    -305.495309258119
   O          0.1686329707       -2.1798213185       -1.1250737839
   H          0.4791865996       -3.0270507530       -1.4444334073
   H          0.8645069295       -1.8726374500       -0.5440149707
   O         -2.0885730013        1.1072308924       -0.6506386373
   H         -2.7985940565        1.5079876764       -1.1521323474
   H         -1.4332841817        0.8726912506       -1.3077684262
   O         -0.1048929076        2.0351850481        1.0586273253
   H         -0.8879434882        1.8552877585        0.5383383735
   H         -0.0558823280        1.3071303139        1.6781159103
   O          1.9543808150       -1.0594531297        0.5423945027
   H          2.1197835704       -0.2085092161        0.1364779788
   H          1.4329914656       -0.8574622433        1.3193016195
   O          0.0376214925       -0.3681918925        2.4304792402
   H         -0.1758596541       -0.6463995996        3.3211296271
   H         -0.6507176660       -0.7524378318        1.8875463705
   O         -1.7627766913       -1.3085938130        0.6685754599
   H         -1.2129897058       -1.7499610940        0.0211489900
   H         -2.0520036997       -0.5075325315        0.2316768435
   O          1.8805088991        1.4430454709       -0.6552908130
   H          2.4824542937        2.1808712388       -0.7527932133
   H          1.2222737402        1.7510414141       -0.0323166446
   O         -0.0855743173        0.3301511970       -2.2686733359
   H          0.0003670209       -0.5948752483       -2.0380827857
   H          0.6764750018        0.7490170410       -1.8685932440
    24
 Energy=    -305.489348080423
   O          0.1679355294       -2.1806306010       -1.1258650233
   H          0.4796105975       -3.0270658978       -1.4462363395
   H          0.8637908496       -1.8728210223       -0.5451150972
   O         -2.0886595811        1.1043357017       -0.6501194911
   H         -2.8019069143        1.5005140580       -1.1506719774
   H         -1.4343104241        0.8707021218       -1.3085071968
   O         -0.1049131248        2.0352215013        1.0574547872
   H         -0.8883169092        1.8566814124        0.5372300404
   H         -0.0564067356        1.3064188810        1.6761030805
   O          1.9514105724       -1.0570851152        0.5406725930
   H          2.1177556294       -0.2056969108        0.1360749072
   H          1.4307402249       -0.8556668384        1.3182103136
   O          0.0374483944       -0.3661769662        2.4318503387
   H         -0.1741466014       -0.6436667022        3.3231745469
   H         -0.6502143403       -0.7535470093        1.8902820115
   O         -1.7615835390       -1.3113762608        0.6699728038
   H         -1.2114760768       -1.7521049399        0.0223835424
   H         -2.0498239231       -0.5094221093        0.2340612761
   O          1.8821270947        1.4453527806       -0.6558994762
   H          2.4827013374        2.1839564694       -0.7559345202
   H          1.2236088058        1.7540792069       -0.0335864546
   O         -0.0843235932        0.3299465011       -2.2677950311
   H          0.0006855996       -0.5948358516       -2.0358836746
   H          0.6766408337        0.7490744666       -1.8659284741
    24
 Energy=    -305.484262263661
   O          0.1678304583       -2.1809242465       -1.1262954169
   H          0.4798939556       -3.0271047902       -1.4469614442
   H          0.8637520265       -1.8727838152       -0.5458003822
   O         -2.0886987629        1.1029344341       -0.6502653838
   H         -2.8035307645        1.4974176198       -1.1498953126
   H         -1.4353980510        0.8692641490       -1.3096804411
   O         -0.1042194442        2.0348292630        1.0563578900
   H         -0.8878590927        1.8569959298        0.5362463184
   H         -0.0559309952        1.3056541715        1.6745841848
   O          1.9495692117       -1.0560975400        0.5394592725
   H          2.1161707267       -0.2044287554        0.1355582245
   H          1.4292726179       -0.8551246767        1.3173623530
   O          0.0367584388       -0.3652323854        2.4323954146
   H         -0.1738730100       -0.6423761681        3.3240554151
   H         -0.6507582032       -0.7538843100        1.8915605151
   O         -1.7604304429       -1.3125967894        0.6711646294
   H         -1.2101919966       -1.7531013887        0.0235341868
   H         -2.0480766810       -0.5101887706        0.2356960851
   O          1.8826481992        1.4465738271       -0.6555335677
   H          2.4827368917        2.1854352123       -0.7565744239
   H          1.2237305363        1.7558370336       -0.0339101908
   O         -0.0839067119        0.3300988414       -2.2670931461
   H          0.0009493321       -0.5945632399       -2.0346467499
   H          0.6762975720        0.7495853297       -1.8641634091
    24
 Energy=    -305.468929198859
   O          0.1693030107       -2.1804174463       -1.1252744317
   H          0.4826949500       -3.0257151916       -1.4469715784
   H          0.8653238849       -1.8712870448       -0.5454251603
   O         -2.0866172737        1.0998360235       -0.6511061908
   H         -2.8059394173        1.4868983947       -1.1500953835
   H         -1.4342999935        0.8669274076       -1.3117631234
   O         -0.1032931406        2.0358857061        1.0553646917
   H         -0.8870973382        1.8584681508        0.5353590851
   H         -0.0552464813        1.3066272942        1.6735115410
   O          1.9468005718       -1.0566991088        0.5367508412
   H          2.1146761941       -0.2049468920        0.1335538959
   H          1.4264926189       -0.8556244972        1.3146200298
   O          0.0361286862       -0.3638594507        2.4318715102
   H         -0.1732526472       -0.6405519436        3.3239659904
   H         -0.6516962677       -0.7534418256        1.8920991082
   O         -1.7599538161       -1.3142550466        0.6730895456
   H         -1.2103037115       -1.7551198971        0.0252046900
   H         -2.0460505663       -0.5109275863        0.2382959382
   O          1.8826482992        1.4479896686       -0.6548435441
   H          2.4819074989        2.1873447357       -0.7571877486
   H          1.2234292042        1.7575804159       -0.0337029851
   O         -0.0853142694        0.3313266752       -2.2655770727
   H         -0.0007117906       -0.5935192656       -2.0337705878
   H          0.6748407727        0.7503754089       -1.8620993029
    24
 Energy=    -305.457913951077
   O          0.1661294052       -2.1796786174       -1.1275392454
   H          0.4847145883       -3.0222212165       -1.4513559989
   H          0.8615618533       -1.8663285052       -0.5492510324
   O         -2.0877697690        1.0933110448       -0.6447262575
   H         -2.8168321857        1.4615862432       -1.1437986078
   H         -1.4359964363        0.8627201169       -1.3067316855
   O         -0.1031923549        2.0403627881        1.0536245557
   H         -0.8853488014        1.8637212246        0.5308809368
   H         -0.0574232830        1.3104894478        1.6712182240
   O          1.9475642051       -1.0558713818        0.5369439216
   H          2.1190019368       -0.2044513395        0.1345450452
   H          1.4268355726       -0.8534804225        1.3141899772
   O          0.0373051619       -0.3590302219        2.4298295795
   H         -0.1685555722       -0.6348821499        3.3230030856
   H         -0.6517348425       -0.7504458556        1.8929408441
   O         -1.7617859723       -1.3193132032        0.6770931892
   H         -1.2129379348       -1.7627274857        0.0302690664
   H         -2.0443401131       -0.5152766031        0.2412949065
   O          1.8838086354        1.4478583681       -0.6542359868
   H          2.4797531438        2.1895984625       -0.7586563647
   H          1.2234103509        1.7561110471       -0.0336828208
   O         -0.0822476475        0.3328185568       -2.2702152860
   H          0.0034087246       -0.5928416849       -2.0420751032
   H          0.6774963785        0.7511113858       -1.8651819984
    24
 Energy=    -305.433419298214
   O          0.1656451624       -2.1789639237       -1.1267849170
   H          0.4884099747       -3.0189708650       -1.4530410351
   H          0.8604459578       -1.8628375373       -0.5492489420
   O         -2.0852094813        1.0888115482       -0.6431076306
   H         -2.8220611637        1.4387183968       -1.1439535505
   H         -1.4316178024        0.8618631630       -1.3045788603
   O         -0.1036202292        2.0455907139        1.0546771337
   H         -0.8847347989        1.8682180726        0.5306248318
   H         -0.0586988653        1.3162230583        1.6729301029
   O          1.9491360620       -1.0574573823        0.5367370287
   H          2.1239845294       -0.2066586922        0.1344915286
   H          1.4274229130       -0.8532998319        1.3128600374
   O          0.0384273483       -0.3572980180        2.4261801522
   H         -0.1657242497       -0.6325237561        3.3199389329
   H         -0.6517389823       -0.7489422088        1.8909072274
   O         -1.7640022690       -1.3216043931        0.6794020223
   H         -1.2167634911       -1.7667564987        0.0324080789
   H         -2.0439150384       -0.5165433303        0.2437905363
   O          1.8829567763        1.4472605351       -0.6548000665
   H          2.4771013654        2.1902335246       -0.7607018331
   H          1.2230477589        1.7544005589       -0.0331756344
   O         -0.0836384278        0.3347773360       -2.2710321295
   H          0.0016011608       -0.5917313558       -2.0462039804
   H          0.6781216639        0.7507446440       -1.8673929323
    24
 Energy=    -305.410330455320
   O          0.1646901277       -2.1782559707       -1.1261724727
   H          0.4895142611       -3.0171061457       -1.4533597374
   H          0.8589105077       -1.8608529143       -0.5486387475
   O         -2.0834832531        1.0869200735       -0.6427115083
   H         -2.8225678209        1.4302557343       -1.1448135555
   H         -1.4282762886        0.8621739467       -1.3033361007
   O         -0.1055358513        2.0483987657        1.0562024190
   H         -0.8857222686        1.8711307955        0.5307339984
   H         -0.0617870944        1.3189815581        1.6744810160
   O          1.9519531562       -1.0581925979        0.5382292684
   H          2.1283106837       -0.2079635783        0.1354384086
   H          1.4296823530       -0.8527031421        1.3136253811
   O          0.0397050082       -0.3567057662        2.4238636696
   H         -0.1632470959       -0.6313223310        3.3180828965
   H         -0.6507336407       -0.7493637740        1.8896857955
   O         -1.7662236084       -1.3225703865        0.6804996848
   H         -1.2193606920       -1.7678731968        0.0332916828
   H         -2.0462854952       -0.5175498078        0.2449092263
   O          1.8830891419        1.4457517727       -0.6559736623
   H          2.4763922148        2.1893082021       -0.7624966181
   H          1.2237934267        1.7520841015       -0.0333007914
   O         -0.0846328302        0.3360037189       -2.2723912954
   H         -0.0001753073       -0.5910146721       -2.0493763415
   H          0.6785620002        0.7502214709       -1.8696641611
    24
 Energy=    -305.314574950832
   O          0.1619657448       -2.1763703523       -1.1267243211
   H          0.4869527656       -3.0158942922       -1.4520162370
   H          0.8555936951       -1.8581046442       -0.5489535660
   O         -2.0787131819        1.0838728716       -0.6463800127
   H         -2.8129523800        1.4384821346       -1.1477550326
   H         -1.4233684533        0.8591437697       -1.3068737352
   O         -0.1116416259        2.0500964487        1.0593777387
   H         -0.8897444252        1.8755455296        0.5299253326
   H         -0.0717226629        1.3187923525        1.6756833734
   O          1.9582349523       -1.0575785795        0.5450468428
   H          2.1337336314       -0.2082430013        0.1400022413
   H          1.4360998455       -0.8505262981        1.3201185318
   O          0.0406214754       -0.3560875476        2.4214480977
   H         -0.1597653393       -0.6298882913        3.3164956480
   H         -0.6499380278       -0.7512796925        1.8892990761
   O         -1.7696678511       -1.3233861308        0.6828897320
   H         -1.2210637994       -1.7657049009        0.0351092599
   H         -2.0551843326       -0.5202716721        0.2473218900
   O          1.8870573527        1.4405749952       -0.6593871908
   H          2.4785103566        2.1858359502       -0.7642742403
   H          1.2270910807        1.7438462224       -0.0359267489
   O         -0.0881427640        0.3396973003       -2.2746921053
   H         -0.0044284641       -0.5877201021       -2.0530601629
   H          0.6747608758        0.7528828479       -1.8703561315
    24
 Energy=    -305.313084218100
   O          0.1642682646       -2.1820619113       -1.1249345701
   H          0.4950312847       -3.0160882677       -1.4584427431
   H          0.8572977465       -1.8629170159       -0.5469306662
   O         -2.0851967832        1.0881792246       -0.6378861277
   H         -2.8380860026        1.3919331010       -1.1449593432
   H         -1.4248111250        0.8705745809       -1.2957393343
   O         -0.1014452911        2.0525411192        1.0573159751
   H         -0.8834273540        1.8704608412        0.5361800372
   H         -0.0534325390        1.3268301478        1.6796263490
   O          1.9510552600       -1.0594184108        0.5318414858
   H          2.1327992496       -0.2087660502        0.1323524074
   H          1.4271695214       -0.8539038726        1.3061407480
   O          0.0411946095       -0.3567251336        2.4200670509
   H         -0.1633582679       -0.6309333206        3.3140468217
   H         -0.6496286806       -0.7476662708        1.8851277562
   O         -1.7648773787       -1.3229217561        0.6794799468
   H         -1.2223592435       -1.7733297292        0.0321480607
   H         -2.0356485095       -0.5142614717        0.2447577607
   O          1.8765991129        1.4497524912       -0.6551338270
   H          2.4716293776        2.1912272724       -0.7664261123
   H          1.2206853091        1.7600154578       -0.0308375723
   O         -0.0828353962        0.3335360608       -2.2686906114
   H          0.0005466706       -0.5940163520       -2.0474988564
   H          0.6853941971        0.7447340066       -1.8724944713
    24
 Energy=    -305.171991462861
   O          0.1615995785       -2.1976333091       -1.1364841128
   H          0.4957597024       -3.0271026818       -1.4778774510
   H          0.8548679344       -1.8793795024       -0.5582753779
   O         -2.0893261937        1.0895473335       -0.6306824093
   H         -2.8593655079        1.3415411660       -1.1403591724
   H         -1.4265104218        0.8754425946       -1.2872387689
   O         -0.0989648059        2.0568215965        1.0582486805
   H         -0.8887877417        1.8693634730        0.5510297712
   H         -0.0404359959        1.3367120625        1.6861407710
   O          1.9428782202       -1.0546410721        0.5243904012
   H          2.1278123528       -0.1998930431        0.1352413121
   H          1.4189771901       -0.8566346112        1.3006332705
   O          0.0443633346       -0.3602667900        2.4251444567
   H         -0.1664179271       -0.6353238090        3.3174150076
   H         -0.6448759953       -0.7475172520        1.8854982153
   O         -1.7600070753       -1.3136297045        0.6726711579
   H         -1.2222680148       -1.7718371912        0.0268271815
   H         -2.0152507850       -0.4997053791        0.2383789967
   O          1.8856066932        1.4578695683       -0.6590086892
   H          2.4818303878        2.1981271274       -0.7720037879
   H          1.2296679557        1.7709382556       -0.0361409588
   O         -0.0877930210        0.3270151941       -2.2529473652
   H          0.0009895472       -0.5993228268       -2.0287881213
   H          0.6802996299        0.7432665499       -1.8617948011
    24
 Energy=    -305.111419483764
   O          0.1611185024       -2.2016498871       -1.1399470827
   H          0.4953323067       -3.0307230109       -1.4822491838
   H          0.8548097756       -1.8834695904       -0.5622053097
   O         -2.0912930810        1.0896228062       -0.6288169817
   H         -2.8642304345        1.3338080550       -1.1379075944
   H         -1.4291351255        0.8750004844       -1.2858679241
   O         -0.0960992858        2.0569608309        1.0577554900
   H         -0.8876231224        1.8672596923        0.5540340052
   H         -0.0341397479        1.3383676984        1.6870541199
   O          1.9388338979       -1.0527309002        0.5217787359
   H          2.1236361816       -0.1966756441        0.1354506959
   H          1.4153950600       -0.8573272126        1.2989923628
   O          0.0434718528       -0.3605461298        2.4277360410
   H         -0.1697418682       -0.6367465508        3.3190749646
   H         -0.6461327658       -0.7443802517        1.8861193160
   O         -1.7570215101       -1.3121556930        0.6703595728
   H         -1.2207360725       -1.7725543745        0.0248653253
   H         -2.0073183211       -0.4964682224        0.2364963493
   O          1.8860483425        1.4604402988       -0.6591799935
   H          2.4824090371        2.2006333534       -0.7718742871
   H          1.2292899166        1.7739031328       -0.0373751514
   O         -0.0866896545        0.3254127994       -2.2486805971
   H          0.0040653027       -0.6003500603       -2.0229406906
   H          0.6802148520        0.7440564996       -1.8577499507
    24
 Energy=    -305.045326078709
   O          0.1653012009       -2.2005005081       -1.1389255651
   H          0.4969993346       -3.0290755933       -1.4848612761
   H          0.8613453463       -1.8853346534       -0.5623625835
   O         -2.0958536268        1.0910567441       -0.6296153882
   H         -2.8770489516        1.3125463751       -1.1364763631
   H         -1.4367624051        0.8715604123       -1.2881379481
   O         -0.0944671870        2.0545763176        1.0544396756
   H         -0.8910951708        1.8702216395        0.5568162756
   H         -0.0324901553        1.3355399640        1.6832301095
   O          1.9325606207       -1.0559350647        0.5169764494
   H          2.1196672890       -0.1997829506        0.1319745115
   H          1.4079338682       -0.8604575571        1.2933701347
   O          0.0441429181       -0.3579139241        2.4290919300
   H         -0.1680382271       -0.6350164634        3.3203972560
   H         -0.6465309204       -0.7405430973        1.8879852818
   O         -1.7523564014       -1.3119013769        0.6700261898
   H         -1.2165963989       -1.7701356425        0.0225584936
   H         -2.0038913957       -0.4952466320        0.2387061066
   O          1.8925694855        1.4605797524       -0.6610648643
   H          2.4870745477        2.2027811543       -0.7703015342
   H          1.2313336958        1.7717142038       -0.0428461137
   O         -0.0923369563        0.3264404197       -2.2400590552
   H          0.0018686549       -0.5990111994       -2.0144566538
   H          0.6732700305        0.7478022807       -1.8495056480
    24
 Energy=    -304.881967633159
   O          0.1618277472       -2.1978890678       -1.1441620755
   H          0.4899707909       -3.0247097573       -1.4976044756
   H          0.8613793466       -1.8883860778       -0.5687775963
   O         -2.1109082907        1.0985478087       -0.6184890110
   H         -2.9060631419        1.2745193621       -1.1214747116
   H         -1.4563955443        0.8670588248       -1.2774713743
   O         -0.0942516186        2.0454473291        1.0370084646
   H         -0.9010546910        1.8793230512        0.5494601422
   H         -0.0384125732        1.3226506957        1.6620515573
   O          1.9371856614       -1.0585914721        0.5225159303
   H          2.1314817504       -0.2054234904        0.1344627575
   H          1.4080162875       -0.8563903816        1.2940898624
   O          0.0506201759       -0.3534988536        2.4277004764
   H         -0.1539764362       -0.6293404555        3.3211675866
   H         -0.6407516940       -0.7426187485        1.8921423704
   O         -1.7483118701       -1.3104228926        0.6711793982
   H         -1.2099355329       -1.7617378797        0.0210274607
   H         -2.0114126395       -0.4964848624        0.2416276456
   O          1.9019724141        1.4587026839       -0.6574156881
   H          2.4931986707        2.2043141069       -0.7610832312
   H          1.2335246801        1.7658056396       -0.0449638602
   O         -0.0963571913        0.3264355181       -2.2372075614
   H          0.0034903453       -0.5990731231       -2.0142814199
   H          0.6685079351        0.7507962350       -1.8484516478
    24
 Energy=    -304.612413202382
   O          0.1648540317       -2.1884839177       -1.1376850224
   H          0.4899049894       -3.0130227180       -1.4992226855
   H          0.8670848241       -1.8854103061       -0.5621416790
   O         -2.1328150468        1.1036490570       -0.6180623863
   H         -2.9353949408        1.2359793231       -1.1226275995
   H         -1.4743203697        0.8686999279       -1.2718326113
   O         -0.0878519603        2.0410359314        1.0276143104
   H         -0.8988179346        1.8916283829        0.5415655342
   H         -0.0425311957        1.3136770806        1.6482002999
   O          1.9444203450       -1.0671751786        0.5230310111
   H          2.1463349046       -0.2177234573        0.1307375956
   H          1.4104371773       -0.8568867886        1.2891071233
   O          0.0610209859       -0.3464805944        2.4265046676
   H         -0.1351166479       -0.6213204880        3.3221747528
   H         -0.6296442927       -0.7445449907        1.8966386002
   O         -1.7497359038       -1.3122614772        0.6737326892
   H         -1.2079769157       -1.7546796021        0.0202839601
   H         -2.0283312609       -0.5025045317        0.2460527199
   O          1.9089663437        1.4502298921       -0.6577910634
   H          2.4973173664        2.1987070214       -0.7570729902
   H          1.2345621501        1.7540323646       -0.0502428089
   O         -0.1058297067        0.3304445611       -2.2351277904
   H         -0.0034275471       -0.5958983833       -2.0168747563
   H          0.6614542736        0.7539347856       -1.8502081061
    24
 Energy=    -304.347530835433
   O          0.1611336820       -2.1816867312       -1.1344939378
   H          0.4860309423       -3.0027988461       -1.5038833055
   H          0.8639687549       -1.8835773760       -0.5570984817
   O         -2.1511752224        1.1071266628       -0.6249184012
   H         -2.9560322292        1.1977884817       -1.1350335580
   H         -1.4828504757        0.8762526234       -1.2701091100
   O         -0.0846500316        2.0398233372        1.0225825001
   H         -0.8959808679        1.9045642701        0.5330121796
   H         -0.0513511130        1.3080967755        1.6387799205
   O          1.9633158194       -1.0731564575        0.5296479880
   H          2.1717446601       -0.2264200666        0.1348990264
   H          1.4255785919       -0.8569390922        1.2914357308
   O          0.0613238686       -0.3437595632        2.4159415008
   H         -0.1232442409       -0.6166463370        3.3146624039
   H         -0.6304870356       -0.7509973897        1.8946096818
   O         -1.7422236118       -1.3099201300        0.6860945271
   H         -1.1968245522       -1.7419781292        0.0287532224
   H         -2.0373061243       -0.5044823720        0.2613261562
   O          1.9164294715        1.4358482014       -0.6635982764
   H          2.5024059369        2.1865351113       -0.7602035831
   H          1.2389621469        1.7366040320       -0.0579450799
   O         -0.1209003530        0.3384040123       -2.2281194299
   H         -0.0171562454       -0.5887822505       -2.0141226209
   H          0.6504838904        0.7599112559       -1.8492661170
    24
 Energy=    -303.859731923296
   O          0.1691705074       -2.1630550179       -1.1252981262
   H          0.4903122760       -2.9825025909       -1.5016031614
   H          0.8756010342       -1.8702570263       -0.5495750270
   O         -2.1706549586        1.0976488510       -0.6300944281
   H         -2.9709573657        1.1484666187       -1.1527467520
   H         -1.4843355967        0.8841554720       -1.2622480096
   O         -0.0937594362        2.0424821198        1.0089705417
   H         -0.8992678636        1.9192826817        0.5067654920
   H         -0.0767147915        1.3057048673        1.6197901553
   O          1.9807133213       -1.0935621531        0.5458710415
   H          2.1921753092       -0.2457163318        0.1551369490
   H          1.4422875925       -0.8791310424        1.3076773642
   O          0.0731086226       -0.3350160960        2.4065849446
   H         -0.1010558265       -0.6121459931        3.3060834742
   H         -0.6240809464       -0.7406820913        1.8912271609
   O         -1.7440113741       -1.3037189024        0.6891351350
   H         -1.1958633422       -1.7249027783        0.0270401888
   H         -2.0570904568       -0.5033251307        0.2677289912
   O          1.9110900546        1.4192572640       -0.6751110187
   H          2.5008377886        2.1654145319       -0.7831794316
   H          1.2512683279        1.7231763453       -0.0518130796
   O         -0.1240756508        0.3504416130       -2.2152485616
   H         -0.0321471223       -0.5779278047       -2.0009795485
   H          0.6637336044        0.7587474185       -1.8562572154
    24
 Energy=    -303.562499254968
   O          0.1723427192       -2.1574346201       -1.1224963272
   H          0.4913529306       -2.9767967662       -1.5007951490
   H          0.8805495018       -1.8666059863       -0.5479585139
   O         -2.1796269578        1.0875222154       -0.6393352844
   H         -2.9772065657        1.1245385175       -1.1672826325
   H         -1.4860284752        0.8827610088       -1.2664124991
   O         -0.0944438250        2.0460465633        1.0089994905
   H         -0.9020695803        1.9311439787        0.5082302069
   H         -0.0825702714        1.3076633190        1.6179995260
   O          1.9850651800       -1.0999637568        0.5514346959
   H          2.1970882831       -0.2515575554        0.1622240058
   H          1.4466927356       -0.8865509700        1.3135645625
   O          0.0754341246       -0.3335560641        2.4012336212
   H         -0.0954869080       -0.6131212378        3.3006007066
   H         -0.6242557993       -0.7369170988        1.8874576721
   O         -1.7446461209       -1.2996412507        0.6916643451
   H         -1.1956823231       -1.7184309063        0.0287270833
   H         -2.0627318757       -0.5011671774        0.2703658206
   O          1.9148172484        1.4130881468       -0.6805155838
   H          2.5057643915        2.1576689213       -0.7928222368
   H          1.2601716632        1.7188389664       -0.0526721048
   O         -0.1277878444        0.3586705167       -2.2057454375
   H         -0.0391541301       -0.5700697069       -1.9916952057
   H          0.6650940349        0.7628946849       -1.8533635602
    24
 Energy=    -302.177725265843
   O          0.1821988613       -2.1572145961       -1.1190443644
   H          0.5023435873       -2.9765406800       -1.4964618557
   H          0.8897569757       -1.8650942352       -0.5443626704
   O         -2.1186994628        1.0972633777       -0.6357920930
   H         -2.9221026649        1.1434543039       -1.1540985016
   H         -1.4356545255        0.8811683688       -1.2706026165
   O         -0.1277993691        2.0404941388        1.0008434514
   H         -0.9222505618        1.9102787464        0.4830374124
   H         -0.1150136047        1.3026027818        1.6104209359
   O          1.9788951055       -1.1056434725        0.5537882076
   H          2.1885747339       -0.2545494256        0.1692037348
   H          1.4424108861       -0.8977110736        1.3187592135
   O          0.0798280146       -0.3302734689        2.4030707053
   H         -0.0904051873       -0.6060689552        3.3037312112
   H         -0.6193532632       -0.7370558181        1.8913036673
   O         -1.7453907703       -1.3013864899        0.6869338493
   H         -1.1983985652       -1.7112568312        0.0168311177
   H         -2.0675846247       -0.4991435276        0.2760455560
   O          1.8982161607        1.4118383165       -0.6913213866
   H          2.4886791125        2.1569602095       -0.8025810255
   H          1.2505217984        1.7120175446       -0.0536566753
   O         -0.1457943340        0.3605199550       -2.1940100773
   H         -0.0658138571       -0.5678191953       -1.9748722549
   H          0.6510224661        0.7591936180       -1.8441899271
    24
 Energy=    -301.845662457274
   O          0.1804379756       -2.1398152818       -1.1123776993
   H          0.4914620128       -2.9598704972       -1.4957904428
   H          0.8954851420       -1.8544159230       -0.5436188788
   O         -2.2252346949        1.0584684984       -0.6602295857
   H         -3.0051793873        1.0771072628       -1.2148201674
   H         -1.5032337865        0.8945122720       -1.2669130981
   O         -0.0815707144        2.0653602211        1.0034940719
   H         -0.8546766125        1.9363909180        0.4540343106
   H         -0.0892493213        1.3222579290        1.6067948779
   O          2.0101757884       -1.1162667233        0.5607491835
   H          2.2335523614       -0.2758561130        0.1606932465
   H          1.4653382520       -0.8864782906        1.3134650497
   O          0.0894028403       -0.3373880551        2.4067042558
   H         -0.0857915016       -0.6341638049        3.2997120591
   H         -0.6184448570       -0.7154773885        1.8849457548
   O         -1.7405927812       -1.2882587636        0.6964675249
   H         -1.1833730157       -1.7275865778        0.0540276097
   H         -2.0578607350       -0.5065328844        0.2442756019
   O          1.9157954335        1.3929435159       -0.6833767963
   H          2.5218347516        2.1208888396       -0.8213760380
   H          1.2831543754        1.7248406430       -0.0463199475
   O         -0.1538443593        0.3801163510       -2.1973274019
   H         -0.0514959566       -0.5483228244       -1.9881448450
   H          0.6453664703        0.7901502359       -1.8666219392
    24
 Energy=    -300.220724723812
   O          0.1757872139       -2.1291340455       -1.1060116479
   H          0.4785774038       -2.9500505755       -1.4941430582
   H          0.8962193815       -1.8509656716       -0.5404750110
   O         -2.3045039692        1.0090495694       -0.7043188419
   H         -3.0642179841        0.9869209720       -1.2861923511
   H         -1.5536140190        0.8870709722       -1.2852812715
   O         -0.0300427526        2.0784809065        1.0068844223
   H         -0.8486654141        2.0080316961        0.5158389183
   H         -0.0451329584        1.3327837760        1.6068343495
   O          2.0192714872       -1.1195505690        0.5512166290
   H          2.2498135409       -0.2859358938        0.1411327660
   H          1.4695734998       -0.8765980215        1.2962253687
   O          0.0949698475       -0.3375426488        2.4108898717
   H         -0.0819008075       -0.6495368016        3.2983628347
   H         -0.6159769468       -0.7006149477        1.8827184965
   O         -1.7566626683       -1.2831394174        0.6982259624
   H         -1.1952346690       -1.7352303765        0.0684290060
   H         -2.0733546332       -0.5123024151        0.2273243217
   O          1.9664703316        1.3918556307       -0.6632420057
   H          2.5756684877        2.1153386912       -0.8104891032
   H          1.3264736252        1.7396378614       -0.0422077265
   O         -0.1708464129        0.4025545155       -2.1778504980
   H         -0.0559994208       -0.5272366610       -1.9815589378
   H          0.6266816792        0.8175043342       -1.8492208732
    24
 Energy=    -298.384005551681
   O          0.1594979558       -2.1222618565       -1.1060525263
   H          0.4569181381       -2.9432760338       -1.4981096596
   H          0.8829572509       -1.8499650338       -0.5415235822
   O         -2.3787895908        0.9747123465       -0.7354861795
   H         -3.1170968560        0.9125482856       -1.3415141093
   H         -1.6042342696        0.8879361004       -1.2911531457
   O          0.0062976961        2.0851676439        1.0090764679
   H         -0.8606327413        2.0872127435        0.6032941687
   H         -0.0107770234        1.3386075734        1.6078989417
   O          2.0275249205       -1.1143124165        0.5450432131
   H          2.2611595971       -0.2841981372        0.1296434523
   H          1.4755021142       -0.8648106986        1.2861582879
   O          0.0840500461       -0.3417617101        2.4003924768
   H         -0.0895788573       -0.6641652148        3.2847797359
   H         -0.6310182848       -0.6953574256        1.8713563796
   O         -1.7571639581       -1.2815517384        0.7107219103
   H         -1.1936813141       -1.7412647089        0.0883208060
   H         -2.0730215348       -0.5169988241        0.2291363285
   O          2.0224232200        1.3901026372       -0.6484578381
   H          2.6297090093        2.1148370954       -0.7974403040
   H          1.3689467685        1.7446512907       -0.0455518589
   O         -0.1686294254        0.4191843211       -2.1613917315
   H         -0.0440222040       -0.5119338054       -1.9777510094
   H          0.6254963812        0.8377091581       -1.8290771153
    24
 Energy=    -296.539003950174
   O          0.1490784647       -2.1188360234       -1.1046260927
   H          0.4403646676       -2.9405075864       -1.4998981896
   H          0.8756065078       -1.8528240403       -0.5410424987
   O         -2.4315775661        0.9425269257       -0.7490330715
   H         -3.1495653918        0.8394674416       -1.3736161845
   H         -1.6390137590        0.8818078961       -1.2823131585
   O          0.0334740395        2.0753190830        1.0002395375
   H         -0.8718372892        2.1623629013        0.7017992390
   H          0.0180475035        1.3286608884        1.5989843934
   O          2.0207182823       -1.1102151528        0.5378883026
   H          2.2546501756       -0.2815460643        0.1197791650
   H          1.4678224408       -0.8581735163        1.2774916030
   O          0.0878661695       -0.3360669112        2.3933880829
   H         -0.0840835701       -0.6667482111        3.2750427800
   H         -0.6273460706       -0.6859846017        1.8621057649
   O         -1.7771908754       -1.2820339614        0.7079319032
   H         -1.2135947410       -1.7428816083        0.0864733900
   H         -2.0952641228       -0.5199127676        0.2239561442
   O          2.0689539848        1.3979918901       -0.6315545364
   H          2.6737130056        2.1250460629       -0.7795092475
   H          1.4000309975        1.7570738962       -0.0486017168
   O         -0.1549345711        0.4374058057       -2.1444380206
   H         -0.0304206303       -0.4956630390       -1.9709138155
   H          0.6386834274        0.8523558564       -1.8064753483
    24
 Energy=    -294.602592766885
   O          0.1318003563       -2.1176531335       -1.1089195483
   H          0.4207108423       -2.9389180283       -1.5067719628
   H          0.8586202607       -1.8561084719       -0.5436240003
   O         -2.4586519457        0.9220188680       -0.7606054264
   H         -3.1567823405        0.7766902727       -1.3991392088
   H         -1.6517074512        0.8813149066       -1.2738457312
   O          0.0448873235        2.0626579136        0.9864541333
   H         -0.8783852809        2.2402172255        0.8068094039
   H          0.0335765743        1.3161006081        1.5854166501
   O          2.0167138252       -1.1033471956        0.5310582092
   H          2.2492715629       -0.2750792668        0.1113905113
   H          1.4638179508       -0.8507969779        1.2704879757
   O          0.0746679731       -0.3383860592        2.3780994834
   H         -0.0895698746       -0.6706750269        3.2606196313
   H         -0.6403402528       -0.6944827212        1.8506620518
   O         -1.7872952472       -1.2836717002        0.7153643723
   H         -1.2253678650       -1.7372650740        0.0870949170
   H         -2.1126133629       -0.5200098734        0.2386877755
   O          2.1144617027        1.4077497201       -0.6194198081
   H          2.7144143793        2.1396334370       -0.7630681663
   H          1.4302668192        1.7657585311       -0.0537883975
   O         -0.1395686392        0.4536335973       -2.1185440238
   H         -0.0254231709       -0.4820029640       -1.9518500612
   H          0.6572656297        0.8575912536       -1.7748796527
    24
 Energy=    -292.572708173522
   O          0.1175269366       -2.1138568584       -1.1111943754
   H          0.4055940209       -2.9347323154       -1.5104595493
   H          0.8436582508       -1.8552308547       -0.5436754376
   O         -2.4842965142        0.9163007540       -0.7527451719
   H         -3.1542958906        0.7299300022       -1.4104674677
   H         -1.6592875252        0.8941497556       -1.2376176721
   O          0.0450023230        2.0463924780        0.9680081925
   H         -0.8726487808        2.3112125353        0.9046155364
   H          0.0384490896        1.2995570593        1.5666948823
   O          2.0056416951       -1.0982115139        0.5220079724
   H          2.2332295787       -0.2667927218        0.1058608982
   H          1.4549827347       -0.8517994181        1.2651685394
   O          0.0669831727       -0.3329937280        2.3682047889
   H         -0.0868455648       -0.6636950422        3.2531936025
   H         -0.6465613596       -0.7010872476        1.8470587428
   O         -1.8038591133       -1.2964101166        0.7126738171
   H         -1.2464864319       -1.7344573575        0.0694925450
   H         -2.1407628397       -0.5268974932        0.2537859860
   O          2.1455588134        1.4116407087       -0.6186183839
   H          2.7375476049        2.1514010694       -0.7547643331
   H          1.4486871815        1.7610092488       -0.0631515605
   O         -0.0962395016        0.4674976955       -2.0929310407
   H         -0.0051096447       -0.4706017866       -1.9259084353
   H          0.7087645887        0.8522838576       -1.7463190617
    24
 Energy=    -290.194028807122
   O          0.1058182149       -2.1186714261       -1.1208441724
   H          0.3945728879       -2.9391901333       -1.5203458996
   H          0.8307137857       -1.8608740815       -0.5513718022
   O         -2.4930907697        0.9039685572       -0.7496714407
   H         -3.1423136550        0.6788925551       -1.4160664276
   H         -1.6571299483        0.8934247616       -1.2158153813
   O          0.0537019070        2.0218264285        0.9492166693
   H         -0.8397123282        2.3632795207        0.9873300558
   H          0.0508042739        1.2746970495        1.5475653426
   O          1.9900348054       -1.0948935435        0.5289215126
   H          2.2059747998       -0.2533206111        0.1272291449
   H          1.4464666706       -0.8682123488        1.2834950073
   O          0.0544035490       -0.3268932199        2.3388951333
   H         -0.0835778308       -0.6505870869        3.2290722277
   H         -0.6573430239       -0.7144979597        1.8295708539
   O         -1.8177492865       -1.2954982587        0.7144913089
   H         -1.2664113128       -1.7100277412        0.0508471369
   H         -2.1699755712       -0.5175539657        0.2820896884
   O          2.1601678238        1.4172221851       -0.6245411887
   H          2.7389975650        2.1695102389       -0.7480347304
   H          1.4497361267        1.7486533063       -0.0752943811
   O         -0.0572081293        0.4917432497       -2.0507591830
   H          0.0041598770       -0.4480064618       -1.8794807914
   H          0.7577878502        0.8529494001       -1.7021282743
    24
 Energy=    -286.224467592419
   O          0.1122866011       -2.1183227768       -1.1161642812
   H          0.4026511885       -2.9387379800       -1.5147105655
   H          0.8354200318       -1.8600023786       -0.5446921006
   O         -2.4378363291        0.9020237888       -0.7358637166
   H         -3.0458290890        0.6499252659       -1.4308622625
   H         -1.5798589011        0.9135770670       -1.1600960760
   O          0.0158545437        2.0185395659        0.9441359158
   H         -0.8470712347        2.4164872459        1.0591515014
   H          0.0166620031        1.2704490479        1.5412889657
   O          1.9686580781       -1.1083992123        0.5199521451
   H          2.1749609528       -0.2585500579        0.1308154357
   H          1.4311553638       -0.8985202846        1.2836755948
   O          0.0532732071       -0.3161137604        2.3403137390
   H         -0.0707369837       -0.6322621961        3.2352458476
   H         -0.6538639802       -0.7248992652        1.8412313315
   O         -1.8482271442       -1.3033607310        0.6932731435
   H         -1.3053594529       -1.6882284498        0.0052300134
   H         -2.2189810822       -0.5162120202        0.2943116610
   O          2.1924448315        1.4144823981       -0.6619789572
   H          2.7579757257        2.1790265892       -0.7709689920
   H          1.4721774862        1.7250139267       -0.1133288309
   O         -0.0622563971        0.5081714342       -2.0072569995
   H         -0.0393804995       -0.4310278907       -1.8239180747
   H          0.7629202121        0.8416300769       -1.6549492686
    24
 Energy=    -284.481750445532
   O          0.1170775812       -2.1264404080       -1.1231475917
   H          0.4083250667       -2.9475512064       -1.5196117123
   H          0.8401913219       -1.8655717084       -0.5528092012
   O         -2.4127726994        0.9360784311       -0.6774073971
   H         -2.9418707402        0.7006930972       -1.4395627932
   H         -1.5181661483        0.9897057206       -1.0136142866
   O         -0.0216694607        2.0267175234        0.9589052297
   H         -0.8818872376        2.4283517446        1.0811638439
   H         -0.0193789225        1.2780985193        1.5553917594
   O          1.9661637533       -1.1094995501        0.5259433527
   H          2.1729635862       -0.2599890281        0.1363313122
   H          1.4286477182       -0.8988886773        1.2894559016
   O          0.0512971538       -0.3164658454        2.3316223500
   H         -0.0701267882       -0.6314510150        3.2273189556
   H         -0.6541237378       -0.7300642000        1.8340787773
   O         -1.8407719224       -1.3098051407        0.6980127485
   H         -1.2991959894       -1.6897368529        0.0062185284
   H         -2.2120028687       -0.5196465401        0.3054967483
   O          2.1805211532        1.3979251027       -0.6954650437
   H          2.7535061244        2.1563400912       -0.8082780217
   H          1.4670104831        1.7163444777       -0.1425243008
   O         -0.0530140947        0.4942540904       -2.0447394562
   H         -0.0337978618       -0.4420143853       -1.8465882062
   H          0.7706025631        0.8311527069       -1.6920543796
    24
 Energy=    -283.212853048143
   O          0.1206681785       -2.1280340884       -1.1211171063
   H          0.4120581830       -2.9491793204       -1.5174051496
   H          0.8439293763       -1.8666782662       -0.5511888530
   O         -2.4023029578        0.9473549339       -0.6575193569
   H         -2.9210465841        0.7310306451       -1.4323359108
   H         -1.5026234263        1.0044212185       -0.9793143534
   O         -0.0566314765        2.0398173815        0.9817737421
   H         -0.9319699619        2.4164051281        1.0723057535
   H         -0.0545798785        1.2911976155        1.5782601853
   O          1.9731287993       -1.1107470473        0.5248575638
   H          2.1847154534       -0.2654349471        0.1287384137
   H          1.4325319308       -0.8915552888        1.2837658842
   O          0.0544811432       -0.3178535887        2.3378010716
   H         -0.0712322760       -0.6339903558        3.2324996357
   H         -0.6505692600       -0.7281481379        1.8370075494
   O         -1.8365850677       -1.3063404858        0.6982532094
   H         -1.2918427205       -1.6958900102        0.0143388996
   H         -2.2029493455       -0.5197006150        0.2942646333
   O          2.2044185976        1.3916766029       -0.7074962885
   H          2.7833325934        2.1448530419       -0.8250363969
   H          1.4950408624        1.7183038395       -0.1540256776
   O         -0.0716731443        0.4764960347       -2.0799776265
   H         -0.0387196758       -0.4593898533       -1.8818273972
   H          0.7458595733        0.8258394206       -1.7252505563
    24
 Energy=    -283.080282859222
   O          0.1198921422       -2.1276652797       -1.1213008158
   H          0.4115148291       -2.9487245012       -1.5175959120
   H          0.8430228341       -1.8661795181       -0.5512665721
   O         -2.4013556638        0.9501466335       -0.6555712002
   H         -2.9175555384        0.7357999083       -1.4326329807
   H         -1.5006838222        1.0084675208       -0.9743512936
   O         -0.0599027669        2.0417976971        0.9836236540
   H         -0.9362893835        2.4165070470        1.0717782979
   H         -0.0578705638        1.2931717699        1.5801024309
   O          1.9748696232       -1.1108503819        0.5245039508
   H          2.1870741706       -0.2661268553        0.1274608376
   H          1.4338479655       -0.8904769222        1.2827670610
   O          0.0537307668       -0.3187605141        2.3389464645
   H         -0.0723815853       -0.6350783163        3.2335248918
   H         -0.6513787519       -0.7285805231        1.8378477049
   O         -1.8347899311       -1.3074120397        0.6992579157
   H         -1.2895768890       -1.6986568978        0.0166877436
   H         -2.2002763019       -0.5213715863        0.2933121577
   O          2.2073503151        1.3914442542       -0.7079833623
   H          2.7867564911        2.1441575452       -0.8260639478
   H          1.4983974527        1.7188224699       -0.1544120635
   O         -0.0746063923        0.4735485347       -2.0846543194
   H         -0.0395705605       -0.4623445695       -1.8868958104
   H          0.7419601618        0.8246309627       -1.7294191418
    24
 Energy=    -282.560963411504
   O          0.1153001803       -2.1269734535       -1.1296388102
   H          0.4075000785       -2.9483323436       -1.5248863696
   H          0.8382710437       -1.8642222527       -0.5599838470
   O         -2.3883765190        0.9781099563       -0.6044343900
   H         -2.8033549946        0.7726614664       -1.4421787560
   H         -1.4611613523        1.0863451296       -0.8160685599
   O         -0.0427970178        2.0386390096        0.9641027337
   H         -0.8941826185        2.4529974563        1.1043934195
   H         -0.0394306357        1.2894547397        1.5598740297
   O          1.9744434155       -1.1110135005        0.5186735851
   H          2.1885375105       -0.2689936678        0.1169296869
   H          1.4317046986       -0.8853752220        1.2741561411
   O          0.0470443173       -0.3212695083        2.3402947274
   H         -0.0780660342       -0.6406337585        3.2339309597
   H         -0.6560752777       -0.7327361191        1.8377512931
   O         -1.8261573060       -1.3266892618        0.7014367398
   H         -1.2821232016       -1.7185471099        0.0182777832
   H         -2.1889131582       -0.5386997122        0.2968227245
   O          2.1608581583        1.3930622265       -0.6973167133
   H          2.7476867766        2.1385257868       -0.8243918606
   H          1.4608534910        1.7311577064       -0.1388216351
   O         -0.0646303132        0.4626535374       -2.1215159976
   H         -0.0350367332       -0.4712063310       -1.9135212716
   H          0.7528317593        0.8133001406       -1.7679137356
    24
 Energy=    -281.623368373598
   O          0.1108163828       -2.1263737224       -1.1379638106
   H          0.4035950790       -2.9480295782       -1.5321644316
   H          0.8336242307       -1.8623594614       -0.5686860884
   O         -2.3743917462        1.0054056956       -0.5538846346
   H         -2.6833352829        0.8212819687       -1.4409495613
   H         -1.4352280453        1.1607421740       -0.6542537598
   O         -0.0268330442        2.0356439953        0.9453019674
   H         -0.8481864600        2.4885935477        1.1362132277
   H         -0.0223406508        1.2858520817        1.5403009125
   O          1.9738530275       -1.1112372101        0.5129157888
   H          2.1897461622       -0.2718604392        0.1066293986
   H          1.4294741419       -0.8805294955        1.2656822993
   O          0.0404384428       -0.3236665514        2.3414898790
   H         -0.0835923261       -0.6460086847        3.2342069437
   H         -0.6606537314       -0.7368872256        1.8375550840
   O         -1.8177708799       -1.3456762579        0.7034736497
   H         -1.2749286931       -1.7380140444        0.0196423389
   H         -2.1778970449       -0.5557406846        0.3003077096
   O          2.1154218675        1.3945036619       -0.6873193444
   H          2.7093510660        2.1327526930       -0.8232175245
   H          1.4243051369        1.7430156302       -0.1241773439
   O         -0.0550517413        0.4517209941       -2.1584254399
   H         -0.0308228026       -0.4799669103       -1.9402455895
   H          0.7631722760        0.8020287448       -1.8062525032
    24
 Energy=    -280.983302978628
   O          0.1078536093       -2.1261701200       -1.1441318863
   H          0.4010448452       -2.9480537268       -1.5375503354
   H          0.8305495802       -1.8612253756       -0.5751444908
   O         -2.3622584294        1.0250125192       -0.5159038760
   H         -2.5897018261        0.8651767324       -1.4318481224
   H         -1.4237680792        1.2127425262       -0.5309087745
   O         -0.0179735251        2.0338706108        0.9334730659
   H         -0.8134375024        2.5150628303        1.1613391420
   H         -0.0127802272        1.2835980522        1.5278601093
   O          1.9728071843       -1.1116394390        0.5088976551
   H          2.1897243177       -0.2739332962        0.0997189464
   H          1.4274257418       -0.8777782384        1.2599634718
   O          0.0358687331       -0.3250672428        2.3419094957
   H         -0.0871766326       -0.6494481418        3.2340242363
   H         -0.6636055325       -0.7399420053        1.8370862363
   O         -1.8123153407       -1.3589659032        0.7045360737
   H         -1.2703878787       -1.7513242050        0.0199913864
   H         -2.1707604716       -0.5675686925        0.3027408733
   O          2.0850404085        1.3949461152       -0.6821536882
   H          2.6835762352        2.1283449929       -0.8239732574
   H          1.3999840468        1.7503072784       -0.1158957390
   O         -0.0491067348        0.4434399232       -2.1861538609
   H         -0.0286550825       -0.4865580095       -1.9605049851
   H          0.7693139832        0.7937758639       -1.8344663619
    24
 Energy=    -280.826432919823
   O          0.1071691212       -2.1263754728       -1.1462794693
   H          0.4005058176       -2.9483376682       -1.5394252079
   H          0.8298221954       -1.8611090696       -0.5773874676
   O         -2.3563952622        1.0313256802       -0.5019413802
   H         -2.5544078844        0.8819668284       -1.4264492356
   H         -1.4201570062        1.2299158644       -0.4860761154
   O         -0.0181119416        2.0337667281        0.9317293361
   H         -0.8034610635        2.5250499477        1.1727674969
   H         -0.0127024001        1.2833175122        1.5258913941
   O          1.9719064411       -1.1120115425        0.5077407027
   H          2.1888778232       -0.2745893969        0.0980098040
   H          1.4263759457       -0.8776336296        1.2585371548
   O          0.0345533374       -0.3252010724        2.3415918970
   H         -0.0879540624       -0.6501023287        3.2335913088
   H         -0.6642468108       -0.7410368360        1.8366257490
   O         -1.8111643434       -1.3626885306        0.7044705890
   H         -1.2695746132       -1.7547321751        0.0194784832
   H         -2.1693010357       -0.5707718119        0.3034246312
   O          2.0781785569        1.3943964209       -0.6828139540
   H          2.6777205037        2.1267016882       -0.8260280926
   H          1.3945844417        1.7512701327       -0.1157406965
   O         -0.0484296970        0.4404140171       -2.1960802241
   H         -0.0290494786       -0.4889984776       -1.9679384657
   H          0.7696682306        0.7910697728       -1.8439606961
    24
 Energy=    -280.786084183094
   O          0.1069458198       -2.1266234066       -1.1472623998
   H          0.4003689653       -2.9486155708       -1.5402809487
   H          0.8295626907       -1.8612032745       -0.5783961137
   O         -2.3527685087        1.0341633066       -0.4950056829
   H         -2.5364370548        0.8903581630       -1.4233470995
   H         -1.4180139136        1.2378978175       -0.4640551432
   O         -0.0194021724        2.0337879678        0.9316533912
   H         -0.7996453790        2.5299924556        1.1791073968
   H         -0.0138950329        1.2832520325        1.5257050061
   O          1.9713643520       -1.1122446597        0.5072423956
   H          2.1882721718       -0.2748686067        0.0973836597
   H          1.4258224504       -0.8777930065        1.2580075359
   O          0.0339498200       -0.3251452158        2.3412291733
   H         -0.0881853598       -0.6501731285        3.2332334860
   H         -0.6644923500       -0.7416369245        1.8363083560
   O         -1.8109153334       -1.3640564002        0.7042668145
   H         -1.2694954121       -1.7557851956        0.0189604161
   H         -2.1690712175       -0.5719025355        0.3037066351
   O          2.0763196998        1.3939055799       -0.6839563037
   H          2.6761471710        2.1259013529       -0.8275565585
   H          1.3930973142        1.7512242493       -0.1167152788
   O         -0.0488150441        0.4389422549       -2.2008122104
   H         -0.0298589739       -0.4901937834       -1.9715116875
   H          0.7689658014        0.7898751262       -1.8482325050
    24
 Energy=    -280.774695913220
   O          0.1068150481       -2.1267954033       -1.1478503457
   H          0.4002947073       -2.9488049833       -1.5407902647
   H          0.8294066077       -1.8612799384       -0.5789963962
   O         -2.3503468785        1.0358726226       -0.4907574728
   H         -2.5251881709        0.8956224343       -1.4213445172
   H         -1.4166293209        1.2427143576       -0.4505099975
   O         -0.0203251464        2.0337963618        0.9316860284
   H         -0.7973678279        2.5330296175        1.1830874358
   H         -0.0147594609        1.2832068609        1.5256694156
   O          1.9710334511       -1.1123910652        0.5069365452
   H          2.1878981721       -0.2750388156        0.0970063770
   H          1.4254873962       -0.8779027830        1.2576872278
   O          0.0335666875       -0.3250947385        2.3409669098
   H         -0.0883214919       -0.6501753400        3.2329858077
   H         -0.6646489318       -0.7420246453        1.8360944094
   O         -1.8108003494       -1.3648509796        0.7041151608
   H         -1.2694835145       -1.7563686990        0.0186067367
   H         -2.1689958683       -0.5725602077        0.3038613125
   O          2.0753310074        1.3935795492       -0.6847344774
   H          2.6753125876        2.1254115324       -0.8285256165
   H          1.3922721126        1.7511442101       -0.1174515679
   O         -0.0492180555        0.4380559352       -2.2036717632
   H         -0.0305105566       -0.4909096312       -1.9736612287
   H          0.7683413332        0.7891795165       -1.8507684951
    24
 Energy=    -280.772710741707
   O          0.1067313753       -2.1269031651       -1.1482255607
   H          0.4002483956       -2.9489233942       -1.5411152930
   H          0.8293060718       -1.8613260781       -0.5793789569
   O         -2.3487377170        1.0369248671       -0.4881273148
   H         -2.5180244767        0.8989191200       -1.4200759436
   H         -1.4157208570        1.2456994312       -0.4420343609
   O         -0.0208970534        2.0338131586        0.9317558434
   H         -0.7958888206        2.5349653214        1.1856576169
   H         -0.0152948437        1.2831897338        1.5256960167
   O          1.9708223840       -1.1124848181        0.5067406421
   H          2.1876600039       -0.2751482156        0.0967641785
   H          1.4252732633       -0.8779723054        1.2574815283
   O          0.0333212452       -0.3250614808        2.3407989292
   H         -0.0884119090       -0.6501768960        3.2328263088
   H         -0.6647470923       -0.7422716196        1.8359542638
   O         -1.8107247130       -1.3653499984        0.7040118231
   H         -1.2694713100       -1.7567412851        0.0183811248
   H         -2.1689407955       -0.5729745580        0.3039440293
   O          2.0747011162        1.3933685128       -0.6852358239
   H          2.6747764156        2.1251011837       -0.8291412558
   H          1.3917366239        1.7510840272       -0.1179343581
   O         -0.0495520378        0.4375148526       -2.2054497725
   H         -0.0309921655       -0.4913436866       -1.9749954705
   H          0.7678579045        0.7887683641       -1.8523296838
    24
 Energy=    -280.822289162395
   O          0.1063132367       -2.1274841564       -1.1501217140
   H          0.4000335488       -2.9495553139       -1.5427528772
   H          0.8287929007       -1.8615858491       -0.5813044627
   O         -2.3398612748        1.0420961982       -0.4750016544
   H         -2.4809804044        0.9158784007       -1.4132906818
   H         -1.4109695013        1.2603926853       -0.3992483914
   O         -0.0240044136        2.0339406370        0.9324683520
   H         -0.7882639080        2.5448674727        1.1991011215
   H         -0.0182233887        1.2831434411        1.5261871325
   O          1.9697441764       -1.1129728985        0.5057328093
   H          2.1864371558       -0.2757103417        0.0955287092
   H          1.4241827486       -0.8783481562        1.2564296847
   O          0.0320345345       -0.3248555335        2.3398602943
   H         -0.0888801552       -0.6501075123        3.2319492070
   H         -0.6652536662       -0.7435711203        1.8351839004
   O         -1.8103944460       -1.3677922249        0.7034059827
   H         -1.2694542134       -1.7585384090        0.0171604549
   H         -2.1687459890       -0.5750099604        0.3042665425
   O          2.0717465543        1.3922264867       -0.6879698776
   H          2.6722450546        2.1235192252       -0.8323455047
   H          1.3891061842        1.7506409539       -0.1207194613
   O         -0.0518727287        0.4348761660       -2.2142872106
   H         -0.0340040411       -0.4934386620       -1.9815982980
   H          0.7646874543        0.7868683515       -1.8599387821
    24
 Energy=    -280.959185615247
   O          0.1061635845       -2.1285314806       -1.1519489102
   H          0.4001546772       -2.9506317519       -1.5443163672
   H          0.8284921528       -1.8622915023       -0.5830995863
   O         -2.3276648463        1.0468400615       -0.4606652112
   H         -2.4389245029        0.9343992311       -1.4047045052
   H         -1.4042065731        1.2747244062       -0.3533088743
   O         -0.0310052191        2.0342283487        0.9354562742
   H         -0.7832260216        2.5556268682        1.2157048925
   H         -0.0250555211        1.2832437771        1.5289363617
   O          1.9683307638       -1.1136358959        0.5048306470
   H          2.1846215082       -0.2761963425        0.0947755919
   H          1.4229252888       -0.8793841604        1.2557572961
   O          0.0307165448       -0.3242695363        2.3381859592
   H         -0.0889909412       -0.6492647796        3.2305312117
   H         -0.6656331867       -0.7451841435        1.8340433356
   O         -1.8109172883       -1.3690301505        0.7022222477
   H         -1.2703077776       -1.7586749091        0.0150904124
   H         -2.1698984769       -0.5758974541        0.3043467996
   O          2.0727696349        1.3903234020       -0.6932657287
   H          2.6731298829        2.1218066756       -0.8372505655
   H          1.3894115511        1.7486430725       -0.1268201594
   O         -0.0566325350        0.4321585522       -2.2232257679
   H         -0.0391624407       -0.4956062518       -1.9883234387
   H          0.7585001519        0.7853544474       -1.8667945651
    24
 Energy=    -281.387034987321
   O          0.1066135404       -2.1329673184       -1.1581356568
   H          0.4015714262       -2.9551506792       -1.5496023948
   H          0.8283869965       -1.8655543358       -0.5891319532
   O         -2.2796932958        1.0613004806       -0.4095673652
   H         -2.2885763196        1.0035704920       -1.3649835993
   H         -1.3831747836        1.3173442519       -0.1929386863
   O         -0.0651874740        2.0363878902        0.9522806122
   H         -0.7717088560        2.5935087628        1.2788930892
   H         -0.0587966375        1.2847360818        1.5449108141
   O          1.9620540686       -1.1165341944        0.5024495816
   H          2.1760958161       -0.2776153936        0.0942422618
   H          1.4177680374       -0.8852546543        1.2551077581
   O          0.0268957439       -0.3212207633        2.3309248487
   H         -0.0880467675       -0.6446304357        3.2244718496
   H         -0.6658398572       -0.7509085014        1.8292101143
   O         -1.8149461429       -1.3700533274        0.6967673701
   H         -1.2754783285       -1.7550699619        0.0061383029
   H         -2.1769525190       -0.5758281048        0.3038430526
   O          2.0869685277        1.3817116555       -0.7184955839
   H          2.6851388561        2.1156413884       -0.8591058446
   H          1.3990936017        1.7371703713       -0.1557265126
   O         -0.0771439182        0.4226435586       -2.2540174791
   H         -0.0602067299       -0.5032884683       -2.0119537412
   H          0.7317492709        0.7810414824       -1.8886757529
    24
 Energy=    -281.699983616850
   O          0.1064846962       -2.1328855678       -1.1592783423
   H          0.4014065476       -2.9551598104       -1.5505813087
   H          0.8283210421       -1.8653274435       -0.5904226666
   O         -2.2756280565        1.0648773282       -0.4000606547
   H         -2.2686149745        1.0167806958       -1.3560258061
   H         -1.3844019963        1.3242863087       -0.1662767153
   O         -0.0657891379        2.0353145566        0.9486538505
   H         -0.7653515043        2.5973852917        1.2817016312
   H         -0.0593475983        1.2835591454        1.5411520768
   O          1.9610247819       -1.1168721407        0.5021164650
   H          2.1749113358       -0.2779123868        0.0939119656
   H          1.4167855983       -0.8856882662        1.2548379057
   O          0.0267330625       -0.3210232089        2.3306716002
   H         -0.0880270565       -0.6447628473        3.2241225510
   H         -0.6656131697       -0.7511343673        1.8287822437
   O         -1.8146544013       -1.3716381348        0.6964886761
   H         -1.2753302895       -1.7566236986        0.0057300655
   H         -2.1764288470       -0.5771882672        0.3038049632
   O          2.0816103387        1.3817802426       -0.7179927885
   H          2.6802642953        2.1151441315       -0.8594943317
   H          1.3948673585        1.7379113440       -0.1542671833
   O         -0.0752818302        0.4207170854       -2.2597435369
   H         -0.0589252758       -0.5048773788       -2.0163525119
   H          0.7334932807        0.7792849793       -1.8943071876
    24
 Energy=    -282.273968967556
   O          0.1052549016       -2.1357880187       -1.1667235151
   H          0.4010949042       -2.9582154790       -1.5570100833
   H          0.8266376866       -1.8669122223       -0.5979137722
   O         -2.2351463763        1.0830621132       -0.3508660929
   H         -2.1260530427        1.1013460597       -1.3016532309
   H         -1.3862572763        1.3606328606       -0.0065208938
   O         -0.0823126813        2.0363509021        0.9560932368
   H         -0.7286969984        2.6328263948        1.3337652389
   H         -0.0756215017        1.2838930981        1.5476964158
   O          1.9559571577       -1.1191270556        0.4987483695
   H          2.1685635324       -0.2797471718        0.0907388351
   H          1.4121417514       -0.8888824144        1.2520637410
   O          0.0215359725       -0.3193041510        2.3254042392
   H         -0.0895182633       -0.6429206520        3.2193679728
   H         -0.6674223964       -0.7561857464        1.8247020547
   O         -1.8139861864       -1.3791482616        0.6935601200
   H         -1.2759134134       -1.7611230917        0.0001592546
   H         -2.1766477103       -0.5831179246        0.3049161161
   O          2.0746206380        1.3762967454       -0.7322779674
   H          2.6735061733        2.1094395376       -0.8739451895
   H          1.3874344814        1.7330598525       -0.1694928293
   O         -0.0875829803        0.4110780242       -2.2929523378
   H         -0.0732749520       -0.5123679016       -2.0414076250
   H          0.7165798974        0.7735500326       -1.9212428422
    24
 Energy=    -284.313032177405
   O          0.1006662148       -2.1327354261       -1.1762165469
   H          0.3973275264       -2.9553407710       -1.5655035269
   H          0.8218611777       -1.8623474707       -0.6078856406
   O         -2.2368705647        1.0895178429       -0.3545462862
   H         -2.0783244614        1.1228070122       -1.2979374057
   H         -1.4124978387        1.3773049357        0.0376526913
   O         -0.0339611502        2.0459063489        0.9703900925
   H         -0.6333164442        2.6684938372        1.3819601241
   H         -0.0271211548        1.2928983861        1.5612911522
   O          1.9537041797       -1.1196522752        0.4925370713
   H          2.1677739839       -0.2827801270        0.0801647076
   H          1.4082710486       -0.8847177667        1.2432302951
   O          0.0170225031       -0.3215680217        2.3316637401
   H         -0.0961561690       -0.6509234855        3.2232619718
   H         -0.6689871611       -0.7573342083        1.8259657955
   O         -1.8034531963       -1.4005762697        0.6935228891
   H         -1.2658510863       -1.7874048980        0.0024516745
   H         -2.1594438336       -0.6027472386        0.3024073776
   O          2.0194352301        1.3779988285       -0.7198998300
   H          2.6222198649        2.1064199780       -0.8691819551
   H          1.3416106275        1.7404592285       -0.1494542966
   O         -0.0830543686        0.4119170447       -2.3109779559
   H         -0.0755216995       -0.5096742561       -2.0524347812
   H          0.7223340541        0.7719576876       -1.9395589689
    24
 Energy=    -287.040921997942
   O          0.0949993990       -2.1309368151       -1.2010430100
   H          0.3951934118       -2.9528582593       -1.5890643164
   H          0.8143046268       -1.8574750799       -0.6317886656
   O         -2.1526970574        1.0858080920       -0.3701797540
   H         -1.9162953622        1.1031351976       -1.2975663238
   H         -1.3726029080        1.4065621716        0.0823705510
   O         -0.0182319805        2.0675174466        1.0559610901
   H         -0.4967592373        2.7431075668        1.5363999457
   H         -0.0116704633        1.3131564012        1.6451369549
   O          1.9385350614       -1.1231544609        0.4821930575
   H          2.1515585572       -0.2880745826        0.0656664350
   H          1.3922225684       -0.8852298421        1.2313034471
   O          0.0104443000       -0.3346789747        2.3448260004
   H         -0.1062371438       -0.6814508573        3.2293408630
   H         -0.6672194725       -0.7679143605        1.8258744112
   O         -1.7962204105       -1.4094753143        0.6813689046
   H         -1.2589680508       -1.8013700930       -0.0071150999
   H         -2.1451220578       -0.6098268882        0.2875899372
   O          1.9877660186        1.3706517562       -0.7384490815
   H          2.5921326272        2.0956950915       -0.8974616730
   H          1.3235389052        1.7357074990       -0.1538393942
   O         -0.1402806430        0.4218809181       -2.3363081910
   H         -0.1415656128       -0.4973816090       -2.0695000290
   H          0.6584546121        0.7824152773       -1.9512513014
    24
 Energy=    -288.567913967633
   O          0.0898958122       -2.1276047905       -1.2190291996
   H          0.3925090424       -2.9487694230       -1.6067735989
   H          0.8077500689       -1.8526362555       -0.6486701802
   O         -2.1035939602        1.0861526832       -0.3730550331
   H         -1.8124653622        1.0919130508       -1.2848898853
   H         -1.3583319838        1.4306873765        0.1189940211
   O         -0.0055281146        2.0789885236        1.1026258059
   H         -0.4000474731        2.7820192438        1.6187015001
   H          0.0004024901        1.3238215826        1.6907750720
   O          1.9250314770       -1.1255235709        0.4762455025
   H          2.1351173225       -0.2895227174        0.0600744434
   H          1.3795947401       -0.8896754408        1.2266495708
   O          0.0088409410       -0.3447256114        2.3572004635
   H         -0.1108653622       -0.7069218642        3.2351048521
   H         -0.6651373154       -0.7709826601        1.8277761740
   O         -1.7880006847       -1.4147544823        0.6758259160
   H         -1.2521804185       -1.8092255508       -0.0123027482
   H         -2.1296688346       -0.6114632159        0.2831201017
   O          1.9607398784        1.3669296249       -0.7481788076
   H          2.5655467671        2.0895682057       -0.9162084147
   H          1.3106546119        1.7326210828       -0.1482698613
   O         -0.1695167051        0.4262864113       -2.3585062053
   H         -0.1724282693       -0.4924721762       -2.0899805629
   H          0.6236516697        0.7890581557       -1.9641555608
    24
 Energy=    -290.214762398647
   O          0.0839495417       -2.1262420228       -1.2413192131
   H          0.3896517813       -2.9459166403       -1.6297925095
   H          0.7992608796       -1.8509633689       -0.6679230216
   O         -2.0545653062        1.0824436357       -0.3782888190
   H         -1.7227920537        1.0465232575       -1.2754332195
   H         -1.3343781804        1.4567560283        0.1291090293
   O          0.0096564702        2.0824277744        1.1457029291
   H         -0.3057030531        2.8055225692        1.6878414066
   H          0.0147528691        1.3266172525        1.7330327526
   O          1.9136989589       -1.1261893432        0.4687524762
   H          2.1199567931       -0.2887896269        0.0534799622
   H          1.3697634852       -0.8933920710        1.2211961422
   O          0.0052974084       -0.3575836306        2.3673893097
   H         -0.1126696410       -0.7343436287        3.2393798596
   H         -0.6664611354       -0.7787379580        1.8311045613
   O         -1.7786712558       -1.4084167825        0.6747123860
   H         -1.2456423315       -1.8044604411       -0.0146796840
   H         -2.1119543812       -0.5998177950        0.2857112603
   O          1.9271942039        1.3672973872       -0.7522838016
   H          2.5342860428        2.0853420160       -0.9314017801
   H          1.2926962698        1.7369922329       -0.1383050295
   O         -0.1950909613        0.4318906388       -2.3748155303
   H         -0.1964508769       -0.4880353292       -2.1103042751
   H          0.5921785782        0.7966609898       -1.9706112462
    24
 Energy=    -291.562090606099
   O          0.0788727378       -2.1193933801       -1.2575674184
   H          0.3861021683       -2.9381552379       -1.6467600919
   H          0.7924941181       -1.8447563292       -0.6817628891
   O         -2.0130023846        1.0886269954       -0.3850346396
   H         -1.6331582010        1.0230343039       -1.2611897829
   H         -1.3254914504        1.4918620418        0.1450238974
   O          0.0251002800        2.0921986710        1.1820165728
   H         -0.2104614689        2.8304889291        1.7438617448
   H          0.0291402782        1.3358754195        1.7686942166
   O          1.8958949508       -1.1288167145        0.4586972770
   H          2.0974670463       -0.2893293651        0.0453432877
   H          1.3539975603       -0.9004529564        1.2139648139
   O          0.0130485712       -0.3660526002        2.3867632976
   H         -0.1062509332       -0.7615047339        3.2502545125
   H         -0.6576808788       -0.7757711728        1.8404259145
   O         -1.7718657967       -1.4196557881        0.6688932478
   H         -1.2432786817       -1.8178179284       -0.0226950777
   H         -2.0946372290       -0.6043860540        0.2849847911
   O          1.8944008346        1.3670954780       -0.7564552742
   H          2.5014172528        2.0826413373       -0.9455505712
   H          1.2760649419        1.7371151284       -0.1263933549
   O         -0.2171427774        0.4311724949       -2.3909735667
   H         -0.2139095009       -0.4906642915       -2.1332172378
   H          0.5632823273        0.7990184065       -1.9764161143
    24
 Energy=    -293.723074341164
   O          0.0622028004       -2.1283306394       -1.2978330657
   H          0.3722150989       -2.9442125400       -1.6908482551
   H          0.7701904127       -1.8598335905       -0.7122609390
   O         -1.9795988594        1.1050324091       -0.4019015439
   H         -1.5203489733        0.9340532135       -1.2241469433
   H         -1.3437390734        1.5790126780        0.1340619597
   O          0.0617546927        2.0972628201        1.2125773745
   H         -0.0616126723        2.8490742784        1.7920528825
   H          0.0640588927        1.3404128905        1.7985848102
   O          1.8622753535       -1.1303105104        0.4430213258
   H          2.0450732560       -0.2797754707        0.0437633727
   H          1.3315622427       -0.9250223143        1.2127174935
   O          0.0286484853       -0.3846817189        2.4088798246
   H         -0.0786618457       -0.8218237638        3.2536420192
   H         -0.6512784761       -0.7658585121        1.8533301693
   O         -1.7443386716       -1.3953061185        0.6748487881
   H         -1.2333156287       -1.8028447814       -0.0244362237
   H         -2.0360409938       -0.5621860113        0.3046427884
   O          1.8143752586        1.3756865530       -0.7499337981
   H          2.4156039493        2.0890915860       -0.9639645442
   H          1.2407917462        1.7394328413       -0.0754544196
   O         -0.2111283159        0.4086834462       -2.3881603053
   H         -0.1786627690       -0.5222204832       -2.1677159757
   H          0.5571129342        0.7841201225       -1.9579457964
    24
 Energy=    -293.868739447389
   O          0.0627612595       -2.1365277498       -1.2938221719
   H          0.3721530621       -2.9525756851       -1.6869815795
   H          0.7707317148       -1.8689452547       -0.7078108386
   O         -1.9906975623        1.1085458580       -0.4039355252
   H         -1.5337125273        0.9383765080       -1.2276095566
   H         -1.3528996242        1.5808004951        0.1312477967
   O          0.0559566952        2.0984958617        1.2041577157
   H         -0.0868227089        2.8485452564        1.7814546821
   H          0.0586091585        1.3416715591        1.7901967753
   O          1.8641517299       -1.1305312427        0.4421133560
   H          2.0462378613       -0.2799727333        0.0425802499
   H          1.3339784142       -0.9253689325        1.2122149868
   O          0.0313217737       -0.3845565864        2.4082004443
   H         -0.0727995744       -0.8211945496        3.2536221580
   H         -0.6506704914       -0.7660929384        1.8554361162
   O         -1.7445557744       -1.3861971886        0.6748152315
   H         -1.2358205074       -1.7960616965       -0.0247784744
   H         -2.0350116752       -0.5529949193        0.3038149777
   O          1.8245387027        1.3760083303       -0.7507655407
   H          2.4238443112        2.0915193637       -0.9631533670
   H          1.2483213037        1.7374939182       -0.0773165679
   O         -0.2081527210        0.4031229781       -2.3789287603
   H         -0.1715033868       -0.5285645487       -2.1624870390
   H          0.5601790176        0.7795999865       -1.9497863113
    24
 Energy=    -294.225437004851
   O          0.0675594689       -2.1916004591       -1.2689993467
   H          0.3707658031       -3.0125871524       -1.6566571963
   H          0.7779374005       -1.9249728909       -0.6854714775
   O         -2.0305805973        1.1328562936       -0.4218897110
   H         -1.5502700369        0.9369673174       -1.2263529572
   H         -1.4052650013        1.6143287188        0.1197712062
   O          0.0303941951        2.1195924740        1.1767737360
   H         -0.2022979212        2.8577438321        1.7399955322
   H          0.0347048114        1.3626820336        1.7626916858
   O          1.8746377710       -1.1403622348        0.4272517385
   H          2.0530916654       -0.2961673533        0.0128593524
   H          1.3464724801       -0.9236768142        1.1955750389
   O          0.0526736884       -0.3789944088        2.3952090301
   H         -0.0298888440       -0.8299324129        3.2354888554
   H         -0.6392217734       -0.7558408764        1.8516106031
   O         -1.7414675262       -1.3264361255        0.6661769478
   H         -1.2569666525       -1.7727560374       -0.0282935553
   H         -2.0139951042       -0.4969954786        0.2737629159
   O          1.8465264540        1.3730517017       -0.7392454513
   H          2.4381149216        2.0941108143       -0.9544864353
   H          1.2558079993        1.7361078403       -0.0793410738
   O         -0.2001968017        0.3646621304       -2.3296492345
   H         -0.1521932225       -0.5705569636       -2.1314252639
   H          0.5804570411        0.7372354797       -1.9197705731
    24
 Energy=    -294.513825723775
   O          0.0581195032       -2.2090561463       -1.2484930314
   H          0.3647347671       -3.0353856263       -1.6218541307
   H          0.7686331277       -1.9279009256       -0.6719915385
   O         -2.0008537065        1.1429663309       -0.4557930951
   H         -1.5025350404        0.9202933126       -1.2421308558
   H         -1.3810147408        1.6232984581        0.0931263381
   O          0.0247568669        2.1363433854        1.1778274874
   H         -0.2127951957        2.8731849931        1.7407353865
   H          0.0292857341        1.3789319975        1.7630960744
   O          1.8814503525       -1.1484694557        0.4416684648
   H          2.0534802256       -0.3054180427        0.0222618866
   H          1.3585485222       -0.9304228927        1.2132001961
   O          0.0524487871       -0.3425806376        2.3831167217
   H         -0.0259365903       -0.8031678118        3.2185489617
   H         -0.6360547328       -0.7198794042        1.8355398926
   O         -1.7500550136       -1.3212962610        0.6778447540
   H         -1.2744065360       -1.7722000672       -0.0197770083
   H         -2.0325345191       -0.4969617218        0.2817264174
   O          1.8369407424        1.3608259314       -0.7369416029
   H          2.4302562519        2.0768604296       -0.9638846432
   H          1.2433510845        1.7377172965       -0.0874525292
   O         -0.2032818520        0.3353404746       -2.3333734567
   H         -0.1552564740       -0.5969967340       -2.1220142068
   H          0.5798332345        0.7128687895       -1.9328301098
    24
 Energy=    -294.741211317724
   O          0.0555251266       -2.2491101199       -1.1851853091
   H          0.3611814707       -3.0852775381       -1.5367960143
   H          0.7662452116       -1.9539323124       -0.6159938977
   O         -2.0012103580        1.1547562436       -0.5038711154
   H         -1.4989785253        0.8993556571       -1.2776705511
   H         -1.3715996710        1.6177213317        0.0488363569
   O          0.0213348634        2.1496913443        1.1322944363
   H         -0.2421225522        2.8807368765        1.6912170249
   H          0.0266525938        1.3910925911        1.7160165393
   O          1.8706143328       -1.1360048123        0.4658375670
   H          2.0392656945       -0.3028136757        0.0258590584
   H          1.3511400045       -0.9006137982        1.2345828647
   O          0.0507806817       -0.2904493040        2.4014398595
   H         -0.0203963550       -0.7414475926        3.2427282840
   H         -0.6394054961       -0.6772151086        1.8626568862
   O         -1.7593629338       -1.2866995714        0.6936834957
   H         -1.2832700384       -1.7591774595        0.0107984100
   H         -2.0524774456       -0.4809152656        0.2682103761
   O          1.8413740889        1.3483898416       -0.7589092454
   H          2.4393290891        2.0541406151       -1.0050748472
   H          1.2527867043        1.7454980266       -0.1169576739
   O         -0.1786484954        0.2666571363       -2.3395953536
   H         -0.1307216590       -0.6600403300       -2.1047195047
   H          0.5958540784        0.6571958523       -1.9348026728
    24
 Energy=    -294.766382699429
   O          0.0583947777       -2.2666944733       -1.1464406625
   H          0.3613503636       -3.1088308028       -1.4859346322
   H          0.7694304872       -1.9663284731       -0.5803661747
   O         -2.0042211861        1.1560462416       -0.5301482999
   H         -1.5025341319        0.8918107868       -1.3013302265
   H         -1.3701764377        1.6106326237        0.0244419256
   O          0.0183043580        2.1563626553        1.1068090938
   H         -0.2546737868        2.8848200427        1.6645407561
   H          0.0240238301        1.3970035306        1.6895378879
   O          1.8676067032       -1.1218107143        0.4862688178
   H          2.0378865258       -0.2974138268        0.0306303714
   H          1.3476799028       -0.8710508543        1.2498311629
   O          0.0438976274       -0.2747421663        2.4117495662
   H         -0.0306058944       -0.7118620850        3.2600462372
   H         -0.6487364677       -0.6652952597        1.8788723463
   O         -1.7565765257       -1.2580077060        0.7047273489
   H         -1.2768927142       -1.7465817048        0.0358247187
   H         -2.0466953562       -0.4622310183        0.2588547578
   O          1.8437365325        1.3376662963       -0.7817698330
   H          2.4429125345        2.0394471826       -1.0361780604
   H          1.2576830272        1.7425087387       -0.1423359226
   O         -0.1699848162        0.2293965747       -2.3459670553
   H         -0.1300964983       -0.6924840992       -2.0914542163
   H          0.6009250837        0.6243878930       -1.9386445484
    24
 Energy=    -294.831512468753
   O          0.0576185898       -2.2660062846       -1.1465421252
   H          0.3606860234       -3.1083283183       -1.4854751010
   H          0.7685243291       -1.9652679893       -0.5805020669
   O         -2.0016653139        1.1579782033       -0.5344558937
   H         -1.5001851086        0.8948967025       -1.3061666995
   H         -1.3680219077        1.6137930247        0.0195844680
   O          0.0183753007        2.1507998943        1.1087962165
   H         -0.2536377783        2.8794372717        1.6667642238
   H          0.0240799494        1.3914334327        1.6915155949
   O          1.8706309170       -1.1229717255        0.4900582227
   H          2.0409536947       -0.2984506415        0.0346606234
   H          1.3507254597       -0.8724066570        1.2536990427
   O          0.0469269247       -0.2692876137        2.4111059578
   H         -0.0312434757       -0.7065582841        3.2589948593
   H         -0.6456590863       -0.6572264230        1.8762602438
   O         -1.7594632024       -1.2615185772        0.7047424941
   H         -1.2798695545       -1.7491409884        0.0350812686
   H         -2.0478643526       -0.4641448725        0.2606121174
   O          1.8418046876        1.3386329611       -0.7824146141
   H          2.4413729166        2.0399038917       -1.0373045132
   H          1.2554587073        1.7444618746       -0.1438747764
   O         -0.1729872770        0.2300855058       -2.3459472775
   H         -0.1334304488       -0.6913140159       -2.0896466359
   H          0.5982606106        0.6255141788       -1.9396903386
    24
 Energy=    -294.894885799110
   O          0.0601724748       -2.2618761273       -1.1314217590
   H          0.3617174334       -3.1068861846       -1.4649790718
   H          0.7711373236       -1.9593469143       -0.5664112289
   O         -1.9958215487        1.1588693872       -0.5452743218
   H         -1.4967848273        0.8963368972       -1.3187540451
   H         -1.3620004287        1.6200269421        0.0041220173
   O          0.0185696422        2.1471535724        1.1043459360
   H         -0.2504191726        2.8761410254        1.6633219202
   H          0.0243014367        1.3875598130        1.6867687268
   O          1.8807600506       -1.1248677940        0.5034741504
   H          2.0515157682       -0.3016179527        0.0459437976
   H          1.3609758635       -0.8720551885        1.2664564734
   O          0.0461829600       -0.2635576839        2.4112633460
   H         -0.0460557489       -0.6895914455        3.2634482406
   H         -0.6459400004       -0.6490617781        1.8740629727
   O         -1.7667644292       -1.2534120350        0.7085160632
   H         -1.2853660562       -1.7444897816        0.0426856844
   H         -2.0444808275       -0.4532559455        0.2625836979
   O          1.8356951557        1.3322776104       -0.7890561317
   H          2.4338106612        2.0339326783       -1.0462911367
   H          1.2488870409        1.7388655611       -0.1514243298
   O         -0.1772755839        0.2216093075       -2.3567460126
   H         -0.1401042577       -0.6963606849       -2.0880803737
   H          0.5945062467        0.6206631633       -1.9550736757
    24
 Energy=    -294.911974391293
   O          0.0575546869       -2.2634073430       -1.1099502411
   H          0.3568840359       -3.1127591694       -1.4343500806
   H          0.7691533955       -1.9568209980       -0.5479325093
   O         -1.9887567676        1.1602319822       -0.5611645504
   H         -1.4920985064        0.8897832989       -1.3334468312
   H         -1.3532281409        1.6268858666       -0.0184221098
   O          0.0206318671        2.1538645581        1.0947477810
   H         -0.2476133327        2.8825640886        1.6544560505
   H          0.0264968738        1.3938507169        1.6766209656
   O          1.8883340004       -1.1255850994        0.5170762490
   H          2.0573833847       -0.3035758097        0.0566906787
   H          1.3700466091       -0.8709051549        1.2804556736
   O          0.0374098417       -0.2541068822        2.4060422423
   H         -0.0655082544       -0.6632437291        3.2652551065
   H         -0.6558427765       -0.6410958917        1.8713721067
   O         -1.7732335315       -1.2404366015        0.7197649377
   H         -1.2890031882       -1.7360258125        0.0593528326
   H         -2.0431601155       -0.4402195551        0.2691829165
   O          1.8340718065        1.3211971248       -0.7952775618
   H          2.4307549144        2.0220342611       -1.0580101582
   H          1.2476841301        1.7310617848       -0.1593590974
   O         -0.1742519944        0.2032423356       -2.3667213029
   H         -0.1356590025       -0.7109695100       -2.0857246441
   H          0.5955514272        0.6094344180       -1.9684217618
    24
 Energy=    -295.053293909583
   O          0.0346673519       -2.3051237903       -1.0223833872
   H          0.3116635589       -3.1755286311       -1.3085657669
   H          0.7562079039       -1.9906901983       -0.4776425423
   O         -1.9692217429        1.1565497716       -0.6041668504
   H         -1.4596214828        0.8557339068       -1.3565292832
   H         -1.3439519921        1.6486338798       -0.0720739926
   O          0.0307753718        2.2030542474        1.0337141750
   H         -0.2374067010        2.9298388892        1.5959368180
   H          0.0371919860        1.4411495119        1.6131033715
   O          1.8840596675       -1.1258725982        0.5428158807
   H          2.0489118614       -0.3185417928        0.0557095629
   H          1.3656430595       -0.8487571287        1.2982515677
   O          0.0289088834       -0.1812142941        2.3921098064
   H         -0.1018364133       -0.5276878669        3.2747725793
   H         -0.6700562853       -0.5782659779        1.8724661850
   O         -1.8104278884       -1.2078311650        0.7415277710
   H         -1.3167581602       -1.7266471747        0.1064277887
   H         -2.0631666002       -0.4187839966        0.2621953712
   O          1.8507172946        1.2898905438       -0.8184767919
   H          2.4549720836        1.9718739067       -1.1117457517
   H          1.2688196652        1.7338882411       -0.2016356181
   O         -0.1463079620        0.1239139798       -2.3610737798
   H         -0.1244973315       -0.7817605220       -2.0520271278
   H          0.6231492294        0.5316778323       -1.9637123432
    24
 Energy=    -295.057545410434
   O          0.0353910953       -2.3044986196       -1.0256503445
   H          0.3131596775       -3.1742726220       -1.3129996780
   H          0.7565280229       -1.9902718741       -0.4802560613
   O         -1.9702021330        1.1564825947       -0.6032895120
   H         -1.4612212047        0.8562016886       -1.3562846196
   H         -1.3445603876        1.6484201965       -0.0714985358
   O          0.0305078447        2.2012867990        1.0349474109
   H         -0.2367959539        2.9283089034        1.5972812787
   H          0.0368768300        1.4394487699        1.6144248423
   O          1.8849241473       -1.1264785378        0.5429997753
   H          2.0501031431       -0.3187303566        0.0566967676
   H          1.3662762299       -0.8499636046        1.2984967438
   O          0.0287683660       -0.1825629843        2.3915735209
   H         -0.1005839036       -0.5313157813        3.2735436546
   H         -0.6700349605       -0.5795380266        1.8716537515
   O         -1.8086497862       -1.2084246094        0.7418544844
   H         -1.3158221689       -1.7263533684        0.1053777918
   H         -2.0619406712       -0.4186662879        0.2639869703
   O          1.8502251125        1.2908128970       -0.8174601207
   H          2.4543894048        1.9732386359       -1.1098852544
   H          1.2679947474        1.7340708691       -0.2004009566
   O         -0.1479046168        0.1267520486       -2.3608182663
   H         -0.1249126222       -0.7792656852       -2.0528652274
   H          0.6215833367        0.5347751310       -1.9637826334
    24
 Energy=    -295.061211134672
   O          0.0356202076       -2.3051215035       -1.0257206034
   H          0.3132645005       -3.1749675569       -1.3129719392
   H          0.7566674017       -1.9910620004       -0.4801113913
   O         -1.9713479042        1.1563048154       -0.6035163379
   H         -1.4624339577        0.8556289249       -1.3563990936
   H         -1.3459639316        1.6495916424       -0.0726728268
   O          0.0302745305        2.2017857426        1.0333987673
   H         -0.2352852781        2.9291538610        1.5961113480
   H          0.0365841446        1.4399592402        1.6128920019
   O          1.8857102548       -1.1274350602        0.5441231016
   H          2.0512855862       -0.3198668646        0.0576559813
   H          1.3665579914       -0.8506216208        1.2991642178
   O          0.0288486263       -0.1807804269        2.3906732105
   H         -0.0996457229       -0.5299174406        3.2726167392
   H         -0.6698093357       -0.5783654829        1.8710242758
   O         -1.8078662120       -1.2081401068        0.7426529035
   H         -1.3161009478       -1.7263441722        0.1055788799
   H         -2.0608904765       -0.4180266240        0.2652314484
   O          1.8505962587        1.2899697194       -0.8174295864
   H          2.4549423101        1.9722071704       -1.1099184761
   H          1.2679325061        1.7336431508       -0.2010784871
   O         -0.1488844576        0.1267580566       -2.3598852719
   H         -0.1251196966       -0.7794219333       -2.0524687760
   H          0.6207940412        0.5349499183       -1.9633928350
    24
 Energy=    -295.069051395765
   O          0.0362638947       -2.3077465263       -1.0229370770
   H          0.3130714143       -3.1783271279       -1.3087671897
   H          0.7571954751       -1.9938771731       -0.4770657319
   O         -1.9743450465        1.1553815038       -0.6046132402
   H         -1.4652469884        0.8527545172       -1.3565892466
   H         -1.3500973407        1.6535303796       -0.0769823661
   O          0.0299078974        2.2057057023        1.0266121419
   H         -0.2300917212        2.9341093176        1.5905804137
   H          0.0360440266        1.4438655693        1.6060893197
   O          1.8871257907       -1.1302118396        0.5476994108
   H          2.0539461286       -0.3237867009        0.0597636459
   H          1.3663048764       -0.8515846027        1.3009220061
   O          0.0294726794       -0.1737685835        2.3883362931
   H         -0.0970709512       -0.5222169844        3.2708340334
   H         -0.6689521985       -0.5735273241        1.8700434424
   O         -1.8071842519       -1.2060680896        0.7448682844
   H         -1.3181844198       -1.7260649017        0.1071267070
   H         -2.0592198808       -0.4156887495        0.2673639593
   O          1.8521540324        1.2860174037       -0.8178562579
   H          2.4571144059        1.9672597562       -1.1113927014
   H          1.2683234385        1.7317347701       -0.2040894398
   O         -0.1507420871        0.1239209100       -2.3573841889
   H         -0.1252531404       -0.7824421361       -2.0506462189
   H          0.6196703279        0.5325736979       -1.9627964930
    24
 Energy=    -295.080131178043
   O          0.0374976339       -2.3125737853       -1.0158196174
   H          0.3161266298       -3.1836467194       -1.2983610588
   H          0.7562591964       -1.9965275706       -0.4683450094
   O         -1.9780347079        1.1534359805       -0.6058710344
   H         -1.4687307004        0.8486779200       -1.3568462620
   H         -1.3561570690        1.6605705341       -0.0840333329
   O          0.0312195618        2.2159760703        1.0151463878
   H         -0.2155316007        2.9467967955        1.5819327421
   H          0.0369284245        1.4541489722        1.5946450691
   O          1.8854543089       -1.1325439574        0.5538328926
   H          2.0558106914       -0.3291719777        0.0620971861
   H          1.3606428622       -0.8489867034        1.3024316297
   O          0.0314232471       -0.1607356652        2.3855525830
   H         -0.0904145135       -0.5085216245        3.2689733925
   H         -0.6685401961       -0.5624325820        1.8708462539
   O         -1.8064607551       -1.2037197832        0.7487091502
   H         -1.3196745550       -1.7266958000        0.1117106248
   H         -2.0615340902       -0.4163015872        0.2679368358
   O          1.8543919070        1.2780314592       -0.8208887990
   H          2.4599194161        1.9575621065       -1.1172102041
   H          1.2690813660        1.7274086990       -0.2112138799
   O         -0.1534446659        0.1148900293       -2.3551374224
   H         -0.1263914834       -0.7909808561       -2.0470823878
   H          0.6194611440        0.5239348249       -1.9658678445
    24
 Energy=    -295.082313639627
   O          0.0369811520       -2.3135673112       -1.0143316846
   H          0.3157047881       -3.1849396221       -1.2958548105
   H          0.7559102852       -1.9966183619       -0.4675994786
   O         -1.9777445109        1.1521678840       -0.6053487001
   H         -1.4682424190        0.8482091031       -1.3565134742
   H         -1.3562785966        1.6596509892       -0.0833593752
   O          0.0327297178        2.2163544221        1.0142528128
   H         -0.2115501537        2.9476258694        1.5815281029
   H          0.0383406240        1.4545418500        1.5937715465
   O          1.8838634178       -1.1296918307        0.5537938330
   H          2.0548437156       -0.3265500793        0.0618986155
   H          1.3585697382       -0.8457019532        1.3018901769
   O          0.0309972732       -0.1587131982        2.3865038446
   H         -0.0904889007       -0.5063005384        3.2700512346
   H         -0.6687437813       -0.5610703998        1.8720109108
   O         -1.8055126119       -1.2056951877        0.7504296989
   H         -1.3174275957       -1.7279924146        0.1138682613
   H         -2.0625777285       -0.4193348711        0.2689872639
   O          1.8543118294        1.2787822495       -0.8243802256
   H          2.4598515516        1.9578738366       -1.1216815897
   H          1.2698400746        1.7287530002       -0.2143384800
   O         -0.1536985211        0.1130335339       -2.3554410915
   H         -0.1278604360       -0.7925536094       -2.0464489243
   H          0.6192648936        0.5216782159       -1.9658657800
    24
 Energy=    -295.083879656867
   O          0.0369733256       -2.3149187746       -1.0117755750
   H          0.3150921992       -3.1871605830       -1.2911963328
   H          0.7565891844       -1.9967258106       -0.4666718296
   O         -1.9783475027        1.1490205506       -0.6046005264
   H         -1.4692321602        0.8442304155       -1.3556906552
   H         -1.3569940002        1.6583293033       -0.0842580820
   O          0.0337597304        2.2181389905        1.0105585215
   H         -0.2062277325        2.9501704215        1.5786851286
   H          0.0392000137        1.4563397092        1.5900963530
   O          1.8836137351       -1.1271403588        0.5545329016
   H          2.0555202337       -0.3243863855        0.0623276051
   H          1.3575230356       -0.8424536560        1.3018038680
   O          0.0304121549       -0.1546230692        2.3865183799
   H         -0.0895696577       -0.5009151516        3.2707796526
   H         -0.6688154268       -0.5594981916        1.8733042295
   O         -1.8043437780       -1.2072996758        0.7538670248
   H         -1.3159412742       -1.7293742327        0.1173664424
   H         -2.0623629857       -0.4214047734        0.2721750788
   O          1.8541919915        1.2789743328       -0.8279934516
   H          2.4595016867        1.9574358752       -1.1271956382
   H          1.2704391233        1.7301451845       -0.2181497901
   O         -0.1546618250        0.1103594737       -2.3555733588
   H         -0.1281003178       -0.7949445688       -2.0458139085
   H          0.6178127689        0.5200289342       -1.9661047786
    24
 Energy=    -295.085144490318
   O          0.0389456426       -2.3165233812       -1.0064005106
   H          0.3174066563       -3.1896293430       -1.2827649141
   H          0.7586789172       -1.9959211120       -0.4628657477
   O         -1.9796660250        1.1444808307       -0.6031483989
   H         -1.4709113627        0.8391565255       -1.3542659678
   H         -1.3590861451        1.6574708206       -0.0855059326
   O          0.0329868901        2.2217493411        1.0056397955
   H         -0.2034402406        2.9543672424        1.5745027514
   H          0.0382217519        1.4599169733        1.5851360248
   O          1.8853027601       -1.1248595576        0.5541348276
   H          2.0582878243       -0.3229137141        0.0609909626
   H          1.3584216550       -0.8387989146        1.3003234429
   O          0.0323492305       -0.1493535529        2.3842536258
   H         -0.0851510152       -0.4929745548        3.2698890697
   H         -0.6673279702       -0.5570231566        1.8738722498
   O         -1.8048360287       -1.2094295501        0.7577819365
   H         -1.3166411637       -1.7324500867        0.1218989818
   H         -2.0618832519       -0.4236517591        0.2753797928
   O          1.8529175155        1.2801975006       -0.8316664075
   H          2.4559596535        1.9592245698       -1.1341465871
   H          1.2688700649        1.7319358601       -0.2225253155
   O         -0.1566601030        0.1058211784       -2.3549112253
   H         -0.1288441644       -0.7989073187       -2.0435842906
   H          0.6160006752        0.5168730258       -1.9672728104
    24
 Energy=    -295.087691919462
   O          0.0410764718       -2.3195513782       -1.0002033862
   H          0.3207143558       -3.1931374133       -1.2738490206
   H          0.7616630509       -1.9951221380       -0.4600807241
   O         -1.9811693807        1.1379518712       -0.6009591207
   H         -1.4734162162        0.8321476636       -1.3525589813
   H         -1.3611123562        1.6551146668       -0.0868542976
   O          0.0316878112        2.2247631613        1.0019356494
   H         -0.2096582479        2.9563711731        1.5700321526
   H          0.0367766241        1.4627039491        1.5811348388
   O          1.8891603626       -1.1175166622        0.5520299843
   H          2.0606681949       -0.3159094697        0.0578207043
   H          1.3636095989       -0.8311040956        1.2990213340
   O          0.0342417045       -0.1451814786        2.3823923640
   H         -0.0818687183       -0.4858835178        3.2693378697
   H         -0.6651472021       -0.5559042043        1.8740678222
   O         -1.8037232644       -1.2137281480        0.7630586406
   H         -1.3134003751       -1.7360074470        0.1282046117
   H         -2.0618873154       -0.4288422602        0.2798016636
   O          1.8498411823        1.2848192416       -0.8384435953
   H          2.4456134637        1.9663643914       -1.1495439609
   H          1.2665463859        1.7361663789       -0.2282921533
   O         -0.1594066907        0.0999199424       -2.3535712926
   H         -0.1293031281       -0.8040453577       -2.0402466181
   H          0.6128707397        0.5134628892       -1.9678231343
    24
 Energy=    -295.089251535589
   O          0.0471889507       -2.3198219486       -0.9989480052
   H          0.3305982496       -3.1916218413       -1.2744039115
   H          0.7672758933       -1.9925661827       -0.4598651741
   O         -1.9852111100        1.1322381339       -0.5948904369
   H         -1.4795129159        0.8275373326       -1.3483216536
   H         -1.3647801663        1.6518401611       -0.0837045436
   O          0.0303396548        2.2258473438        1.0013374153
   H         -0.2103206494        2.9575912586        1.5695497886
   H          0.0349025283        1.4637231754        1.5804555138
   O          1.8941316177       -1.1098260387        0.5488224333
   H          2.0589193508       -0.3086227231        0.0516805118
   H          1.3693335737       -0.8245095091        1.2967618231
   O          0.0390409157       -0.1434081923        2.3824301574
   H         -0.0734290140       -0.4841710081        3.2698213103
   H         -0.6599689667       -0.5571952773        1.8760732945
   O         -1.7980765052       -1.2201764455        0.7680848539
   H         -1.3076022787       -1.7409423325        0.1321054800
   H         -2.0599052256       -0.4361655190        0.2853795314
   O          1.8422112518        1.2890079823       -0.8461166477
   H          2.4379094463        1.9708875485       -1.1566255175
   H          1.2606998848        1.7391583816       -0.2333842525
   O         -0.1680562761        0.0972139632       -2.3540890154
   H         -0.1333622570       -0.8062509018       -2.0397971083
   H          0.6041465547        0.5141106669       -1.9718171663
    24
 Energy=    -295.089251535590
   O          1.8941315524       -1.1098259828        0.5488225322
   H          1.3693334284       -0.8245094219        1.2967618540
   H          2.0589193025       -0.3086226947        0.0516805720
   O         -1.9852110586        1.1322380739       -0.5948902863
   H         -1.3647800791        1.6518401137       -0.0837044494
   H         -1.4795129413        0.8275373274       -1.3483215767
   O         -0.1680563188        0.0972140304       -2.3540890553
   H         -0.1333623034       -0.8062508509       -2.0397971947
   H          0.6041465160        0.5141107101       -1.9718171883
   O          0.0390407519       -0.1434081427        2.3824301835
   H         -0.6599690873       -0.5571952887        1.8760733108
   H         -0.0734291264       -0.4841710109        3.2698213228
   O          1.8422112851        1.2890079371       -0.8461167411
   H          2.4379093198        1.9708875419       -1.1566258328
   H          1.2606999684        1.7391583481       -0.2333843067
   O          0.0303398114        2.2258473628        1.0013373590
   H         -0.2103204035        2.9575914089        1.5695496010
   H          0.0349024943        1.4637232816        1.5804555739
   O          0.0471890104       -2.3198218852       -0.9989480648
   H          0.3305982620       -3.1916218351       -1.2744038388
   H          0.7672759108       -1.9925661318       -0.4598651698
   O         -1.7980765216       -1.2201766082        0.7680848411
   H         -1.3076022329       -1.7409424222        0.1321054553
   H         -2.0599052229       -0.4361656414        0.2853795738
    24
 Energy=    -295.088541868033
   O          1.8964494234       -1.1085962962        0.5497442285
   H          1.3709025325       -0.8236237403        1.2972888411
   H          2.0607837602       -0.3073415357        0.0525351432
   O         -1.9864732101        1.1320625458       -0.5973010540
   H         -1.3666550771        1.6510814073       -0.0847810609
   H         -1.4794746975        0.8269867820       -1.3497059494
   O         -0.1665068213        0.0965155685       -2.3533717936
   H         -0.1314005505       -0.8069305864       -2.0390718812
   H          0.6046944154        0.5141574972       -1.9698933563
   O          0.0386398000       -0.1447281480        2.3820283287
   H         -0.6602193708       -0.5580367960        1.8750730439
   H         -0.0742159091       -0.4861758869        3.2691071699
   O          1.8411320045        1.2908754205       -0.8451876908
   H          2.4318765205        1.9748291904       -1.1605604823
   H          1.2595052155        1.7401513814       -0.2319232868
   O          0.0273742046        2.2249401197        1.0017993008
   H         -0.2142290559        2.9562785751        1.5701335055
   H          0.0327976814        1.4627056918        1.5807648464
   O          0.0495274132       -2.3197852727       -0.9973431970
   H          0.3307232859       -3.1932657133       -1.2697264582
   H          0.7699814782       -1.9928832937       -0.4585362962
   O         -1.7981744001       -1.2201426745        0.7662032194
   H         -1.3058154180       -1.7397600041        0.1307409440
   H         -2.0607494389       -0.4364331792        0.2834138077
    24
 Energy=    -295.087384263205
   O          1.8979546256       -1.1081366939        0.5511690626
   H          1.3717432488       -0.8237957461        1.2984867008
   H          2.0616199219       -0.3066701723        0.0540806141
   O         -1.9873524409        1.1313971150       -0.5995452790
   H         -1.3676683214        1.6499001079       -0.0863415394
   H         -1.4798423075        0.8260986788       -1.3515148058
   O         -0.1657729457        0.0964095324       -2.3542928869
   H         -0.1302439633       -0.8068613854       -2.0395371395
   H          0.6052178583        0.5146128666       -1.9710031905
   O          0.0390290473       -0.1453839726        2.3831757059
   H         -0.6598057566       -0.5585323201        1.8760561935
   H         -0.0739963184       -0.4869527706        3.2701863388
   O          1.8400151925        1.2916841795       -0.8441341980
   H          2.4270195425        1.9781136099       -1.1611079668
   H          1.2569381904        1.7389004285       -0.2307414395
   O          0.0245722787        2.2233721127        1.0017721959
   H         -0.2171258242        2.9549118802        1.5698069093
   H          0.0310406623        1.4615339372        1.5812483338
   O          0.0509862857       -2.3190279708       -0.9976919007
   H          0.3326049582       -3.1916403249       -1.2724107439
   H          0.7714081942       -1.9931042125       -0.4582497653
   O         -1.7971680978       -1.2190814989        0.7662599492
   H         -1.3057246547       -1.7402464553        0.1313565940
   H         -2.0594085546       -0.4359929772        0.2822825220
    24
 Energy=    -295.086038739644
   O          1.8976538475       -1.1085122077        0.5507561075
   H          1.3716880144       -0.8239144280        1.2981488330
   H          2.0620183828       -0.3070546803        0.0538839194
   O         -1.9879375591        1.1296848812       -0.6001273386
   H         -1.3688027378        1.6477374511       -0.0858069640
   H         -1.4798909729        0.8258794837       -1.3523392681
   O         -0.1645707785        0.0976105196       -2.3539579352
   H         -0.1298799330       -0.8056293204       -2.0390195655
   H          0.6050208916        0.5160312676       -1.9681022900
   O          0.0394886109       -0.1450922631        2.3834586606
   H         -0.6588102419       -0.5587211367        1.8759926941
   H         -0.0737855848       -0.4866838606        3.2704287712
   O          1.8395873464        1.2927813213       -0.8430306652
   H          2.4245974423        1.9796427099       -1.1627437563
   H          1.2569037300        1.7402298118       -0.2294334915
   O          0.0224482898        2.2235317981        1.0020686396
   H         -0.2190542483        2.9553282766        1.5698558163
   H          0.0298162583        1.4620733146        1.5820328893
   O          0.0519520583       -2.3186891507       -0.9987614426
   H          0.3341037451       -3.1904484791       -1.2756331437
   H          0.7722526395       -1.9935860480       -0.4586624837
   O         -1.7962158101       -1.2201081124        0.7663622465
   H         -1.3057846486       -1.7424548829        0.1316473758
   H         -2.0588888166       -0.4377380596        0.2814583054
    24
 Energy=    -295.084127850304
   O          1.8961977612       -1.1087247054        0.5499023414
   H          1.3713184365       -0.8239795855        1.2980024358
   H          2.0604320940       -0.3072546606        0.0530072909
   O         -1.9876038971        1.1287780246       -0.6012801080
   H         -1.3702419825        1.6488646999       -0.0868814721
   H         -1.4781252314        0.8255966348       -1.3527748678
   O         -0.1623037547        0.0973716327       -2.3538797610
   H         -0.1286682121       -0.8057927215       -2.0386106069
   H          0.6058710217        0.5159423030       -1.9653724292
   O          0.0399712706       -0.1450288793        2.3840691459
   H         -0.6582766925       -0.5580549016        1.8760424468
   H         -0.0739826322       -0.4869329089        3.2708317876
   O          1.8386134237        1.2938757494       -0.8419813387
   H          2.4216845769        1.9809158872       -1.1648369092
   H          1.2566030214        1.7419010531       -0.2281661720
   O          0.0215722240        2.2243247637        1.0032527131
   H         -0.2206506353        2.9554487466        1.5715991286
   H          0.0304948388        1.4625670915        1.5828020860
   O          0.0508224465       -2.3197496593       -1.0001066353
   H          0.3337722384       -3.1904316989       -1.2795418535
   H          0.7709136123       -1.9954955264       -0.4592186522
   O         -1.7946491439       -1.2198037327        0.7668621142
   H         -1.3049446480       -1.7423021852        0.1317111764
   H         -2.0581250941       -0.4376833279        0.2819910633
    24
 Energy=    -295.082509018906
   O          1.8952620157       -1.1092052696        0.5494569613
   H          1.3713279698       -0.8249939984        1.2984221867
   H          2.0587191610       -0.3074088057        0.0528323222
   O         -1.9865678844        1.1284786373       -0.6023018976
   H         -1.3700895417        1.6502263716       -0.0885260762
   H         -1.4764406452        0.8248509034       -1.3531762140
   O         -0.1610883428        0.0964698136       -2.3546314132
   H         -0.1277594948       -0.8066213883       -2.0391202266
   H          0.6068386519        0.5150688533       -1.9656650717
   O          0.0407007062       -0.1447853244        2.3848766592
   H         -0.6575615425       -0.5574866341        1.8766057658
   H         -0.0734895433       -0.4869282825        3.2715167345
   O          1.8379760341        1.2941418626       -0.8410899544
   H          2.4197888780        1.9815122473       -1.1655088330
   H          1.2560895801        1.7422161625       -0.2271930442
   O          0.0207406821        2.2251974450        1.0041979548
   H         -0.2219814758        2.9557001105        1.5731299804
   H          0.0305175215        1.4630387555        1.5832060595
   O          0.0498604248       -2.3201270763       -1.0005835247
   H          0.3332908887       -3.1901955731       -1.2814390447
   H          0.7698216746       -1.9963125150       -0.4592594363
   O         -1.7941706353       -1.2191940903        0.7669645640
   H         -1.3047906779       -1.7414805916        0.1313893065
   H         -2.0576894102       -0.4368015808        0.2825560007
    24
 Energy=    -295.081407347678
   O          1.8953141873       -1.1091163058        0.5496365698
   H          1.3717306117       -0.8253520970        1.2990162821
   H          2.0579285433       -0.3071370319        0.0530304327
   O         -1.9861105665        1.1287613873       -0.6026644400
   H         -1.3698635089        1.6511307150       -0.0892428886
   H         -1.4757776015        0.8246317725       -1.3531957733
   O         -0.1606364176        0.0956089439       -2.3553416926
   H         -0.1271760827       -0.8073959208       -2.0395973969
   H          0.6074500466        0.5143155003       -1.9668061819
   O          0.0408387561       -0.1449141959        2.3852004784
   H         -0.6574918830       -0.5573335011        1.8767946611
   H         -0.0734896441       -0.4872260137        3.2717575698
   O          1.8376572118        1.2940677107       -0.8409262050
   H          2.4193363604        1.9814956151       -1.1654629277
   H          1.2559216012        1.7420634828       -0.2268290567
   O          0.0204810228        2.2254774834        1.0045764019
   H         -0.2223406109        2.9558174870        1.5736747883
   H          0.0305205300        1.4632153967        1.5834438820
   O          0.0492697779       -2.3203297852       -1.0005353813
   H          0.3328840175       -3.1901717958       -1.2819064525
   H          0.7692069594       -1.9966424533       -0.4591032010
   O         -1.7941109216       -1.2185944576        0.7669529914
   H         -1.3047158744       -1.7407863519        0.1313116198
   H         -2.0573722677       -0.4359972957        0.2827350798
    24
 Energy=    -295.074873525083
   O          1.8958066844       -1.1092628521        0.5501554665
   H          1.3727201965       -0.8251819116        1.2997622870
   H          2.0600856326       -0.3071246945        0.0543544547
   O         -1.9864186436        1.1283049030       -0.6008211485
   H         -1.3705976129        1.6514519420       -0.0876803551
   H         -1.4759231117        0.8244492425       -1.3513528863
   O         -0.1589791909        0.0962429083       -2.3564098704
   H         -0.1260593869       -0.8068848129       -2.0409602773
   H          0.6087885747        0.5146330468       -1.9669048127
   O          0.0429228771       -0.1434898016        2.3860747385
   H         -0.6551406424       -0.5567447557        1.8779807456
   H         -0.0709335554       -0.4855199329        3.2728012702
   O          1.8374122056        1.2942208577       -0.8393000506
   H          2.4169717348        1.9822394885       -1.1663672544
   H          1.2551252276        1.7424376057       -0.2258870884
   O          0.0192413066        2.2261284134        1.0045884998
   H         -0.2237771556        2.9559945851        1.5742105136
   H          0.0294368319        1.4634456308        1.5828988527
   O          0.0472230871       -2.3209626087       -1.0030950591
   H          0.3308992533       -3.1907445271       -1.2845894411
   H          0.7669806682       -1.9974475611       -0.4613212331
   O         -1.7943778309       -1.2202495457        0.7657801670
   H         -1.3054995360       -1.7422408326        0.1295766232
   H         -2.0583650444       -0.4376789039        0.2819147087
    24
 Energy=    -295.070748266700
   O          1.8931637867       -1.1141342385        0.5478144169
   H          1.3723506643       -0.8293716608        1.2987443776
   H          2.0627650135       -0.3112262385        0.0550609213
   O         -1.9848195781        1.1246927311       -0.6013091198
   H         -1.3694038983        1.6487869835       -0.0886488077
   H         -1.4748015003        0.8227097370       -1.3529205032
   O         -0.1573264379        0.0992103207       -2.3572079382
   H         -0.1269045984       -0.8044128290       -2.0429285161
   H          0.6096411674        0.5158959574       -1.9643140435
   O          0.0431576972       -0.1416481701        2.3835743654
   H         -0.6543111906       -0.5589375047        1.8779672038
   H         -0.0674959613       -0.4819149862        3.2713840869
   O          1.8368916591        1.2952852992       -0.8337758902
   H          2.4100956927        1.9851246797       -1.1681269109
   H          1.2524687968        1.7440315719       -0.2227860861
   O          0.0148236115        2.2297134707        1.0059861644
   H         -0.2288620083        2.9580531785        1.5772745580
   H          0.0253271737        1.4656537504        1.5824705605
   O          0.0471496632       -2.3195520891       -1.0075233128
   H          0.3310147949       -3.1891064683       -1.2895297108
   H          0.7664146112       -1.9965958098       -0.4647627613
   O         -1.7899171753       -1.2226549026        0.7694762474
   H         -1.3030807672       -1.7439065147        0.1311041704
   H         -2.0551896103       -0.4393825904        0.2874525341
    24
 Energy=    -295.055712028084
   O          1.8908406955       -1.1169146754        0.5459123088
   H          1.3701726153       -0.8289817267        1.2957330923
   H          2.0685869446       -0.3146896415        0.0549203475
   O         -1.9872395605        1.1212103373       -0.5982196142
   H         -1.3723420052        1.6446763770       -0.0842973031
   H         -1.4773739663        0.8229012105       -1.3513999251
   O         -0.1560054915        0.1049370204       -2.3551939688
   H         -0.1283324425       -0.7993699476       -2.0426320547
   H          0.6081986089        0.5204256911       -1.9557029207
   O          0.0447708386       -0.1390573911        2.3819575766
   H         -0.6519954024       -0.5598353270        1.8782765523
   H         -0.0636785883       -0.4774543075        3.2707534411
   O          1.8380209218        1.2967726218       -0.8308151383
   H          2.4069444372        1.9874255096       -1.1707511060
   H          1.2516471729        1.7466013435       -0.2224963176
   O          0.0128435874        2.2309719901        1.0051932130
   H         -0.2316832756        2.9584388363        1.5772338068
   H          0.0231410800        1.4661426184        1.5806598357
   O          0.0478114645       -2.3187423679       -1.0121207907
   H          0.3312686975       -3.1887473509       -1.2931459972
   H          0.7667912361       -1.9959188738       -0.4689035969
   O         -1.7874777042       -1.2282955789        0.7703319483
   H         -1.3023647571       -1.7496019369        0.1306938087
   H         -2.0560163796       -0.4461237733        0.2883297839
    24
 Energy=    -295.038523869630
   O          1.8887577222       -1.1183440392        0.5438511348
   H          1.3677222294       -0.8295138557        1.2930713830
   H          2.0682830550       -0.3164543832        0.0529586062
   O         -1.9875860486        1.1197683160       -0.5986602653
   H         -1.3727088058        1.6429158303       -0.0843894275
   H         -1.4778153752        0.8223010790       -1.3522376956
   O         -0.1563839515        0.1065338512       -2.3537098568
   H         -0.1294135959       -0.7978921567       -2.0414310772
   H          0.6068228110        0.5219145942       -1.9522050423
   O          0.0466668246       -0.1372213339        2.3830071105
   H         -0.6498641507       -0.5584522392        1.8793793066
   H         -0.0617340733       -0.4753926242        3.2718947659
   O          1.8384088783        1.2972049430       -0.8306036849
   H          2.4074761491        1.9876966295       -1.1706264962
   H          1.2517844740        1.7473203367       -0.2227387488
   O          0.0125358412        2.2307406913        1.0047566307
   H         -0.2325517135        2.9578869578        1.5769648425
   H          0.0227760702        1.4656757682        1.5799110806
   O          0.0500114879       -2.3175258014       -1.0110770029
   H          0.3333961698       -3.1875642455       -1.2920717854
   H          0.7690319798       -1.9947304038       -0.4678970110
   O         -1.7887266290       -1.2302454401        0.7694684353
   H         -1.3039337960       -1.7517119914        0.1297181833
   H         -2.0582174278       -0.4485782853        0.2871790943
    24
 Energy=    -295.034769141957
   O          1.8847706896       -1.1188125509        0.5424644482
   H          1.3647352465       -0.8309107552        1.2927360883
   H          2.0686966008       -0.3155130329        0.0555219632
   O         -1.9923161775        1.1196235063       -0.5888509663
   H         -1.3790978801        1.6453383555       -0.0752177732
   H         -1.4823255745        0.8249879206       -1.3433914201
   O         -0.1551569762        0.1142678224       -2.3468232641
   H         -0.1275098651       -0.7933707766       -2.0440698152
   H          0.6104678750        0.5247516144       -1.9448861001
   O          0.0412529595       -0.1404065967        2.3807522745
   H         -0.6538093915       -0.5612955193        1.8748148445
   H         -0.0692830050       -0.4797358997        3.2689354001
   O          1.8477540053        1.2984984012       -0.8294283636
   H          2.4033170912        1.9909165624       -1.1873928699
   H          1.2606425072        1.7509285920       -0.2237561328
   O          0.0167197696        2.2311001801        1.0033251248
   H         -0.2253524164        2.9596120086        1.5750798034
   H          0.0281755283        1.4670987456        1.5798686303
   O          0.0458266086       -2.3197384235       -1.0222203447
   H          0.3281695561       -3.1915360051       -1.2987764452
   H          0.7634491930       -1.9966759636       -0.4773531008
   O         -1.7847276231       -1.2338894941        0.7690108441
   H         -1.3015103355       -1.7540199844        0.1269850143
   H         -2.0547372244       -0.4508613786        0.2892258656
    24
 Energy=    -295.019179619690
   O          1.8813143490       -1.1195819318        0.5400051487
   H          1.3617371958       -0.8331846388        1.2911695863
   H          2.0661985842       -0.3151161536        0.0553563365
   O         -1.9934987379        1.1196285721       -0.5849168644
   H         -1.3809158419        1.6471257192       -0.0723538972
   H         -1.4837077893        0.8257043912       -1.3398695813
   O         -0.1553692404        0.1189694349       -2.3418322126
   H         -0.1267512927       -0.7905113848       -2.0447505879
   H          0.6127288237        0.5264619784       -1.9415735075
   O          0.0400049683       -0.1409468473        2.3817492135
   H         -0.6540558095       -0.5606626244        1.8734676545
   H         -0.0727551457       -0.4817489885        3.2690884368
   O          1.8529293137        1.2987221203       -0.8288403516
   H          2.4008749806        1.9916361539       -1.1974289137
   H          1.2665185817        1.7528082874       -0.2237287534
   O          0.0195221763        2.2305964060        1.0024617784
   H         -0.2204786035        2.9599593043        1.5740046274
   H          0.0317281965        1.4672258904        1.5798250169
   O          0.0447332334       -2.3206805137       -1.0264614332
   H          0.3265796238       -3.1933994351       -1.3006076287
   H          0.7614848363       -1.9974778039       -0.4805319615
   O         -1.7853539143       -1.2361836493        0.7669223821
   H         -1.3028158275       -1.7553159093        0.1235791368
   H         -2.0548848839       -0.4518822437        0.2889514608
    24
 Energy=    -295.008372885287
   O          1.8803624052       -1.1196454009        0.5397877305
   H          1.3612169598       -0.8345692438        1.2917527770
   H          2.0646854170       -0.3143716034        0.0562683634
   O         -1.9931550446        1.1206060508       -0.5824981586
   H         -1.3808569876        1.6491373046       -0.0706606423
   H         -1.4834448389        0.8266175366       -1.3374803437
   O         -0.1554437247        0.1200835729       -2.3409365330
   H         -0.1262418837       -0.7902430293       -2.0465140986
   H          0.6148082937        0.5258245633       -1.9430446923
   O          0.0397197008       -0.1414956266        2.3828205717
   H         -0.6537692847       -0.5604916380        1.8731665622
   H         -0.0742806296       -0.4832517008        3.2696342785
   O          1.8550489048        1.2986083667       -0.8284444943
   H          2.3986771996        1.9919420982       -1.2025948035
   H          1.2690055152        1.7532863492       -0.2234214223
   O          0.0204902238        2.2307742857        1.0026560948
   H         -0.2179150961        2.9608152859        1.5740008956
   H          0.0329991032        1.4678674057        1.5806253504
   O          0.0431707127       -2.3215428436       -1.0288899011
   H          0.3248380803       -3.1946702788       -1.3019170350
   H          0.7594371428       -1.9982836883       -0.4823574138
   O         -1.7858927055       -1.2369282929        0.7650760897
   H         -1.3035493219       -1.7554292310        0.1210780481
   H         -2.0544172298       -0.4515419236        0.2883217812
    24
 Energy=    -294.996514829597
   O          1.8809156441       -1.1217450835        0.5392992520
   H          1.3613455467       -0.8368717095        1.2910478235
   H          2.0634638010       -0.3166533757        0.0548043063
   O         -1.9896451016        1.1258642814       -0.5801786276
   H         -1.3755724452        1.6523967291       -0.0684070046
   H         -1.4810171514        0.8303338293       -1.3352886859
   O         -0.1607717408        0.1187048327       -2.3395103071
   H         -0.1313854530       -0.7923062142       -2.0472310594
   H          0.6130517111        0.5220320076       -1.9461195405
   O          0.0388029761       -0.1447508364        2.3809272841
   H         -0.6553190594       -0.5626762550        1.8712560328
   H         -0.0749899136       -0.4872660764        3.2674747045
   O          1.8540110056        1.2966520729       -0.8309568368
   H          2.3862874757        1.9927848733       -1.2160707466
   H          1.2681768927        1.7499841146       -0.2247223177
   O          0.0242792949        2.2319875395        1.0065500902
   H         -0.2092728386        2.9625148170        1.5792761484
   H          0.0352028648        1.4684911880        1.5837726096
   O          0.0442462067       -2.3216451925       -1.0286559572
   H          0.3257566441       -3.1955940488       -1.2992056018
   H          0.7592081488       -1.9981795983       -0.4805398466
   O         -1.7873142877       -1.2345513058        0.7627356050
   H         -1.3042058439       -1.7508569714        0.1175483987
   H         -2.0531143340       -0.4463942411        0.2890367379
    24
 Energy=    -294.983143361443
   O          1.8842427448       -1.1222033777        0.5403073919
   H          1.3635438915       -0.8361325775        1.2908192448
   H          2.0660733167       -0.3181108447        0.0538871194
   O         -1.9879317576        1.1320295405       -0.5768640716
   H         -1.3718688398        1.6560802938       -0.0649371929
   H         -1.4802584880        0.8342960503       -1.3317511228
   O         -0.1649065763        0.1170961921       -2.3389554193
   H         -0.1351112823       -0.7940086178       -2.0470100377
   H          0.6105892638        0.5197896742       -1.9482176539
   O          0.0400094976       -0.1464790460        2.3792977533
   H         -0.6553110919       -0.5632857237        1.8703446009
   H         -0.0729798736       -0.4893547802        3.2658085953
   O          1.8507214846        1.2947585511       -0.8334342543
   H          2.3739202283        1.9927159173       -1.2275794426
   H          1.2661644803        1.7472305403       -0.2253273166
   O          0.0287046071        2.2312489040        1.0089603104
   H         -0.2007473107        2.9615967957        1.5835694075
   H          0.0375886844        1.4665750695        1.5846571403
   O          0.0441513028       -2.3225976732       -1.0281980674
   H          0.3255317560       -3.1972872370       -1.2964797244
   H          0.7579462214       -1.9988883054       -0.4787065757
   O         -1.7902624537       -1.2332406409        0.7594790367
   H         -1.3060484020       -1.7476309836        0.1135911459
   H         -2.0546941399       -0.4433844683        0.2878489381
    24
 Energy=    -294.968545247630
   O          1.8881809443       -1.1228965834        0.5409244725
   H          1.3661832063       -0.8348301757        1.2897688797
   H          2.0703747241       -0.3201780489        0.0523753746
   O         -1.9894533815        1.1381828610       -0.5736531357
   H         -1.3709693247        1.6591073126       -0.0614549055
   H         -1.4829112086        0.8377247240       -1.3282204124
   O         -0.1690014030        0.1160504825       -2.3365482032
   H         -0.1381257545       -0.7950935221       -2.0448374953
   H          0.6059812265        0.5195784762       -1.9456531762
   O          0.0393440658       -0.1499081528        2.3741466501
   H         -0.6581415980       -0.5659038862        1.8674977198
   H         -0.0714731926       -0.4922029098        3.2611560495
   O          1.8489279171        1.2934056196       -0.8369064768
   H          2.3647621984        1.9921054385       -1.2393557249
   H          1.2670386837        1.7459380877       -0.2262911107
   O          0.0338198758        2.2298867636        1.0096866265
   H         -0.1924656548        2.9592564696        1.5867884638
   H          0.0403100059        1.4633634403        1.5829507131
   O          0.0450245396       -2.3227358906       -1.0259829600
   H          0.3262675185       -3.1981778491       -1.2919446191
   H          0.7576662781       -1.9987327305       -0.4751694301
   O         -1.7919220962       -1.2312076295        0.7590243374
   H         -1.3064854195       -1.7437282227        0.1125680632
   H         -2.0567390780       -0.4406661307        0.2887606402
    24
 Energy=    -294.949586779944
   O          1.8920555883       -1.1239010549        0.5398409345
   H          1.3681740700       -0.8332427862        1.2863647222
   H          2.0760671308       -0.3227855642        0.0493457123
   O         -1.9950333180        1.1429458109       -0.5709326666
   H         -1.3734605168        1.6601312157       -0.0586843383
   H         -1.4901457843        0.8391112150       -1.3252568386
   O         -0.1729016260        0.1162025876       -2.3307180386
   H         -0.1397189105       -0.7951220047       -2.0398259027
   H          0.5986863253        0.5223943943       -1.9358863156
   O          0.0416016441       -0.1519625923        2.3696121773
   H         -0.6585239989       -0.5670386371        1.8658584665
   H         -0.0666310063       -0.4933124254        3.2573045929
   O          1.8503365351        1.2925712656       -0.8417191619
   H          2.3615319137        1.9902912502       -1.2517166595
   H          1.2735137541        1.7468299719       -0.2275886001
   O          0.0390580429        2.2273987202        1.0077644814
   H         -0.1853310665        2.9546744519        1.5882396124
   H          0.0426846955        1.4580835360        1.5773018680
   O          0.0472278846       -2.3212344785       -1.0211581823
   H          0.3282640327       -3.1974989055       -1.2846181930
   H          0.7587479821       -1.9968608572       -0.4691140311
   O         -1.7972451931       -1.2309384981        0.7578917595
   H         -1.3104770930       -1.7417439217        0.1110792087
   H         -2.0649744538       -0.4412191038        0.2878958433
    24
 Energy=    -294.939272938022
   O          1.8921388907       -1.1252588394        0.5376727762
   H          1.3678922157       -0.8339841536        1.2836998006
   H          2.0777430677       -0.3243308743        0.0474714662
   O         -1.9990171559        1.1423095595       -0.5702108093
   H         -1.3772487491        1.6596042207       -0.0583103094
   H         -1.4942586043        0.8378201701       -1.3243572515
   O         -0.1718441871        0.1174741952       -2.3281522301
   H         -0.1382068800       -0.7940813687       -2.0380370366
   H          0.5987814563        0.5240479671       -1.9318370453
   O          0.0423514082       -0.1515144116        2.3671668312
   H         -0.6585477295       -0.5669757395        1.8648082702
   H         -0.0647828192       -0.4918501013        3.2553817352
   O          1.8527543574        1.2934170113       -0.8412845620
   H          2.3653734852        1.9903745845       -1.2508008753
   H          1.2764162578        1.7484855640       -0.2272985301
   O          0.0389813312        2.2260564105        1.0051244676
   H         -0.1869879668        2.9524697347        1.5860662881
   H          0.0423712818        1.4560945183        1.5737887208
   O          0.0484923338       -2.3199354328       -1.0188981287
   H          0.3295976435       -3.1961363315       -1.2824956060
   H          0.7600251639       -1.9955592685       -0.4668718831
   O         -1.7987129012       -1.2313937910        0.7590810610
   H         -1.3122097630       -1.7420296735        0.1119353803
   H         -2.0682632932       -0.4424244750        0.2888663818
    24
 Energy=    -294.910702771631
   O          1.8900633465       -1.1207797266        0.5428276670
   H          1.3664288814       -0.8313205221        1.2899904043
   H          2.0698430073       -0.3195425659        0.0509637368
   O         -1.9901535295        1.1437972376       -0.5737152012
   H         -1.3652023594        1.6569900080       -0.0615618496
   H         -1.4877280083        0.8379702278       -1.3288776180
   O         -0.1782677462        0.1144840838       -2.3311147797
   H         -0.1434236639       -0.7963711210       -2.0389495425
   H          0.5905056183        0.5235450838       -1.9337629806
   O          0.0381980489       -0.1554943380        2.3709169017
   H         -0.6609759462       -0.5688433467        1.8644288350
   H         -0.0715635636       -0.5000543863        3.2571801818
   O          1.8465472417        1.2891068543       -0.8510390266
   H          2.3540631597        1.9850490107       -1.2685602212
   H          1.2785275622        1.7456026391       -0.2303965513
   O          0.0441150756        2.2270744808        1.0157077018
   H         -0.1726067474        2.9556464955        1.5974690884
   H          0.0454695466        1.4575867540        1.5850218890
   O          0.0512693556       -2.3221414878       -1.0201119662
   H          0.3315878050       -3.1996017983       -1.2803365047
   H          0.7618727000       -1.9973213361       -0.4671503076
   O         -1.7971175469       -1.2247283553        0.7569446787
   H         -1.3078739715       -1.7353635939        0.1118677708
   H         -2.0633919519       -0.4350715305        0.2860180598
    24
 Energy=    -294.867270466594
   O          1.8872154356       -1.1161244836        0.5459500630
   H          1.3637602670       -0.8283944511        1.2939059139
   H          2.0592592125       -0.3150490889        0.0510652372
   O         -1.9802477032        1.1522891694       -0.5736012454
   H         -1.3518081266        1.6614123497       -0.0616548362
   H         -1.4802424629        0.8437692876       -1.3292745095
   O         -0.1822324878        0.1055044709       -2.3434769447
   H         -0.1467031088       -0.8048640977       -2.0498810106
   H          0.5857890962        0.5159622752       -1.9461117758
   O          0.0323408574       -0.1587279232        2.3827967475
   H         -0.6648211832       -0.5668274341        1.8693264773
   H         -0.0824299833       -0.5104969213        3.2655866806
   O          1.8333749971        1.2886267326       -0.8568873317
   H          2.3362628697        1.9807051345       -1.2862625910
   H          1.2812535163        1.7496954788       -0.2253738151
   O          0.0523651849        2.2236680006        1.0219960598
   H         -0.1504821712        2.9555964031        1.6045470050
   H          0.0505299525        1.4551474974        1.5926138900
   O          0.0547498572       -2.3217475117       -1.0173325333
   H          0.3339009660       -3.2009643326       -1.2728404204
   H          0.7640683895       -1.9963398214       -0.4630682508
   O         -1.7940079961       -1.2219379495        0.7511186660
   H         -1.3011946590       -1.7332819515        0.1093288512
   H         -2.0540728953       -0.4308784178        0.2790774543
    24
 Energy=    -294.798530737753
   O          1.8832706431       -1.1139548707        0.5510031894
   H          1.3599689725       -0.8269878027        1.2993594571
   H          2.0490889802       -0.3134747728        0.0530396045
   O         -1.9659934462        1.1599557275       -0.5726712395
   H         -1.3374133517        1.6669473997       -0.0587856986
   H         -1.4655975150        0.8526421198       -1.3285773835
   O         -0.1875611911        0.0975053408       -2.3552598297
   H         -0.1536924030       -0.8120466795       -2.0589494054
   H          0.5829952872        0.5069465115       -1.9617722421
   O          0.0306069325       -0.1592868431        2.3932326229
   H         -0.6634888071       -0.5651300363        1.8738539106
   H         -0.0887763793       -0.5156808940        3.2735523065
   O          1.8190592014        1.2852978258       -0.8604122605
   H          2.3135066386        1.9794619166       -1.2961757134
   H          1.2676942005        1.7447112196       -0.2270341670
   O          0.0582285492        2.2261857515        1.0343521134
   H         -0.1368249791        2.9607718105        1.6162191798
   H          0.0569330577        1.4593484078        1.6072313765
   O          0.0561227663       -2.3238195837       -1.0224470919
   H          0.3351281779       -3.2033613322       -1.2769940090
   H          0.7648474005       -1.9984603675       -0.4673951906
   O         -1.7903340757       -1.2204906415        0.7432617377
   H         -1.2956173353       -1.7317252429        0.1028506438
   H         -2.0431420171       -0.4262455628        0.2726294612
    24
 Energy=    -294.449567233388
   O          1.8922340732       -1.0986656643        0.5624216235
   H          1.3661136692       -0.8009751379        1.3045870437
   H          2.0480935789       -0.3078251279        0.0461746859
   O         -1.9668338902        1.1569217601       -0.5938662838
   H         -1.3372495651        1.6666620808       -0.0839445025
   H         -1.4692432932        0.8497906723       -1.3516960356
   O         -0.1784743354        0.0951352731       -2.3642058814
   H         -0.1506307396       -0.8129420450       -2.0627889633
   H          0.5902271730        0.5037616036       -1.9662682567
   O          0.0204745463       -0.1672612244        2.3966272170
   H         -0.6819388385       -0.5680038708        1.8845211654
   H         -0.0884475552       -0.5277017742        3.2766558677
   O          1.8219052275        1.2858567511       -0.8838975968
   H          2.2750741311        2.0148294347       -1.3075349551
   H          1.2723974062        1.6992882068       -0.2180542024
   O          0.0756966378        2.1993915964        1.0268166007
   H         -0.0759094116        2.9491320826        1.6022613410
   H          0.0400221346        1.4396878847        1.6080303654
   O          0.0497416251       -2.3190089632       -0.9948317532
   H          0.3153365472       -3.2131003050       -1.2099871617
   H          0.7556053055       -1.9857141353       -0.4408436103
   O         -1.8081986550       -1.2005492409        0.7581685413
   H         -1.3094135600       -1.7229666232        0.1300560134
   H         -2.0547606513       -0.4130475537        0.2731117254
    24
 Energy=    -294.314340797412
   O          1.8911012464       -1.0979198777        0.5543911110
   H          1.3630893734       -0.7982761381        1.2944241720
   H          2.0577281750       -0.3064984948        0.0424150359
   O         -1.9730775492        1.1490165467       -0.5997897435
   H         -1.3461645183        1.6629954025       -0.0908323508
   H         -1.4732631363        0.8411052651       -1.3558373844
   O         -0.1684703996        0.0958002685       -2.3557018346
   H         -0.1404318122       -0.8127020419       -2.0555864740
   H          0.5992061990        0.5044445921       -1.9558089781
   O          0.0243980205       -0.1652048737        2.3939305246
   H         -0.6799895692       -0.5661919849        1.8847357680
   H         -0.0806885970       -0.5257666788        3.2743757685
   O          1.8305766349        1.2997167875       -0.8817269103
   H          2.2675156210        2.0333955437       -1.3141984643
   H          1.2861186884        1.7077383498       -0.2084396097
   O          0.0688929248        2.1947008766        1.0221146950
   H         -0.0754647361        2.9439568943        1.6000490561
   H          0.0273620398        1.4335526922        1.6010451460
   O          0.0547602272       -2.3162678692       -0.9819589791
   H          0.3148371584       -3.2149372332       -1.1844070072
   H          0.7600326993       -1.9812825477       -0.4282375560
   O         -1.8211658344       -1.2078459083        0.7550257860
   H         -1.3233677175       -1.7317947609        0.1274060964
   H         -2.0687641982       -0.4216740649        0.2683423952
    24
 Energy=    -293.788833851330
   O          1.8925741622       -1.0885877578        0.5304661152
   H          1.3581933000       -0.7873835758        1.2652755971
   H          2.1260009753       -0.2885366982        0.0596561056
   O         -1.9876284415        1.1221423739       -0.5971032227
   H         -1.3880579237        1.6618009822       -0.0818211439
   H         -1.4607733275        0.8159651874       -1.3352841351
   O         -0.1219491097        0.0965696063       -2.3069073093
   H         -0.0854817189       -0.8149957561       -2.0171650800
   H          0.6342366746        0.5109226044       -1.8913035408
   O          0.0142575903       -0.1721583607        2.3501262640
   H         -0.6876412468       -0.5858648179        1.8477152473
   H         -0.0793543599       -0.5301434307        3.2329146488
   O          1.8536570199        1.3660098473       -0.8500483963
   H          2.1796111881        2.1049764604       -1.3637740671
   H          1.2994436134        1.7656374744       -0.1796924462
   O          0.0326471668        2.2173520659        1.0287184840
   H         -0.1184241204        2.9437588074        1.6334850109
   H          0.0042670522        1.4357657863        1.5805783364
   O          0.0576059143       -2.3409503704       -0.9950701106
   H          0.2975768200       -3.2523633020       -1.1623192436
   H          0.7619910368       -2.0051756952       -0.4406976666
   O         -1.8299003829       -1.2473882805        0.7446674367
   H         -1.3388224402       -1.7653409349        0.1068592037
   H         -2.0829882318       -0.4568490760        0.2679849985
    24
 Energy=    -292.766767223332
   O          1.8794079309       -1.0999851413        0.5087696347
   H          1.3402435924       -0.8009269092        1.2409566532
   H          2.1654497100       -0.2950634291        0.0768981517
   O         -1.9831884598        1.1090202514       -0.5791966579
   H         -1.4127206737        1.6713703744       -0.0552112725
   H         -1.4283551513        0.8082674425       -1.2988768561
   O         -0.0893114304        0.1021666494       -2.2637880675
   H         -0.0501599197       -0.8142908894       -1.9902838104
   H          0.6547984570        0.5153232706       -1.8257995723
   O          0.0065593883       -0.1692905436        2.3196929510
   H         -0.6868433346       -0.5943080166        1.8149309759
   H         -0.0857477743       -0.5269510294        3.2027502564
   O          1.8590753636        1.4248130840       -0.8183207715
   H          2.0818672781        2.1314997708       -1.4242824283
   H          1.2889793019        1.8363920624       -0.1688401598
   O          0.0013476832        2.2495375872        1.0489274941
   H         -0.1716410015        2.9473985806        1.6808268444
   H          0.0035693838        1.4476428976        1.5716050341
   O          0.0611226963       -2.3680693110       -1.0288032039
   H          0.2888720635       -3.2850115800       -1.1823575623
   H          0.7656980793       -2.0356817671       -0.4726342634
   O         -1.8190213973       -1.2927158794        0.7191890401
   H         -1.3335447145       -1.7992989582        0.0680993268
   H         -2.0763336917       -0.4939889686        0.2586919769
    24
 Energy=    -291.998737581970
   O          1.8673100329       -1.1065627363        0.4966632013
   H          1.3262164258       -0.8096299052        1.2282918244
   H          2.1735054726       -0.3000942997        0.0818320869
   O         -1.9772579870        1.0960450941       -0.5658122049
   H         -1.4198797205        1.6673854782       -0.0374832604
   H         -1.4103871402        0.7992821309       -1.2777258420
   O         -0.0750135113        0.1095992440       -2.2425999646
   H         -0.0384406326       -0.8102369837       -1.9803108516
   H          0.6632936925        0.5176731871       -1.7902616291
   O          0.0048367200       -0.1688794793        2.3103253283
   H         -0.6813696727       -0.6014406035        1.8021486854
   H         -0.0888608964       -0.5264663303        3.1932660062
   O          1.8591813524        1.4447994311       -0.8028372355
   H          2.0350057541        2.1216113903       -1.4564756613
   H          1.2810837407        1.8683706429       -0.1683118854
   O         -0.0131147300        2.2705935573        1.0635038030
   H         -0.1981493489        2.9537840422        1.7078987061
   H          0.0071942199        1.4600232519        1.5722229461
   O          0.0653043330       -2.3830360864       -1.0524641965
   H          0.2891482602       -3.3012186806       -1.2043406597
   H          0.7701718122       -2.0531963448       -0.4951497237
   O         -1.8127961167       -1.3049174804        0.7014579491
   H         -1.3286721508       -1.8046326783        0.0440839713
   H         -2.0750613092       -0.5034790016        0.2485284033
    24
 Energy=    -289.822825220807
   O          1.8401207878       -1.1278403373        0.4780991375
   H          1.3004478967       -0.8441427174        1.2160020248
   H          2.1669535655       -0.3146652344        0.0931856050
   O         -1.9667467010        1.0899647292       -0.5423529655
   H         -1.4321286498        1.6748164175       -0.0053577308
   H         -1.3804392443        0.8046710329       -1.2431260479
   O         -0.0514692058        0.1242246147       -2.2051863635
   H         -0.0263125468       -0.8053461193       -1.9782563460
   H          0.6724372428        0.5111479996       -1.7127621684
   O         -0.0028030739       -0.1610065029        2.2994771393
   H         -0.6765829210       -0.6028321965        1.7827154784
   H         -0.1023103349       -0.5204165303        3.1810408506
   O          1.8637552635        1.4811756211       -0.7668478578
   H          1.9608939461        2.0719066275       -1.5137299063
   H          1.2724663569        1.9420291992       -0.1716812858
   O         -0.0444694555        2.3058895389        1.0924675258
   H         -0.2490319931        2.9652053073        1.7555578106
   H          0.0118794038        1.4842863226        1.5803453805
   O          0.0655680094       -2.4090017310       -1.1138357979
   H          0.2861593865       -3.3269595775       -1.2717113076
   H          0.7712969677       -2.0854603281       -0.5539255925
   O         -1.7807466109       -1.3406749927        0.6710121613
   H         -1.2976200394       -1.8256103643        0.0019394887
   H         -2.0494532550       -0.5323248803        0.2344360793
    24
 Energy=    -288.493970246111
   O          1.8223246221       -1.1366670524        0.4619127079
   H          1.2845872488       -0.8641512551        1.2054216168
   H          2.1513036596       -0.3179587881        0.0908043533
   O         -1.9638883135        1.0876018588       -0.5309140685
   H         -1.4370804523        1.6757957836        0.0101341959
   H         -1.3718099165        0.8096073834       -1.2297660438
   O         -0.0397794783        0.1292139338       -2.1916462986
   H         -0.0299128835       -0.8074766741       -1.9948083057
   H          0.6798745307        0.4907475749       -1.6743230210
   O         -0.0026738868       -0.1539809567        2.3018515382
   H         -0.6686227455       -0.6011371021        1.7795534058
   H         -0.1060841274       -0.5147688336        3.1824026554
   O          1.8658206670        1.4890102271       -0.7402233127
   H          1.9308758053        2.0256379130       -1.5301792581
   H          1.2697049238        1.9736760837       -0.1692794728
   O         -0.0628855221        2.3229586924        1.1058136932
   H         -0.2730861416        2.9749562474        1.7743544382
   H          0.0090628494        1.4992857541        1.5881187445
   O          0.0695312287       -2.4156871556       -1.1452023339
   H          0.2911824428       -3.3318579998       -1.3117363052
   H          0.7757803366       -2.0961637476       -0.5836430500
   O         -1.7628961150       -1.3560669964        0.6544808176
   H         -1.2787967044       -1.8331391966       -0.0195234231
   H         -2.0358300602       -0.5451739603        0.2253055789
    24
 Energy=    -287.109233345939
   O          1.8166181464       -1.1365676122        0.4520682410
   H          1.2826488442       -0.8763569732        1.2026673668
   H          2.1450632531       -0.3119444831        0.0938052834
   O         -1.9650488931        1.0850806629       -0.5264538183
   H         -1.4423444779        1.6731631613        0.0186800271
   H         -1.3714039985        0.8169719397       -1.2278348072
   O         -0.0301012649        0.1384252386       -2.1762978445
   H         -0.0401514756       -0.8053229584       -2.0167040668
   H          0.6848021435        0.4664622330       -1.6308286089
   O         -0.0125918532       -0.1541004132        2.2962368883
   H         -0.6729696329       -0.6060597157        1.7710075889
   H         -0.1179145816       -0.5149515233        3.1765353827
   O          1.8695169902        1.4933653318       -0.7086466537
   H          1.9069420061        1.9704732474       -1.5376214694
   H          1.2708543686        2.0047171855       -0.1642624261
   O         -0.0815976821        2.3355461782        1.1145060295
   H         -0.2932338113        2.9853190522        1.7847576249
   H          0.0031280063        1.5127323597        1.5962018026
   O          0.0675962217       -2.4265594930       -1.1827911210
   H          0.2918958783       -3.3398408597       -1.3612250006
   H          0.7743059067       -2.1115672707       -0.6192548214
   O         -1.7366305553       -1.3650446970        0.6509383456
   H         -1.2508296957       -1.8338065094       -0.0276570627
   H         -2.0149704901       -0.5523120248        0.2287721172
    24
 Energy=    -285.689927598764
   O          1.8109359694       -1.1357744370        0.4404920087
   H          1.2810962507       -0.8885119323        1.1983593891
   H          2.1355557326       -0.3049399869        0.0932630268
   O         -1.9807473230        1.0769927008       -0.5241372773
   H         -1.4545846743        1.6602972740        0.0228000884
   H         -1.3937894093        0.8207320696       -1.2355040859
   O         -0.0257789047        0.1561405179       -2.1610437980
   H         -0.0620611326       -0.7942055450       -2.0526104050
   H          0.6763653611        0.4379539945       -1.5746937025
   O         -0.0069648502       -0.1511961655        2.2995069102
   H         -0.6624036532       -0.6071915724        1.7715864575
   H         -0.1148171945       -0.5114716758        3.1797348741
   O          1.8912181352        1.4959457195       -0.6768707121
   H          1.9009031340        1.9119029394       -1.5389134210
   H          1.2887178809        2.0301942339       -0.1593730710
   O         -0.1069073391        2.3365283616        1.1118479865
   H         -0.3117153828        2.9934789975        1.7772060610
   H         -0.0169032351        1.5189923604        1.6015070392
   O          0.0744432557       -2.4286716928       -1.2046058615
   H          0.3044837572       -3.3365951987       -1.4020599454
   H          0.7816044782       -2.1196358560       -0.6383447055
   O         -1.7250239167       -1.3756241058        0.6385678709
   H         -1.2365822484       -1.8359097730       -0.0439229212
   H         -2.0146700892       -0.5645447096        0.2208512832
    24
 Energy=    -283.999470313423
   O          1.8083209374       -1.1255829606        0.4270546769
   H          1.2840143158       -0.8886631761        1.1920405738
   H          2.1288570341       -0.2899419576        0.0876543751
   O         -2.0186012618        1.0731335933       -0.5191986329
   H         -1.4831083548        1.6481957164        0.0274115948
   H         -1.4445312472        0.8292661745       -1.2452868785
   O         -0.0104890319        0.1766268150       -2.1529453511
   H         -0.0740941842       -0.7770037305       -2.1002670134
   H          0.6759095103        0.4063308614       -1.5265868817
   O         -0.0094845447       -0.1616262881        2.2918031506
   H         -0.6647579929       -0.6184192303        1.7643671298
   H         -0.1186319633       -0.5194775823        3.1728599775
   O          1.9181581154        1.4904069134       -0.6402196236
   H          1.9035879825        1.8456546950       -1.5289369942
   H          1.3130924736        2.0465755670       -0.1495019472
   O         -0.1343279588        2.3314864237        1.0981794074
   H         -0.3265713209        3.0022595465        1.7534181024
   H         -0.0444246427        1.5226076401        1.6020289358
   O          0.0863809947       -2.4247090738       -1.2160456707
   H          0.3240359133       -3.3253195339       -1.4366194197
   H          0.7939939059       -2.1223441861       -0.6467555139
   O         -1.7053297757       -1.3817689245        0.6397906131
   H         -1.2143643425       -1.8339786248       -0.0462787496
   H         -2.0070466789       -0.5732061546        0.2257555935
    24
 Energy=    -282.535623089661
   O          1.8239971915       -1.1057269600        0.4239910107
   H          1.3024589532       -0.8686718956        1.1908251534
   H          2.1442385530       -0.2702337014        0.0839493588
   O         -2.0677909718        1.0566998206       -0.5326663259
   H         -1.5174043042        1.6204865998        0.0108875571
   H         -1.5146453025        0.8299952053       -1.2802402193
   O         -0.0080046075        0.2129333276       -2.1227565943
   H         -0.0836898370       -0.7412318201       -2.1142444275
   H          0.6460322171        0.4077928018       -1.4515655205
   O         -0.0024031464       -0.1724385068        2.2939948192
   H         -0.6605630107       -0.6277684578        1.7688928588
   H         -0.1127287391       -0.5262426158        3.1765381643
   O          1.9507367928        1.4783959171       -0.6016295477
   H          1.9084887990        1.7811787336       -1.5086959802
   H          1.3385130465        2.0440497931       -0.1310452120
   O         -0.1437579982        2.2984183565        1.0586829945
   H         -0.3172901851        2.9898791052        1.6974321261
   H         -0.0604740381        1.5022755515        1.5835184506
   O          0.0964600073       -2.4042146377       -1.2277854426
   H          0.3428961295       -3.2959268941       -1.4734484831
   H          0.8044749904       -2.1086086985       -0.6554535874
   O         -1.7100124406       -1.3843232558        0.6409143353
   H         -1.2156969250       -1.8289456578       -0.0477037959
   H         -2.0322075809       -0.5839330320        0.2264295694
    24
 Energy=    -281.414385358290
   O          1.8372337697       -1.1049947786        0.4277202894
   H          1.3175602429       -0.8678292160        1.1957852355
   H          2.1563108750       -0.2695188520        0.0865434777
   O         -2.1410062756        1.0482788341       -0.5300465665
   H         -1.5820543680        1.6103298306        0.0065196291
   H         -1.6028475723        0.8310706005       -1.2912545757
   O          0.0043278379        0.2618131739       -2.0968534840
   H         -0.0592630467       -0.6932060341       -2.1080941179
   H          0.6024145878        0.4540238164       -1.3746491165
   O         -0.0029323683       -0.1892250427        2.2944546583
   H         -0.6655755165       -0.6444280545        1.7749105157
   H         -0.1113193109       -0.5370640298        3.1796055775
   O          1.9988678154        1.4595856270       -0.5948550943
   H          1.9200083190        1.7207060516       -1.5123675704
   H          1.3677169394        2.0115845230       -0.1331434629
   O         -0.1465496753        2.2558557207        1.0129617751
   H         -0.3022368922        2.9672903238        1.6341333584
   H         -0.0700689049        1.4732007944        1.5587032873
   O          0.1094956443       -2.3678510805       -1.2250346420
   H          0.3643998554       -3.2503326411       -1.4942594150
   H          0.8178923365       -2.0783333340       -0.6500690421
   O         -1.7144291389       -1.3830289622        0.6456075004
   H         -1.2169878198       -1.8223287084       -0.0441748617
   H         -2.0560714713       -0.5921009378        0.2285400995
    24
 Energy=    -280.899420685834
   O          1.8387890896       -1.0925758815        0.4228537578
   H          1.3196453265       -0.8573364404        1.1918687112
   H          2.1574972321       -0.2562344195        0.0834573542
   O         -2.1441982653        1.0505433080       -0.5238782005
   H         -1.5825246186        1.6130966885        0.0093086791
   H         -1.6085281294        0.8294371101       -1.2857189941
   O          0.0308410242        0.2645424919       -2.0924610491
   H         -0.0459312244       -0.6893913060       -2.1111203935
   H          0.6437666834        0.4420676001       -1.3789914896
   O         -0.0001991574       -0.1887499571        2.2983634851
   H         -0.6632156844       -0.6426832698        1.7781851768
   H         -0.1093408401       -0.5372173613        3.1831744261
   O          1.9859010996        1.4463182111       -0.6040813753
   H          1.9141876074        1.7083747806       -1.5219132604
   H          1.3553340031        2.0019141078       -0.1458999959
   O         -0.1590448541        2.2685506797        1.0212923327
   H         -0.3167391047        2.9778165362        1.6444346185
   H         -0.0816408198        1.4844056944        1.5647599928
   O          0.1081756552       -2.3821894814       -1.2270926429
   H          0.3626890590       -3.2650639525       -1.4953973868
   H          0.8165728392       -2.0924862751       -0.6522210730
   O         -1.7156040633       -1.3850437649        0.6401830048
   H         -1.2181934474       -1.8243639992       -0.0496084498
   H         -2.0581473364       -0.5946651886        0.2228130824
    24
 Energy=    -277.791092967039
   O          1.8725942334       -1.0663279928        0.4357146418
   H          1.3506255778       -0.8302113865        1.2025454646
   H          2.1942261396       -0.2305350804        0.0977280083
   O         -2.1990816730        1.0401261047       -0.5194330130
   H         -1.6346102079        1.6037564895        0.0096459929
   H         -1.6716332538        0.8269263110       -1.2892224992
   O          0.0289640462        0.3307475562       -2.0687862595
   H         -0.0154121687       -0.6254084843       -2.0740982937
   H          0.5774100042        0.5413444344       -1.3130827290
   O          0.0125224363       -0.1952373521        2.3148260015
   H         -0.6527346978       -0.6482608679        1.7967193718
   H         -0.0973742342       -0.5401810097        3.2009233070
   O          2.0340378257        1.3932174510       -0.6045274794
   H          1.9229521326        1.6225320867       -1.5271902600
   H          1.3780767014        1.9183475172       -0.1460678224
   O         -0.1637935944        2.2324463642        0.9769078703
   H         -0.3095778288        2.9547107688        1.5879012637
   H         -0.0905236817        1.4577028996        1.5342550906
   O          0.0996293419       -2.3655196655       -1.2328160889
   H          0.3609891356       -3.2405251731       -1.5196753923
   H          0.8082632536       -2.0804505130       -0.6559232067
   O         -1.7344739239       -1.3881977847        0.6319822228
   H         -1.2339400647       -1.8233502622       -0.0581916807
   H         -2.0931158835       -0.6064726246        0.2118470555
    24
 Energy=    -276.006144105646
   O          1.9043879111       -1.1006649306        0.4692604862
   H          1.3815454988       -0.8579395593        1.2334280372
   H          2.2264632340       -0.2678243676        0.1244766077
   O         -2.3085938235        1.0165731474       -0.5324739791
   H         -1.7413422263        1.5763970430       -0.0023280827
   H         -1.7967209002        0.8336965739       -1.3203661730
   O         -0.0494984065        0.4128281271       -2.0374923843
   H         -0.0249382245       -0.5438612383       -2.0181508328
   H          0.3198041610        0.6794446299       -1.1956116956
   O          0.0146673438       -0.2193389961        2.3156821861
   H         -0.6558222324       -0.6749575555        1.8066760010
   H         -0.0917058465       -0.5535885696        3.2062964725
   O          2.1688448906        1.3967070337       -0.5672661124
   H          1.9758343003        1.5354359197       -1.4944840201
   H          1.4842832414        1.8800698160       -0.1046997829
   O         -0.1294086726        2.1161535793        0.8647353461
   H         -0.2377590637        2.8749597259        1.4380635806
   H         -0.0691847107        1.3706659431        1.4621071723
   O          0.1131670594       -2.2595319937       -1.2301730413
   H          0.3896745216       -3.1149677088       -1.5588144882
   H          0.8226200368       -1.9848493854       -0.6492618797
   O         -1.7509411215       -1.3831098441        0.6484236322
   H         -1.2445781578       -1.8085987649       -0.0435211395
   H         -2.1401765242       -0.6179404677        0.2250520853
    24
 Energy=    -275.856314217562
   O          1.9135091698       -1.1205260180        0.4817846754
   H          1.3909898767       -0.8746717305        1.2451725831
   H          2.2352607766       -0.2890895211        0.1333293768
   O         -2.3565712739        1.0063535652       -0.5395237959
   H         -1.7877099918        1.5637736817       -0.0085704124
   H         -1.8520716204        0.8373123744       -1.3352228693
   O         -0.0856578265        0.4450963685       -2.0244904643
   H         -0.0356994705       -0.5102210186       -1.9912535484
   H          0.1978816516        0.7306012674       -1.1559720954
   O          0.0127268719       -0.2312905201        2.3125380988
   H         -0.6601833211       -0.6884585160        1.8081363386
   H         -0.0914613331       -0.5604599167        3.2053001982
   O          2.2272957189        1.4039050522       -0.5483283608
   H          2.0017393483        1.4978068698       -1.4738220735
   H          1.5354096896        1.8747244648       -0.0837267646
   O         -0.1111164101        2.0636354932        0.8158961400
   H         -0.2017913769        2.8380257709        1.3711704759
   H         -0.0564103288        1.3323116778        1.4310421078
   O          0.1229989552       -2.2086055476       -1.2269052511
   H          0.4059801205       -3.0547341700       -1.5736325998
   H          0.8328862049       -1.9383843932       -0.6444342557
   O         -1.7551299533       -1.3795785430        0.6585666902
   H         -1.2464101174       -1.8006952693       -0.0343233959
   H         -2.1572941407       -0.6216791769        0.2342032171
    24
 Energy=    -275.822598946630
   O          1.9173780532       -1.1270548503        0.4864327898
   H          1.3949219004       -0.8801239202        1.2495163528
   H          2.2390652176       -0.2961076399        0.1367530195
   O         -2.3748842349        1.0025005053       -0.5419292126
   H         -1.8053680812        1.5590589252       -0.0107739472
   H         -1.8732633847        0.8385960307       -1.3405177711
   O         -0.0983349033        0.4582170959       -2.0190836378
   H         -0.0395731971       -0.4963507535       -1.9793454617
   H          0.1521926286        0.7507675926       -1.1427948711
   O          0.0122647257       -0.2356757110        2.3117154882
   H         -0.6615506184       -0.6933723555        1.8090043350
   H         -0.0911509201       -0.5629586519        3.2052606302
   O          2.2490520581        1.4050836070       -0.5417699203
   H          2.0116660978        1.4814141418       -1.4659200138
   H          1.5545638898        1.8711990109       -0.0763083706
   O         -0.1047456133        2.0440684017        0.7975084407
   H         -0.1888024285        2.8240567016        1.3459467179
   H         -0.0519738224        1.3181312108        1.4191692590
   O          0.1263952016       -2.1899896616       -1.2257697173
   H          0.4117968032       -3.0324882980       -1.5792860727
   H          0.8364544512       -1.9214356108       -0.6427376222
   O         -1.7569713479       -1.3783549459        0.6620194947
   H         -1.2473582516       -1.7977892035       -0.0312345969
   H         -2.1640833135       -0.6233082394        0.2372888054
    24
 Energy=    -275.821492051803
   O          1.9177099561       -1.1271702538        0.4866722893
   H          1.3952417049       -0.8802186962        1.2497408935
   H          2.2394098610       -0.2962331231        0.1369802874
   O         -2.3760276183        1.0022839252       -0.5419867987
   H         -1.8064589122        1.5588169351       -0.0108612600
   H         -1.8745994242        0.8386469058       -1.3407511770
   O         -0.0987301537        0.4593010087       -2.0185852260
   H         -0.0394762272       -0.4952140813       -1.9783142053
   H          0.1498925021        0.7523831829       -1.1419316717
   O          0.0123044520       -0.2358911297        2.3117609002
   H         -0.6615609742       -0.6936064481        1.8091338866
   H         -0.0910800755       -0.5630748253        3.2053459878
   O          2.2502064493        1.4046552789       -0.5416067172
   H          2.0121134159        1.4799200207       -1.4656623249
   H          1.5554739451        1.8703374017       -0.0760761080
   O         -0.1045476737        2.0429881181        0.7964398697
   H         -0.1882556841        2.8232722631        1.3445105421
   H         -0.0518701740        1.3173415006        1.4184478339
   O          0.1265120913       -2.1890649832       -1.2257110681
   H          0.4120544983       -3.0313503274       -1.5796217528
   H          0.8365811350       -1.9206075432       -0.6426464096
   O         -1.7571411920       -1.3783094015        0.6621116067
   H         -1.2474722921       -1.7976414520       -0.0311632910
   H         -2.1645742722       -0.6234527168        0.2373510734
    24
 Energy=    -275.820451958571
   O          1.9184905751       -1.1274276959        0.4872319358
   H          1.3959869536       -0.8804309698        1.2502617011
   H          2.2402304349       -0.2965133348        0.1375225890
   O         -2.3786689716        1.0017769656       -0.5421183162
   H         -1.8089853103        1.5582579008       -0.0110615069
   H         -1.8776822205        0.8387594414       -1.3412862598
   O         -0.0995302208        0.4618624321       -2.0173787921
   H         -0.0391849003       -0.4925298086       -1.9758368470
   H          0.1447714994        0.7561954576       -1.1399298879
   O          0.0123999131       -0.2363796189        2.3118671332
   H         -0.6615804958       -0.6941363601        1.8094320485
   H         -0.0909151929       -0.5633355848        3.2055435989
   O          2.2527915224        1.4035945519       -0.5413117883
   H          2.0130631330        1.4764034250       -1.4651413219
   H          1.5574763633        1.8682313291       -0.0756065866
   O         -0.1041271918        2.0404946097        0.7939696068
   H         -0.1870375808        2.8214544075        1.3411985365
   H         -0.0516621297        1.3155136918        1.4167712815
   O          0.1267745715       -2.1869291690       -1.2255527185
   H          0.4126440688       -3.0287181228       -1.5803791941
   H          0.8368663529       -1.9186959365       -0.6424125681
   O         -1.7575386057       -1.3782027001        0.6623202434
   H         -1.2477397870       -1.7972977101       -0.0310024643
   H         -2.1657166644       -0.6237878331        0.2374900175
    24
 Energy=    -275.822522879524
   O          1.9196074955       -1.1277902082        0.4880311690
   H          1.3970503795       -0.8807302219        1.2510038184
   H          2.2414087358       -0.2969080543        0.1383017762
   O         -2.3824281967        1.0010526467       -0.5423048802
   H         -1.8125836293        1.5574619133       -0.0113456190
   H         -1.8820687856        0.8389178369       -1.3420452151
   O         -0.1006187918        0.4655313618       -2.0156377672
   H         -0.0387548231       -0.4886820067       -1.9722610837
   H          0.1375624352        0.7616478889       -1.1371068654
   O          0.0125373495       -0.2370709640        2.3120188790
   H         -0.6616063939       -0.6948857935        1.8098559223
   H         -0.0906799900       -0.5637034643        3.2058249153
   O          2.2564342656        1.4020554955       -0.5409276199
   H          2.0143878448        1.4713619133       -1.4644220652
   H          1.5602905658        1.8651919228       -0.0749657771
   O         -0.1035448444        2.0369472770        0.7904537830
   H         -0.1853229772        2.8188630660        1.3364866353
   H         -0.0513787105        1.3129126377        1.4143803616
   O          0.1271449430       -2.1838897493       -1.2253176227
   H          0.4134803283       -3.0249690633       -1.5814488831
   H          0.8372692681       -1.9159757914       -0.6420703389
   O         -1.7581063618       -1.3780502077        0.6626154046
   H         -1.2481224258       -1.7968070764       -0.0307754736
   H         -2.1673455644       -0.6242661368        0.2376863639
    24
 Energy=    -275.828050153021
   O          1.9209822937       -1.1276075531        0.4887824964
   H          1.3983281362       -0.8806006240        1.2517058533
   H          2.2428957028       -0.2967069881        0.1392001054
   O         -2.3865422497        1.0003331048       -0.5422908829
   H         -1.8164996922        1.5567373645       -0.0115389425
   H         -1.8868987398        0.8390441134       -1.3426495927
   O         -0.1006658377        0.4701633512       -2.0132607421
   H         -0.0373391319       -0.4838468405       -1.9675866535
   H          0.1313879694        0.7684602122       -1.1338280537
   O          0.0128077718       -0.2376828798        2.3123606436
   H         -0.6614965555       -0.6955325677        1.8104451353
   H         -0.0903384316       -0.5640080627        3.2062871371
   O          2.2597765899        1.3992054456       -0.5412151483
   H          2.0152767335        1.4647941091       -1.4643347437
   H          1.5625064801        1.8603124957       -0.0749249787
   O         -0.1034053592        2.0333798741        0.7867963909
   H         -0.1841135544        2.8162103741        1.3316765937
   H         -0.0514991796        1.3102594354        1.4118039265
   O          0.1273583673       -2.1810459485       -1.2250285734
   H          0.4141758945       -3.0213887994       -1.5825078580
   H          0.8375156331       -1.9134613915       -0.6416701906
   O         -1.7588134559       -1.3779373084        0.6626738949
   H         -1.2486300358       -1.7963328193       -0.0307883710
   H         -2.1692411524       -0.6248693861        0.2376213684
    24
 Energy=    -275.890820736784
   O          1.9485274697       -1.1168784494        0.5014206735
   H          1.4237191535       -0.8715654502        1.2634112271
   H          2.2728270821       -0.2853308000        0.1556026460
   O         -2.4605927612        0.9878172577       -0.5399669395
   H         -1.8869024301        1.5446582389       -0.0136216482
   H         -1.9740261791        0.8406386373       -1.3510299795
   O         -0.0943870366        0.5579893516       -1.9682809760
   H         -0.0094445085       -0.3911164462       -1.8776454884
   H          0.0295868350        0.8958212295       -1.0813018661
   O          0.0197029464       -0.2474800812        2.3212475557
   H         -0.6573759416       -0.7055621629        1.8232949216
   H         -0.0826042275       -0.5686527108        3.2171343924
   O          2.3163398160        1.3377638325       -0.5503462227
   H          2.0314566557        1.3345210206       -1.4641639885
   H          1.6000080725        1.7610689924       -0.0771513211
   O         -0.1049388963        1.9726609366        0.7227743257
   H         -0.1675722721        2.7705032609        1.2478995735
   H         -0.0570420086        1.2652552013        1.3658255319
   O          0.1285708185       -2.1354715325       -1.2208177887
   H          0.4237908726       -2.9624318600       -1.6018867803
   H          0.8393337512       -1.8736238740       -0.6355967217
   O         -1.7732905475       -1.3769147543        0.6608174899
   H         -1.2595330575       -1.7887867561       -0.0339101802
   H         -2.2051307403       -0.6371814951        0.2335697946
    24
 Energy=    -275.909750303049
   O          1.9405194787       -1.1205382761        0.4980143394
   H          1.4163248549       -0.8746343632        1.2602368147
   H          2.2641686641       -0.2892255109        0.1510242370
   O         -2.4393096268        0.9913436896       -0.5407057104
   H         -1.8666735193        1.5480557340       -0.0130775951
   H         -1.9489421037        0.8401339110       -1.3487324025
   O         -0.0964443521        0.5326954850       -1.9815226175
   H         -0.0170043403       -0.4180566860       -1.9041182641
   H          0.0587676855        0.8594295168       -1.0953025907
   O          0.0176971013       -0.2446893868        2.3186219433
   H         -0.6585904061       -0.7027222217        1.8195498349
   H         -0.0848390944       -0.5673237848        3.2139571955
   O          2.3003443855        1.3560167358       -0.5477976155
   H          2.0263536363        1.3730936542       -1.4647868675
   H          1.5890204754        1.7899359143       -0.0766667616
   O         -0.1044729311        1.9901251412        0.7412820170
   H         -0.1722691377        2.7837689240        1.2720974844
   H         -0.0554800342        1.2781864485        1.3792278093
   O          0.1283043537       -2.1485054825       -1.2219359073
   H          0.4211482394       -2.9793604178       -1.5963078815
   H          0.8388880238       -1.8850335134       -0.6372263987
   O         -1.7691180657       -1.3771818918        0.6614347655
   H         -1.2563721329       -1.7909433960       -0.0329173540
   H         -2.1948263082       -0.6335604391        0.2347833066
    24
 Energy=    -275.955022560388
   O          1.9439079126       -1.1210209632        0.5004542296
   H          1.4193804298       -0.8749861494        1.2624054289
   H          2.2680446720       -0.2897981445        0.1537038484
   O         -2.4492352936        0.9894412403       -0.5406024511
   H         -1.8761341430        1.5461559544       -0.0134823148
   H         -1.9606207710        0.8402493064       -1.3500648994
   O         -0.0958275341        0.5446413091       -1.9761255100
   H         -0.0142560851       -0.4053830788       -1.8922708671
   H          0.0451517025        0.8768007951       -1.0895440018
   O          0.0185239028       -0.2460515262        2.3195675168
   H         -0.6581496235       -0.7041570668        1.8210857294
   H         -0.0838567266       -0.5679370052        3.2151900853
   O          2.3083284080        1.3494794633       -0.5497737471
   H          2.0287954583        1.3571016680       -1.4652163024
   H          1.5946888666        1.7781684199       -0.0773584389
   O         -0.1047794137        1.9820915287        0.7331269015
   H         -0.1700195872        2.7777764307        1.2611999046
   H         -0.0563341189        1.2723363315        1.3735427457
   O          0.1287367709       -2.1422979266       -1.2209490155
   H          0.4227569834       -2.9712370311       -1.5986313100
   H          0.8394085524       -1.8796280011       -0.6359857951
   O         -1.7709999818       -1.3769427150        0.6614280002
   H         -1.2577694090       -1.7897972748       -0.0331058950
   H         -2.1995625369       -0.6351117217        0.2345172908
    24
 Energy=    -276.127092160815
   O          1.9621722185       -1.1253254566        0.5146712821
   H          1.4359159367       -0.8788052928        1.2752723436
   H          2.2887523003       -0.2944753600        0.1693230416
   O         -2.5044518483        0.9788248480       -0.5398445506
   H         -1.9287628829        1.5355718547       -0.0155861929
   H         -2.0256523877        0.8406949234       -1.3570979021
   O         -0.0921841139        0.6114919166       -1.9461655732
   H         -0.0014760905       -0.3337474895       -1.8256402246
   H         -0.0303125159        0.9731794080       -1.0620921012
   O          0.0233534252       -0.2534736229        2.3249145629
   H         -0.6554356474       -0.7119919491        1.8296992769
   H         -0.0781493825       -0.5712190991        3.2221140014
   O          2.3532861715        1.3146286411       -0.5617849204
   H          2.0451880284        1.2680502499       -1.4668472540
   H          1.6283826126        1.7150959761       -0.0818134798
   O         -0.1069199651        1.9377613029        0.6883655282
   H         -0.1578938723        2.7444925457        1.2010235065
   H         -0.0613972774        1.2402953057        1.3423538366
   O          0.1312986251       -2.1085166201       -1.2155122748
   H          0.4317452158       -2.9266000254       -1.6113698603
   H          0.8424804845       -1.8502313345       -0.6292180533
   O         -1.7816560958       -1.3755860097        0.6610768720
   H         -1.2657826273       -1.7833398672       -0.0345115093
   H         -2.2259765686       -0.6438498346        0.2328557521
    24
 Energy=    -276.436010761100
   O          1.9715422458       -1.1365645007        0.5213770272
   H          1.4452522638       -0.8895827100        1.2818049922
   H          2.2985133658       -0.3059590527        0.1758103673
   O         -2.5568539705        0.9694351642       -0.5456006580
   H         -1.9787079194        1.5240935923       -0.0218325684
   H         -2.0878634986        0.8456747683       -1.3708055669
   O         -0.1069266097        0.6558765716       -1.9182036770
   H         -0.0078837348       -0.2846142389       -1.7702192720
   H         -0.1305863695        1.0358257249       -1.0399607171
   O          0.0187772756       -0.2653336859        2.3199376393
   H         -0.6624212981       -0.7253127268        1.8294076962
   H         -0.0803381961       -0.5780876301        3.2191555960
   O          2.3990192163        1.2986834607       -0.5537702397
   H          2.0678059380        1.1961985768       -1.4459733853
   H          1.6694746461        1.6858653147       -0.0699450936
   O         -0.0940191321        1.8834986208        0.6377803329
   H         -0.1280391705        2.7026454165        1.1318177849
   H         -0.0519661721        1.2008980880        1.3074966171
   O          0.1424219615       -2.0550724489       -1.2078899194
   H          0.4489731818       -2.8621236250       -1.6213226085
   H          0.8541704309       -1.8010252312       -0.6204327146
   O         -1.7832893833       -1.3707117974        0.6712544894
   H         -1.2653118727       -1.7734026388       -0.0257184116
   H         -2.2418172512       -0.6480757788        0.2425573713
    24
 Energy=    -276.743771648755
   O          1.9497250081       -1.1464049568        0.5112799119
   H          1.4267527134       -0.9016980233        1.2747262660
   H          2.2710855979       -0.3143927721        0.1638393619
   O         -2.5056409765        0.9774061169       -0.5508029069
   H         -1.9305899137        1.5310631505       -0.0225870379
   H         -2.0270535651        0.8463474569       -1.3693440222
   O         -0.1258921843        0.5725147939       -1.9551055127
   H         -0.0294256248       -0.3743240715       -1.8530163069
   H         -0.0817597121        0.9158458603       -1.0626886013
   O          0.0132506545       -0.2598336235        2.3108922832
   H         -0.6660591379       -0.7197620097        1.8177027399
   H         -0.0863778589       -0.5760942021        3.2088261592
   O          2.3638996635        1.3578038691       -0.5283113108
   H          2.0575476527        1.3047036678       -1.4336072039
   H          1.6465739882        1.7811403861       -0.0566526323
   O         -0.0816441813        1.9167261015        0.6780240924
   H         -0.1252945075        2.7288490330        1.1827842664
   H         -0.0386121723        1.2255032951        1.3387745128
   O          0.1443440757       -2.0691624107       -1.2151920390
   H          0.4454247005       -2.8860266051       -1.6130804472
   H          0.8556448555       -1.8113938865       -0.6288146618
   O         -1.7732058871       -1.3699754195        0.6757847473
   H         -1.2575749134       -1.7771072765       -0.0203475605
   H         -2.2176608635       -0.6378455365        0.2483769229
    24
 Energy=    -277.134281524090
   O          1.9690723685       -1.1533559423        0.5308241385
   H          1.4422011679       -0.9028413027        1.2896923703
   H          2.2969206899       -0.3244212104        0.1820913919
   O         -2.5266967977        0.9680948762       -0.5511758571
   H         -1.9513770324        1.5223124241       -0.0238411274
   H         -2.0517727032        0.8422403872       -1.3726620664
   O         -0.1095087989        0.6111082331       -1.9531010130
   H         -0.0247834291       -0.3346864174       -1.8325774439
   H         -0.0742644202        0.9701294517       -1.0664819074
   O          0.0210349742       -0.2616774059        2.3203574706
   H         -0.6594035379       -0.7204429912        1.8276411130
   H         -0.0797124868       -0.5763672065        3.2187182659
   O          2.3760877582        1.3444582548       -0.5520543630
   H          2.0555983250        1.2702015216       -1.4509449575
   H          1.6530603609        1.7482907797       -0.0720725774
   O         -0.0969619858        1.9128344430        0.6712941221
   H         -0.1358482438        2.7278972620        1.1716862683
   H         -0.0543535154        1.2251176056        1.3357201223
   O          0.1381844702       -2.0711196810       -1.2120749376
   H          0.4430840949       -2.8812596566       -1.6206594194
   H          0.8497728151       -1.8158721235       -0.6249441585
   O         -1.7841190914       -1.3710514268        0.6721074311
   H         -1.2668128222       -1.7753371053       -0.0244405960
   H         -2.2357956201       -0.6436230378        0.2442428586
    24
 Energy=    -277.273293293778
   O          1.9747550963       -1.1462357613        0.5283674444
   H          1.4460045780       -0.8929272125        1.2849978089
   H          2.3057823092       -0.3187993878        0.1790797805
   O         -2.5349000888        0.9647741989       -0.5553139886
   H         -1.9597236509        1.5184296809       -0.0272330171
   H         -2.0618518998        0.8436845372       -1.3785967741
   O         -0.1083323173        0.6187666355       -1.9489442107
   H         -0.0269886571       -0.3268402398       -1.8246756054
   H         -0.0819461802        0.9803842641       -1.0630727175
   O          0.0189840867       -0.2653884670        2.3194349293
   H         -0.6624304925       -0.7236417926        1.8275915591
   H         -0.0818950981       -0.5787794906        3.2182348495
   O          2.3756171551        1.3320390884       -0.5496745589
   H          2.0490060233        1.2463966446       -1.4453432367
   H          1.6520731073        1.7324950527       -0.0676466847
   O         -0.0961924546        1.9042799507        0.6613583732
   H         -0.1322676311        2.7212812511        1.1587910789
   H         -0.0536735312        1.2189492336        1.3282510102
   O          0.1411706552       -2.0584605694       -1.2059739427
   H          0.4482364382       -2.8645954325       -1.6208100879
   H          0.8529546725       -1.8047270780       -0.6184242273
   O         -1.7830195060       -1.3705791818        0.6769696147
   H         -1.2649455343       -1.7734478310       -0.0198288149
   H         -2.2376564804       -0.6449965032        0.2491065082
    24
 Energy=    -277.358292726016
   O          1.9805039146       -1.1450775053        0.5329363641
   H          1.4499930948       -0.8897331676        1.2876478185
   H          2.3139467583       -0.3187305887        0.1833673677
   O         -2.5420883148        0.9586490828       -0.5606265636
   H         -1.9679041982        1.5122288389       -0.0313875874
   H         -2.0708186239        0.8437834033       -1.3858190225
   O         -0.1069963848        0.6252555863       -1.9483675174
   H         -0.0313604112       -0.3203228938       -1.8203347972
   H         -0.0882135529        0.9895222875       -1.0633879607
   O          0.0216990943       -0.2663994761        2.3185878411
   H         -0.6606345722       -0.7239150652        1.8273322119
   H         -0.0797987089       -0.5784440812        3.2177864846
   O          2.3754230985        1.3265170830       -0.5506548478
   H          2.0406081087        1.2269561144       -1.4418441521
   H          1.6523445665        1.7242297429       -0.0656662741
   O         -0.0972506937        1.8938495365        0.6532950153
   H         -0.1294609039        2.7133279981        1.1469035579
   H         -0.0550069748        1.2115890114        1.3233456732
   O          0.1441048328       -2.0429867118       -1.1999258504
   H          0.4542557128       -2.8432465108       -1.6237448280
   H          0.8561874618       -1.7914297809       -0.6118023259
   O         -1.7861882413       -1.3708191078        0.6810386631
   H         -1.2666383017       -1.7717033020       -0.0158053388
   H         -2.2448163469       -0.6479278079        0.2528794996
    24
 Energy=    -277.464115302391
   O          1.9942064606       -1.1451031819        0.5474366183
   H          1.4603847150       -0.8873543008        1.2989894762
   H          2.3300679481       -0.3199546877        0.1973525373
   O         -2.5488254586        0.9452563197       -0.5725996472
   H         -1.9784587782        1.5000238657       -0.0404843779
   H         -2.0790754989        0.8420224537       -1.4001922911
   O         -0.1019513693        0.6315527250       -1.9574360812
   H         -0.0377959312       -0.3142544794       -1.8249043795
   H         -0.0887639107        0.9991542491       -1.0737353114
   O          0.0218667226       -0.2723272713        2.3173760466
   H         -0.6628136289       -0.7294361388        1.8290153811
   H         -0.0793208185       -0.5803983663        3.2179786903
   O          2.3690067034        1.3231063510       -0.5578876150
   H          2.0176814464        1.1998754452       -1.4397133051
   H          1.6495798179        1.7190876292       -0.0660994252
   O         -0.1033376201        1.8870124354        0.6450030070
   H         -0.1306724379        2.7094452494        1.1339701983
   H         -0.0602157363        1.2085247705        1.3188181387
   O          0.1462667350       -2.0209118124       -1.1905335821
   H          0.4632307441       -2.8074589281       -1.6345035041
   H          0.8590639977       -1.7742651459       -0.6011972400
   O         -1.7865731282       -1.3702260196        0.6948958333
   H         -1.2628777086       -1.7673444470       -0.0010006405
   H         -2.2505589444       -0.6514199032        0.2656327795
    24
 Energy=    -277.678171414449
   O          2.0000367717       -1.1435056579        0.5604349094
   H          1.4611342490       -0.8862667129        1.3085285106
   H          2.3272908280       -0.3171971926        0.2049761315
   O         -2.5310004427        0.9228524325       -0.5842535880
   H         -1.9713355882        1.4898100209       -0.0536254850
   H         -2.0578028046        0.8237659688       -1.4103877829
   O         -0.0930501914        0.6285323800       -1.9735352305
   H         -0.0300735628       -0.3158377866       -1.8305989764
   H         -0.0846342122        1.0055047626       -1.0937325060
   O          0.0265230504       -0.2596757729        2.3231978467
   H         -0.6590175646       -0.7207544153        1.8398011248
   H         -0.0725996736       -0.5609333569        3.2263314988
   O          2.3417276894        1.3289800949       -0.5806769235
   H          1.9642504490        1.1881811866       -1.4489616927
   H          1.6389620674        1.7399557345       -0.0772374096
   O         -0.1211368875        1.9015305597        0.6541605600
   H         -0.1554812828        2.7194874506        1.1501432484
   H         -0.0704781664        1.2177900662        1.3221160012
   O          0.1534904938       -2.0195855131       -1.1789254853
   H          0.4806081257       -2.7826752821       -1.6552865871
   H          0.8676844371       -1.7814066347       -0.5877997176
   O         -1.7854163385       -1.3826595993        0.7057465911
   H         -1.2504312350       -1.7770619912        0.0169291027
   H         -2.2468623903       -0.6658646012        0.2704256612
    24
 Energy=    -277.756621319271
   O          2.0034559418       -1.1348169343        0.5653950421
   H          1.4622948737       -0.8765326340        1.3114954097
   H          2.3232461608       -0.3084326932        0.2033796530
   O         -2.5261709306        0.9099964001       -0.5864088965
   H         -1.9728240118        1.4857039761       -0.0585833435
   H         -2.0505276607        0.8098280553       -1.4110067515
   O         -0.0889078983        0.6221569830       -1.9713851924
   H         -0.0231016303       -0.3209574511       -1.8215968779
   H         -0.0894947604        1.0050220965       -1.0940906008
   O          0.0260780180       -0.2498103923        2.3198775521
   H         -0.6582112308       -0.7162934898        1.8399050699
   H         -0.0706778647       -0.5465032356        3.2247772680
   O          2.3293657653        1.3288781706       -0.5898501464
   H          1.9357170024        1.1805580145       -1.4496603712
   H          1.6391070947        1.7526493662       -0.0797591925
   O         -0.1302944540        1.9095629174        0.6556594838
   H         -0.1701359397        2.7243875779        1.1563642557
   H         -0.0743009969        1.2223711381        1.3196354105
   O          0.1590529351       -2.0183528620       -1.1769849839
   H          0.4905390946       -2.7697431090       -1.6686774312
   H          0.8740368606       -1.7845417567       -0.5850709756
   O         -1.7811440531       -1.3923161536        0.7097492690
   H         -1.2393805386       -1.7862488876        0.0259794719
   H         -2.2392516385       -0.6760370304        0.2700749601
    24
 Energy=    -277.810815170193
   O          2.0081782049       -1.1274215860        0.5691046259
   H          1.4626935292       -0.8657854208        1.3108760365
   H          2.3124669053       -0.3019235929        0.1920193702
   O         -2.5289291141        0.8824069901       -0.5864872943
   H         -1.9865807526        1.4739634409       -0.0648062995
   H         -2.0494395249        0.7793975074       -1.4085034866
   O         -0.0845351972        0.6208340597       -1.9597556365
   H         -0.0146882831       -0.3201941113       -1.7990720033
   H         -0.1045996908        1.0125492224       -1.0866070309
   O          0.0190197275       -0.2378706970        2.3143060759
   H         -0.6606627102       -0.7181248583        1.8414217724
   H         -0.0721470498       -0.5251071135        3.2228299884
   O          2.3214815253        1.3336998666       -0.6090694079
   H          1.8972741719        1.1708116302       -1.4515344717
   H          1.6554783032        1.7818505142       -0.0876937802
   O         -0.1507778734        1.9320130273        0.6494815639
   H         -0.1997790066        2.7423435708        1.1566256649
   H         -0.0852857876        1.2403831414        1.3079576286
   O          0.1820501842       -2.0220794584       -1.1660814430
   H          0.5196362807       -2.7548671737       -1.6811441884
   H          0.8984082384       -1.7954094381       -0.5730522024
   O         -1.7741787381       -1.4081283930        0.7144049744
   H         -1.2210895208       -1.8009209272        0.0390989824
   H         -2.2286246076       -0.6942273403        0.2671286853
    24
 Energy=    -277.906938934496
   O          2.0207822700       -1.1186973527        0.5729609082
   H          1.4729052920       -0.8539204317        1.3118491535
   H          2.3248802916       -0.2947706557        0.1923022274
   O         -2.5460496568        0.8785083917       -0.5859786064
   H         -2.0046226770        1.4706759111       -0.0640338828
   H         -2.0675458606        0.7784453098       -1.4089326371
   O         -0.0846153429        0.6218815720       -1.9472504834
   H         -0.0148478244       -0.3191169297       -1.7863587401
   H         -0.1096032999        1.0134299221       -1.0741540789
   O          0.0198773076       -0.2308573196        2.3060944238
   H         -0.6579642301       -0.7125079100        1.8319895845
   H         -0.0723988652       -0.5182053774        3.2144710206
   O          2.3299431530        1.3293478219       -0.6073933820
   H          1.8997169378        1.1608557655       -1.4456938477
   H          1.6680763586        1.7820426429       -0.0846777945
   O         -0.1544642042        1.9243614232        0.6416743157
   H         -0.2016299489        2.7376448277        1.1442450436
   H         -0.0895323089        1.2363776447        1.3040141148
   O          0.1839131371       -2.0152275662       -1.1643450130
   H          0.5196668182       -2.7512480342       -1.6759847068
   H          0.9002495664       -1.7886243157       -0.5712641358
   O         -1.7761929340       -1.4161076604        0.7101887119
   H         -1.2235041464       -1.8076368620        0.0338220743
   H         -2.2349457800       -0.7047904666        0.2631926088
    24
 Energy=    -277.940061898800
   O          2.0322908055       -1.1140004279        0.5798855589
   H          1.4794805980       -0.8466508346        1.3141586072
   H          2.3338490950       -0.2913230138        0.1945333687
   O         -2.5572206993        0.8664789446       -0.5874933139
   H         -2.0198748781        1.4617888847       -0.0649061119
   H         -2.0783417559        0.7710673153       -1.4107814886
   O         -0.0836835707        0.6231119838       -1.9402754328
   H         -0.0121223769       -0.3173550249       -1.7770803316
   H         -0.1117472086        1.0165727851       -1.0681327438
   O          0.0200370362       -0.2264006216        2.3011204390
   H         -0.6551528546       -0.7116148140        1.8268656143
   H         -0.0728033797       -0.5120924803        3.2099618218
   O          2.3312111650        1.3305780955       -0.6144090204
   H          1.8894049031        1.1554296833       -1.4452893371
   H          1.6786354412        1.7928243164       -0.0883812682
   O         -0.1638014263        1.9282887840        0.6345718838
   H         -0.2131400908        2.7428650162        1.1348349127
   H         -0.0972941638        1.2423421315        1.2988653536
   O          0.1929396254       -2.0127627512       -1.1568356967
   H          0.5272639784       -2.7499870596       -1.6676775372
   H          0.9094640652       -1.7873475567       -0.5635292352
   O         -1.7775450496       -1.4227802356        0.7091945343
   H         -1.2234735580       -1.8115914475        0.0323914140
   H         -2.2417939922       -0.7151482496        0.2620237261
    24
 Energy=    -277.969702857530
   O          2.0486233113       -1.1046039593        0.5911511102
   H          1.4867455543       -0.8339446379        1.3172838515
   H          2.3454133460       -0.2836675418        0.1984541358
   O         -2.5700158095        0.8477316990       -0.5938744293
   H         -2.0412222435        1.4499192957       -0.0704441064
   H         -2.0894199048        0.7597008739       -1.4169843796
   O         -0.0851834681        0.6228371939       -1.9360848205
   H         -0.0088804094       -0.3161664855       -1.7667278802
   H         -0.1179921469        1.0216388666       -1.0665374345
   O          0.0154170541       -0.2191623911        2.2891415881
   H         -0.6569284512       -0.7094691758        1.8160849124
   H         -0.0773380351       -0.5013774186        3.1990773065
   O          2.3277280244        1.3314108072       -0.6274851823
   H          1.8657586293        1.1461229556       -1.4450942148
   H          1.6922752584        1.8111712661       -0.0962022782
   O         -0.1802222941        1.9345028985        0.6293499689
   H         -0.2362876139        2.7500212085        1.1273644324
   H         -0.1096613942        1.2508319592        1.2955684362
   O          0.2098227877       -2.0084713216       -1.1420042538
   H          0.5415904891       -2.7477045097       -1.6516083413
   H          0.9266941437       -1.7852911889       -0.5482720522
   O         -1.7702573120       -1.4332614039        0.7149565997
   H         -1.2134274992       -1.8171313152        0.0375968055
   H         -2.2419164256       -0.7303905153        0.2680315115
    24
 Energy=    -277.991412935042
   O          2.0507523643       -1.1028528682        0.5954424835
   H          1.4855701167       -0.8318837962        1.3188902211
   H          2.3453843372       -0.2821272513        0.2006852133
   O         -2.5685423109        0.8401127922       -0.5952678736
   H         -2.0433448638        1.4457827379       -0.0722349890
   H         -2.0866851633        0.7532808217       -1.4177675624
   O         -0.0871130228        0.6215240970       -1.9379000361
   H         -0.0082555991       -0.3168032795       -1.7659841225
   H         -0.1212143153        1.0225868878       -1.0694430253
   O          0.0179852664       -0.2157146458        2.2904933841
   H         -0.6533668538       -0.7076346198        1.8177007130
   H         -0.0747986852       -0.4969518548        3.2007288540
   O          2.3235933355        1.3321957187       -0.6330768113
   H          1.8552151887        1.1441614935       -1.4464013970
   H          1.6937869410        1.8175487689       -0.1001526496
   O         -0.1861927568        1.9381506662        0.6279075704
   H         -0.2467844978        2.7526453253        1.1270657931
   H         -0.1134336146        1.2538083502        1.2931996429
   O          0.2162326400       -2.0067560053       -1.1377277471
   H          0.5470375788       -2.7468244335       -1.6467450885
   H          0.9332191644       -1.7843395816       -0.5438480469
   O         -1.7702362580       -1.4360576897        0.7150356961
   H         -1.2119341727       -1.8181224380        0.0378672166
   H         -2.2440636843       -0.7347601737        0.2679325713
    24
 Energy=    -278.003987428279
   O          2.0532315818       -1.1001828464        0.6000534935
   H          1.4854486382       -0.8291593995        1.3214415031
   H          2.3459651594       -0.2795435307        0.2037076773
   O         -2.5666117081        0.8345973465       -0.5965536473
   H         -2.0445264872        1.4436057326       -0.0742820248
   H         -2.0833642728        0.7477858405       -1.4182394259
   O         -0.0889696557        0.6204751657       -1.9402432882
   H         -0.0071246348       -0.3171858254       -1.7661022583
   H         -0.1242286833        1.0234970513       -1.0727399736
   O          0.0190921027       -0.2138423027        2.2921789628
   H         -0.6518108404       -0.7070718434        1.8201136059
   H         -0.0731178394       -0.4941778320        3.2027508477
   O          2.3187967795        1.3315679332       -0.6376233130
   H          1.8458215039        1.1415503637       -1.4478205433
   H          1.6930966231        1.8210242101       -0.1036160966
   O         -0.1906471356        1.9410089839        0.6266171470
   H         -0.2560279102        2.7542023232        1.1272904807
   H         -0.1156110462        1.2557077239        1.2906680549
   O          0.2195261632       -2.0055882472       -1.1364258616
   H          0.5491591609       -2.7471682504       -1.6440014969
   H          0.9365692653       -1.7836556765       -0.5424334679
   O         -1.7675368715       -1.4376587437        0.7166266035
   H         -1.2079054490       -1.8182962861        0.0397517463
   H         -2.2424432870       -0.7371512294        0.2694298248
    24
 Energy=    -278.017513137531
   O          2.0559886674       -1.0965833134        0.6053214826
   H          1.4847872302       -0.8251617771        1.3238554816
   H          2.3453698327       -0.2762920916        0.2058059102
   O         -2.5677120355        0.8267540400       -0.5982467519
   H         -2.0501780387        1.4413233343       -0.0779631901
   H         -2.0822311130        0.7385242605       -1.4184635646
   O         -0.0919132423        0.6201920098       -1.9427197983
   H         -0.0054264369       -0.3165972270       -1.7661474383
   H         -0.1292766430        1.0252738859       -1.0762646697
   O          0.0203934683       -0.2091292683        2.2940274797
   H         -0.6497375730       -0.7048243033        1.8234505363
   H         -0.0701846191       -0.4882078701        3.2051490875
   O          2.3123753135        1.3299367810       -0.6441706885
   H          1.8332877792        1.1366615394       -1.4499942768
   H          1.6922247395        1.8254113097       -0.1092406960
   O         -0.1966250002        1.9424808732        0.6243353901
   H         -0.2694345770        2.7541236222        1.1264973695
   H         -0.1179113662        1.2564190855        1.2871741542
   O          0.2263755376       -2.0021373444       -1.1336047057
   H          0.5533669964       -2.7477018146       -1.6370349854
   H          0.9434423224       -1.7807318065       -0.5394442441
   O         -1.7614347986       -1.4413043501        0.7192896681
   H         -1.1997352888       -1.8198699301        0.0429660751
   H         -2.2375298086       -0.7417010638        0.2719412320
    24
 Energy=    -278.027966236829
   O          2.0641041650       -1.0896099104        0.6157925241
   H          1.4898535011       -0.8171688501        1.3315046755
   H          2.3472443100       -0.2701795968        0.2100863997
   O         -2.5738283399        0.8102855952       -0.5996280844
   H         -2.0621346077        1.4325552339       -0.0827317107
   H         -2.0854862613        0.7192159031       -1.4178335387
   O         -0.1001958087        0.6213141026       -1.9442577375
   H         -0.0072670534       -0.3145094601       -1.7658471271
   H         -0.1402459963        1.0278400755       -1.0785993431
   O          0.0224108109       -0.2030190924        2.2947936441
   H         -0.6454290246       -0.7048550619        1.8274795593
   H         -0.0638020398       -0.4799776327        3.2069850447
   O          2.3071836915        1.3279655414       -0.6534400869
   H          1.8207304696        1.1300474983       -1.4537047626
   H          1.6941002826        1.8320187186       -0.1183784379
   O         -0.2056589787        1.9441279608        0.6195375270
   H         -0.2882275685        2.7554667653        1.1206798343
   H         -0.1215675298        1.2595786917        1.2832790176
   O          0.2365573384       -1.9979967219       -1.1328810918
   H          0.5576389939       -2.7529901098       -1.6259565371
   H          0.9535283584       -1.7770472256       -0.5384353696
   O         -1.7524063582       -1.4428030914        0.7236893800
   H         -1.1869024957       -1.8175304610        0.0483993535
   H         -2.2326976630       -0.7466946304        0.2753757477
    24
 Energy=    -278.040527968652
   O          2.0647433591       -1.0887400541        0.6146896903
   H          1.4907378947       -0.8156584079        1.3303544032
   H          2.3471959778       -0.2696977362        0.2077228125
   O         -2.5774662274        0.8097620532       -0.6000102713
   H         -2.0659814351        1.4324149411       -0.0833686852
   H         -2.0888329740        0.7181431455       -1.4179805393
   O         -0.1008477465        0.6216432482       -1.9436539914
   H         -0.0068863296       -0.3142191195       -1.7659893608
   H         -0.1405173108        1.0275177190       -1.0776724214
   O          0.0234419523       -0.2008241287        2.2963186889
   H         -0.6444050210       -0.7028031100        1.8291684319
   H         -0.0621837901       -0.4781371699        3.2084576856
   O          2.3068499090        1.3271008655       -0.6540145849
   H          1.8209069507        1.1290370236       -1.4545531510
   H          1.6934919257        1.8314188219       -0.1195174164
   O         -0.2066881323        1.9430635081        0.6177209643
   H         -0.2900856952        2.7549203686        1.1178860615
   H         -0.1220205904        1.2593865569        1.2822877959
   O          0.2378601637       -1.9961826939       -1.1315267031
   H          0.5574941415       -2.7537097251       -1.6216478689
   H          0.9547552184       -1.7750781037       -0.5370470308
   O         -1.7497403126       -1.4454539342        0.7240602818
   H         -1.1837473454       -1.8197666849        0.0489500939
   H         -2.2303690623       -0.7496703428        0.2756039977
    24
 Energy=    -278.049244692963
   O          2.0659820788       -1.0877123591        0.6142497807
   H          1.4928999010       -0.8137666979        1.3303241010
   H          2.3471382088       -0.2691980025        0.2053276382
   O         -2.5822237752        0.8068783518       -0.6000662106
   H         -2.0708991932        1.4296611995       -0.0834226814
   H         -2.0933400094        0.7150582278       -1.4178642104
   O         -0.1030589383        0.6221517887       -1.9430707951
   H         -0.0077906959       -0.3137458729       -1.7662902276
   H         -0.1418244448        1.0273014012       -1.0767089383
   O          0.0251669640       -0.1981826674        2.2971716515
   H         -0.6422627557       -0.7010184010        1.8303465940
   H         -0.0593295635       -0.4759676423        3.2092723503
   O          2.3070728382        1.3271641240       -0.6553261670
   H          1.8221183733        1.1291830574       -1.4564843937
   H          1.6932278901        1.8318602460       -0.1217457662
   O         -0.2086098300        1.9416151350        0.6153346448
   H         -0.2926159901        2.7548831301        1.1130996226
   H         -0.1232050653        1.2599929781        1.2819147986
   O          0.2405926310       -1.9945684517       -1.1298401455
   H          0.5577613417       -2.7563254827       -1.6149814390
   H          0.9573583794       -1.7732209759       -0.5352949438
   O         -1.7468040880       -1.4468436774        0.7250579935
   H         -1.1798487317       -1.8201114518        0.0501767947
   H         -2.2292737324       -0.7526216136        0.2761586637
    24
 Energy=    -278.073222313871
   O          2.0764197861       -1.0775399289        0.6210623974
   H          1.5054414697       -0.7993846544        1.3371945399
   H          2.3520166619       -0.2616866532        0.2031370038
   O         -2.5942304476        0.7860760609       -0.6015415530
   H         -2.0858119810        1.4091165702       -0.0823469589
   H         -2.1037689437        0.6982098972       -1.4188290731
   O         -0.1170639136        0.6174556088       -1.9497291503
   H         -0.0106739128       -0.3167162434       -1.7701854002
   H         -0.1514668685        1.0257070008       -1.0846400927
   O          0.0342893328       -0.1848148141        2.3017080984
   H         -0.6304941621       -0.6919914633        1.8358040403
   H         -0.0459395977       -0.4644384360        3.2136323216
   O          2.2979181821        1.3304599539       -0.6672668598
   H          1.8149072108        1.1337845567       -1.4699193560
   H          1.6835802929        1.8362847607       -0.1353250747
   O         -0.2217103435        1.9406467505        0.6036309016
   H         -0.3121988975        2.7594788297        1.0910298016
   H         -0.1295082313        1.2684167676        1.2787882614
   O          0.2532068480       -1.9917577437       -1.1200807987
   H          0.5577324580       -2.7728520892       -1.5820197734
   H          0.9694527024       -1.7704023448       -0.5249123323
   O         -1.7306702803       -1.4500243859        0.7349468819
   H         -1.1581092446       -1.8156836407        0.0606331495
   H         -2.2257055794       -0.7658668820        0.2842802618
    24
 Energy=    -278.075343731796
   O          2.0767418126       -1.0769959351        0.6220965308
   H          1.5055150085       -0.7988487600        1.3380336281
   H          2.3524577934       -0.2611394597        0.2042559518
   O         -2.5929977069        0.7856677788       -0.6014960319
   H         -2.0846262259        1.4088994834       -0.0824849341
   H         -2.1026032873        0.6977044554       -1.4188133552
   O         -0.1172326930        0.6166405978       -1.9507449957
   H         -0.0102867199       -0.3173236674       -1.7704531482
   H         -0.1516152491        1.0255936811       -1.0859866159
   O          0.0343393916       -0.1843537873        2.3019302114
   H         -0.6303389336       -0.6917213410        1.8360839607
   H         -0.0459580201       -0.4637528671        3.2139172288
   O          2.2964626316        1.3306411882       -0.6677727651
   H          1.8134841942        1.1339362427       -1.4704375976
   H          1.6817845235        1.8356914256       -0.1354881410
   O         -0.2217915936        1.9410817796        0.6034972043
   H         -0.3126985135        2.7596579733        1.0912479470
   H         -0.1290894306        1.2686278426        1.2783630070
   O          0.2530001929       -1.9922929035       -1.1202280450
   H          0.5576512948       -2.7730919490       -1.5825833159
   H          0.9692593635       -1.7710706161       -0.5250261128
   O         -1.7303751132       -1.4498876549        0.7354341526
   H         -1.1578166691       -1.8154556892        0.0610687617
   H         -2.2254698823       -0.7657237716        0.2848425523
    24
 Energy=    -278.077949657385
   O          2.0773848376       -1.0757461283        0.6237714177
   H          1.5058318912       -0.7972931259        1.3393292385
   H          2.3528953635       -0.2600918448        0.2054009121
   O         -2.5919090467        0.7838697268       -0.6014059376
   H         -2.0836334925        1.4077263089       -0.0830520373
   H         -2.1016571226        0.6953457465       -1.4187482134
   O         -0.1185051500        0.6148966129       -1.9529671156
   H         -0.0099475746       -0.3186296862       -1.7713748752
   H         -0.1525368805        1.0251137921       -1.0887937839
   O          0.0349415549       -0.1823296136        2.3027092892
   H         -0.6293580675       -0.6905122536        1.8372114309
   H         -0.0451206868       -0.4611919809        3.2148812344
   O          2.2933267863        1.3311990350       -0.6691856575
   H          1.8108301363        1.1343026664       -1.4720932754
   H          1.6775644143        1.8344616844       -0.1364612944
   O         -0.2226124463        1.9416316816        0.6023497996
   H         -0.3145480376        2.7600971715        1.0900935120
   H         -0.1285652075        1.2693618089        1.2772128784
   O          0.2540405850       -1.9926619740       -1.1194881519
   H          0.5582137125       -2.7739110101       -1.5813977666
   H          0.9702979103       -1.7717320167       -0.5241754292
   O         -1.7285611107       -1.4503052593        0.7369098959
   H         -1.1557633197       -1.8154132603        0.0624985390
   H         -2.2241992010       -0.7664992977        0.2863722945
    24
 Energy=    -278.096173663898
   O          2.0843122595       -1.0672532727        0.6291314047
   H          1.5133050898       -0.7874900057        1.3446138759
   H          2.3538443297       -0.2527399378        0.2046878507
   O         -2.5961975407        0.7671930295       -0.5943710613
   H         -2.0833817659        1.3953423111       -0.0857648274
   H         -2.1121920523        0.6703977229       -1.4144937325
   O         -0.1332110162        0.6026675136       -1.9656664327
   H         -0.0134002086       -0.3280403579       -1.7768276961
   H         -0.1637493167        1.0202072086       -1.1048761823
   O          0.0427423073       -0.1641396906        2.3049227489
   H         -0.6185985595       -0.6813418362        1.8451814754
   H         -0.0355977069       -0.4333519194        3.2201382744
   O          2.2774319034        1.3385220220       -0.6732379297
   H          1.8111329624        1.1385200777       -1.4849006429
   H          1.6430045378        1.8231529052       -0.1451596544
   O         -0.2290095652        1.9421920639        0.5867666179
   H         -0.3168301452        2.7658616213        1.0664413473
   H         -0.1304941560        1.2770584386        1.2680329495
   O          0.2649914340       -1.9928877256       -1.1137051723
   H          0.5669077310       -2.7751040286       -1.5754584017
   H          0.9812092217       -1.7748508519       -0.5172792822
   O         -1.7135757288       -1.4552341393        0.7500160251
   H         -1.1407359798       -1.8191819432        0.0750134637
   H         -2.2141688343       -0.7753962163        0.2989519707
    24
 Energy=    -278.099310679583
   O          2.0862302838       -1.0664393787        0.6291715937
   H          1.5156676392       -0.7873123917        1.3452569474
   H          2.3543689401       -0.2516289787        0.2044157662
   O         -2.5992545681        0.7649272677       -0.5920074725
   H         -2.0850523554        1.3925983172       -0.0842112751
   H         -2.1179608736        0.6695789935       -1.4138936728
   O         -0.1364849858        0.6017898278       -1.9679643265
   H         -0.0156034363       -0.3284887797       -1.7776981883
   H         -0.1650623250        1.0209184126       -1.1078792114
   O          0.0445723492       -0.1620147221        2.3050194486
   H         -0.6165457768       -0.6798092668        1.8456247675
   H         -0.0354308535       -0.4287357943        3.2208202987
   O          2.2773676463        1.3393187255       -0.6728188402
   H          1.8174535728        1.1394683220       -1.4881535575
   H          1.6376147835        1.8206879762       -0.1481934893
   O         -0.2279394853        1.9413689729        0.5827395247
   H         -0.3131181947        2.7662503033        1.0608056481
   H         -0.1303599973        1.2773955391        1.2652711084
   O          0.2654384770       -1.9920796244       -1.1123302229
   H          0.5675362349       -2.7737904703       -1.5748201557
   H          0.9816075497       -1.7744359857       -0.5157022434
   O         -1.7123734709       -1.4559185569        0.7525691471
   H         -1.1405693807       -1.8200317206        0.0767781096
   H         -2.2154454643       -0.7779046669        0.3015175155
    24
 Energy=    -278.101479953183
   O          2.0863284825       -1.0684479849        0.6299763190
   H          1.5161441286       -0.7889986148        1.3462372297
   H          2.3547484480       -0.2537926807        0.2051006931
   O         -2.5992548928        0.7644776677       -0.5878864490
   H         -2.0859013772        1.3949823113       -0.0827489406
   H         -2.1194998467        0.6686704208       -1.4106184268
   O         -0.1419521862        0.6020977171       -1.9717627406
   H         -0.0190835137       -0.3278147841       -1.7809804839
   H         -0.1666387967        1.0222444704       -1.1120540010
   O          0.0459665158       -0.1598982837        2.3052309324
   H         -0.6149750624       -0.6786884488        1.8467063041
   H         -0.0361644246       -0.4227180830        3.2219708638
   O          2.2758291740        1.3367096058       -0.6725877203
   H          1.8224689602        1.1394600430       -1.4922150542
   H          1.6307561863        1.8134294374       -0.1502364182
   O         -0.2236353953        1.9420763199        0.5803716099
   H         -0.3059218186        2.7674013839        1.0581783943
   H         -0.1271261310        1.2781250897        1.2630769386
   O          0.2647648097       -1.9903012027       -1.1135524049
   H          0.5667063956       -2.7725783613       -1.5751859889
   H          0.9807203186       -1.7725060052       -0.5167234501
   O         -1.7107049500       -1.4560675008        0.7549764078
   H         -1.1402425409       -1.8204737625        0.0782101585
   H         -2.2134558471       -0.7770838296        0.3050269110
    24
 Energy=    -278.102511902294
   O          2.0842262148       -1.0700218720        0.6283719992
   H          1.5153889871       -0.7898698340        1.3454290987
   H          2.3537788205       -0.2556479701        0.2036740115
   O         -2.5987542484        0.7667081579       -0.5849270065
   H         -2.0871556614        1.3985845768       -0.0797231694
   H         -2.1181045259        0.6714353368       -1.4071987218
   O         -0.1452060945        0.6016510247       -1.9721247165
   H         -0.0218074517       -0.3282893600       -1.7818210228
   H         -0.1659746038        1.0218632518       -1.1123443996
   O          0.0460820916       -0.1593280723        2.3051797388
   H         -0.6149596693       -0.6778596345        1.8465070348
   H         -0.0371475290       -0.4212610777        3.2220743734
   O          2.2765643385        1.3353162132       -0.6736783505
   H          1.8259771344        1.1412023361       -1.4955802998
   H          1.6293173158        1.8089508045       -0.1512097815
   O         -0.2176122685        1.9430604441        0.5807598463
   H         -0.2957104251        2.7686129771        1.0588764985
   H         -0.1232505446        1.2785080497        1.2631804058
   O          0.2624071667       -1.9914054353       -1.1144417502
   H          0.5643695198       -2.7743919731       -1.5748574959
   H          0.9780850773       -1.7730407393       -0.5174879599
   O         -1.7107123974       -1.4555569957        0.7555973089
   H         -1.1408058946       -1.8193346021        0.0780249724
   H         -2.2139173915       -0.7762375783        0.3066633460
    24
 Energy=    -278.103526584570
   O          2.0815060857       -1.0728157002        0.6246744543
   H          1.5137673230       -0.7932165816        1.3428171074
   H          2.3527305545       -0.2579610387        0.2019676906
   O         -2.5977294204        0.7729639417       -0.5855967689
   H         -2.0883240935        1.4048069616       -0.0781399223
   H         -2.1134123508        0.6775898854       -1.4057020094
   O         -0.1442490302        0.6035815994       -1.9685637710
   H         -0.0228604692       -0.3271462799       -1.7808345197
   H         -0.1633672660        1.0215484970       -1.1076514610
   O          0.0459736259       -0.1646770026        2.3056003264
   H         -0.6165014964       -0.6803625100        1.8457883978
   H         -0.0361568595       -0.4303820021        3.2215082238
   O          2.2795468365        1.3342602957       -0.6728022820
   H          1.8276033311        1.1407026937       -1.4940905157
   H          1.6334194186        1.8082236578       -0.1492471930
   O         -0.2124323565        1.9422654541        0.5855669865
   H         -0.2877767842        2.7671137794        1.0653380752
   H         -0.1203812624        1.2760252624        1.2666561459
   O          0.2583879818       -1.9925177583       -1.1173219375
   H          0.5619798404       -2.7741113273       -1.5790310627
   H          0.9738802317       -1.7732725828       -0.5204683263
   O         -1.7143167526       -1.4524250056        0.7529323252
   H         -1.1462033804       -1.8183623362        0.0750172078
   H         -2.2153882619       -0.7713692640        0.3042428342
    24
 Energy=    -278.103526584571
   O          2.0815061139       -1.0728156379        0.6246744430
   H          1.5137672972       -0.7932165446        1.3428170633
   H          2.3527305927       -0.2579609628        0.2019677119
   O         -2.5977294276        0.7729639298       -0.5855968210
   H         -2.0883242881        1.4048070714       -0.0781399379
   H         -2.1134121908        0.6775898681       -1.4057019621
   O         -0.1442491001        0.6035815575       -1.9685637154
   H         -0.0228604878       -0.3271463113       -1.7808344446
   H         -0.1633672304        1.0215484878       -1.1076514189
   O          0.0459735942       -0.1646770710        2.3056002777
   H         -0.6165015559       -0.6803625287        1.8457883332
   H         -0.0361568358       -0.4303821698        3.2215081513
   O          2.2795468477        1.3342603605       -0.6728023077
   H          1.8276033809        1.1407027708       -1.4940905654
   H          1.6334193802        1.8082236478       -0.1492472123
   O         -0.2124322257        1.9422654867        0.5855670187
   H         -0.2877765634        2.7671138057        1.0653381323
   H         -0.1203812142        1.2760252633        1.2666561583
   O          0.2583879964       -1.9925177886       -1.1173218720
   H          0.5619799504       -2.7741112898       -1.5790310493
   H          0.9738802369       -1.7732725414       -0.5204682757
   O         -1.7143168416       -1.4524250193        0.7529323086
   H         -1.1462034734       -1.8183623859        0.0750172072
   H         -2.2153883137       -0.7713692636        0.3042427974
    24
 Energy=    -278.101571813303
   O          2.0779755180       -1.0773711917        0.6214523059
   H          1.5122722145       -0.7977558147        1.3411931296
   H          2.3524510582       -0.2622566992        0.2013530532
   O         -2.5964539859        0.7769237759       -0.5836062914
   H         -2.0889391815        1.4101572242       -0.0759883610
   H         -2.1116117913        0.6828659345       -1.4035532462
   O         -0.1445337608        0.6070687168       -1.9674257951
   H         -0.0258478346       -0.3244758109       -1.7820335516
   H         -0.1620694341        1.0229719675       -1.1054810021
   O          0.0467396569       -0.1673144505        2.3063600143
   H         -0.6165371043       -0.6813704526        1.8458796077
   H         -0.0371998133       -0.4325623510        3.2222364015
   O          2.2815306141        1.3310961652       -0.6726063240
   H          1.8281265944        1.1371408720       -1.4929952434
   H          1.6365029149        1.8057598142       -0.1483301300
   O         -0.2069998166        1.9424487753        0.5890098208
   H         -0.2784824913        2.7666051853        1.0705576159
   H         -0.1175674021        1.2743711820        1.2686464976
   O          0.2538605969       -1.9917838186       -1.1216365333
   H          0.5594769200       -2.7713112089       -1.5854980977
   H          0.9690904161       -1.7718969876       -0.5247044373
   O         -1.7155257039       -1.4505050227        0.7528341027
   H         -1.1497351119       -1.8188069152        0.0742572374
   H         -2.2154198523       -0.7684431359        0.3043597300
    24
 Energy=    -278.093584483429
   O          2.0688049400       -1.0845379914        0.6090489608
   H          1.5096555634       -0.8046165812        1.3337749910
   H          2.3480652353       -0.2691718080        0.1926074710
   O         -2.5919614820        0.7955752696       -0.5799039768
   H         -2.0775854439        1.4206606302       -0.0691032099
   H         -2.1081677794        0.7004087711       -1.4003421712
   O         -0.1399487401        0.6061226908       -1.9611917069
   H         -0.0271972607       -0.3271051042       -1.7806236406
   H         -0.1565792354        1.0174671637       -1.0970441552
   O          0.0509201307       -0.1752121826        2.3089401754
   H         -0.6159098301       -0.6829398131        1.8465741984
   H         -0.0293819529       -0.4492854138        3.2225414447
   O          2.2875058682        1.3294990888       -0.6716398965
   H          1.8309271524        1.1402359874       -1.4913637492
   H          1.6459890610        1.8050678597       -0.1438877103
   O         -0.2002874481        1.9402923290        0.5984568613
   H         -0.2677296421        2.7638043484        1.0816869767
   H         -0.1078923715        1.2710268268        1.2765266787
   O          0.2412233502       -2.0005127439       -1.1286621474
   H          0.5509712878       -2.7765331488       -1.5956529249
   H          0.9555748317       -1.7788106991       -0.5313498302
   O         -1.7208504012       -1.4401434660        0.7490165658
   H         -1.1605155657       -1.8133512618        0.0685956275
   H         -2.2167235317       -0.7541856668        0.3020226327
    24
 Energy=    -278.091739173554
   O          2.0673473142       -1.0854435074        0.6074830776
   H          1.5087588201       -0.8053495985        1.3325748900
   H          2.3469202418       -0.2701493506        0.1911103406
   O         -2.5918914150        0.7977243922       -0.5792729549
   H         -2.0765556228        1.4217934580       -0.0681969701
   H         -2.1084068305        0.7024112414       -1.3998763304
   O         -0.1393359416        0.6056569065       -1.9602262368
   H         -0.0274223562       -0.3278735140       -1.7807042507
   H         -0.1558819220        1.0160152110       -1.0956083255
   O          0.0512983479       -0.1762043078        2.3090804669
   H         -0.6159705351       -0.6832804579        1.8466327880
   H         -0.0286278139       -0.4510268096        3.2224895983
   O          2.2886987413        1.3297987173       -0.6717354767
   H          1.8319080074        1.1412465759       -1.4915050512
   H          1.6475569709        1.8055398655       -0.1436829886
   O         -0.1995028454        1.9400635262        0.5992319843
   H         -0.2665603402        2.7635885165        1.0824935313
   H         -0.1069809237        1.2707739480        1.2772607407
   O          0.2402061081       -2.0012795486       -1.1289807511
   H          0.5504419406       -2.7768150030       -1.5964530254
   H          0.9544762883       -1.7794150908       -0.5316315132
   O         -1.7214901014       -1.4391746668        0.7485160009
   H         -1.1617613195       -1.8127836707        0.0678164762
   H         -2.2171779366       -0.7529395066        0.3017423278
    24
 Energy=    -278.086802338240
   O          2.0655210701       -1.0867190331        0.6039194912
   H          1.5073402489       -0.8077435653        1.3297560425
   H          2.3441019103       -0.2708153759        0.1880760377
   O         -2.5906828538        0.8027526273       -0.5797290902
   H         -2.0730699962        1.4235932181       -0.0670247598
   H         -2.1060258851        0.7055952314       -1.3994240964
   O         -0.1372682516        0.6068802434       -1.9590112158
   H         -0.0284286871       -0.3275583377       -1.7823467674
   H         -0.1537791411        1.0144991525       -1.0930977931
   O          0.0531333565       -0.1804111009        2.3093933772
   H         -0.6162191453       -0.6854404617        1.8477177194
   H         -0.0242102726       -0.4575950089        3.2223111633
   O          2.2899189100        1.3293028459       -0.6708874773
   H          1.8323942153        1.1413676165       -1.4903893646
   H          1.6496949071        1.8058187618       -0.1424202143
   O         -0.1975738246        1.9381124231        0.6024739483
   H         -0.2625980393        2.7615385067        1.0861816870
   H         -0.1056537378        1.2683343846        1.2801021036
   O          0.2353121996       -2.0023901778       -1.1317016714
   H          0.5462244681       -2.7779848143       -1.5986260347
   H          0.9492067725       -1.7797433236       -0.5341945525
   O         -1.7229321868       -1.4358488308        0.7494562912
   H         -1.1663524340       -1.8111320303        0.0670976326
   H         -2.2194798955       -0.7495979096        0.3036627447
    24
 Energy=    -278.083808403569
   O          2.0651954104       -1.0876050939        0.6028452929
   H          1.5065851920       -0.8097211537        1.3287702061
   H          2.3426651281       -0.2711344375        0.1873719929
   O         -2.5897784601        0.8035439488       -0.5807844193
   H         -2.0717143301        1.4233439411       -0.0672774897
   H         -2.1039805329        0.7053123571       -1.3996756015
   O         -0.1366609788        0.6081104095       -1.9595125907
   H         -0.0288937124       -0.3265853619       -1.7835527339
   H         -0.1530884464        1.0150531361       -1.0932795992
   O          0.0544572757       -0.1819078881        2.3101603338
   H         -0.6156849500       -0.6863039970        1.8489382586
   H         -0.0216913611       -0.4599411050        3.2229202997
   O          2.2893450470        1.3289887005       -0.6703218236
   H          1.8314979933        1.1404749053       -1.4895107301
   H          1.6492642175        1.8057073019       -0.1418639287
   O         -0.1972400783        1.9373198607        0.6036552897
   H         -0.2614407491        2.7605698693        1.0877725659
   H         -0.1059177416        1.2671204350        1.2809475461
   O          0.2338489283       -2.0013891230       -1.1324227196
   H          0.5446372285       -2.7776239147       -1.5983647983
   H          0.9475802424       -1.7783866024       -0.5348532030
   O         -1.7235725665       -1.4350454343        0.7501273826
   H         -1.1685049576       -1.8110955278        0.0669596750
   H         -2.2208264641       -0.7490359311        0.3047496071
    24
 Energy=    -278.081665448844
   O          2.0656768512       -1.0875027956        0.6027001621
   H          1.5066350578       -0.8102676840        1.3285409202
   H          2.3424012071       -0.2707042748        0.1873742089
   O         -2.5892615807        0.8029554597       -0.5818199931
   H         -2.0715637956        1.4226735006       -0.0678449031
   H         -2.1024140125        0.7041670428       -1.4000205394
   O         -0.1365013358        0.6090481707       -1.9600197290
   H         -0.0290271096       -0.3256550504       -1.7839202706
   H         -0.1531040957        1.0160924083       -1.0938377753
   O          0.0554168130       -0.1819830764        2.3108742983
   H         -0.6150373575       -0.6862401994        1.8499536987
   H         -0.0201072036       -0.4602992228        3.2235999337
   O          2.2885494245        1.3286544364       -0.6699287593
   H          1.8306196604        1.1395921754       -1.4889450184
   H          1.6484297442        1.8054838613       -0.1416179278
   O         -0.1975142274        1.9369223128        0.6039875431
   H         -0.2612094035        2.7600847135        1.0883205139
   H         -0.1063854033        1.2665110607        1.2810961980
   O          0.2332888532       -2.0008561123       -1.1327009945
   H          0.5437626282       -2.7777296285       -1.5977874541
   H          0.9469532626       -1.7777103145       -0.5351050577
   O         -1.7239524607       -1.4350699786        0.7505252737
   H         -1.1694436951       -1.8113318506        0.0670204291
   H         -2.2217468825       -0.7493612051        0.3052882228
    24
 Energy=    -278.076716867277
   O          2.0662928845       -1.0868686459        0.6026111025
   H          1.5066770648       -0.8101637200        1.3282117905
   H          2.3421784683       -0.2698191192        0.1872208576
   O         -2.5888559414        0.8010389231       -0.5832877292
   H         -2.0723809915        1.4214291667       -0.0688935111
   H         -2.1004495638        0.7017513338       -1.4004982436
   O         -0.1364941388        0.6100251153       -1.9606638908
   H         -0.0290786151       -0.3245763998       -1.7839897462
   H         -0.1535706294        1.0175485212       -1.0947164864
   O          0.0571005990       -0.1805276669        2.3121512566
   H         -0.6134838125       -0.6848699778        1.8515134157
   H         -0.0179616232       -0.4588990124        3.2248981529
   O          2.2874772135        1.3283987646       -0.6694567959
   H          1.8296438979        1.1386766002       -1.4883743714
   H          1.6472049072        1.8054153127       -0.1414999541
   O         -0.1984532997        1.9365434277        0.6038364015
   H         -0.2614627971        2.7597081882        1.0882550432
   H         -0.1072149003        1.2660516918        1.2808506012
   O          0.2335228875       -2.0003414551       -1.1322515198
   H          0.5434112661       -2.7781133031       -1.5962256412
   H          0.9471624403       -1.7771542711       -0.5346413547
   O         -1.7247777025       -1.4360193954        0.7505419643
   H         -1.1703028473       -1.8120750997        0.0668961626
   H         -2.2233722968       -0.7508949910        0.3053006576
    24
 Energy=    -278.060567502025
   O          2.0621586742       -1.0950179278        0.5992216946
   H          1.5031955880       -0.8190847004        1.3256189429
   H          2.3430494797       -0.2773096959        0.1885083604
   O         -2.5848314528        0.8231010364       -0.5712250961
   H         -2.0543491992        1.4317221491       -0.0570259520
   H         -2.1071359239        0.7251947733       -1.3949077931
   O         -0.1385212033        0.6112955446       -1.9608226097
   H         -0.0319193798       -0.3236509887       -1.7854861585
   H         -0.1517152581        1.0179742983       -1.0944103821
   O          0.0539428094       -0.1942633713        2.3114349944
   H         -0.6173138898       -0.6939174752        1.8466855348
   H         -0.0233426434       -0.4779680723        3.2223523570
   O          2.2899819616        1.3235657253       -0.6716950848
   H          1.8289677576        1.1350109188       -1.4890963502
   H          1.6509825807        1.7977351860       -0.1396471980
   O         -0.1879266682        1.9324462824        0.6120533354
   H         -0.2586455292        2.7524142467        1.1008101462
   H         -0.1021898840        1.2580371325        1.2858881390
   O          0.2304892071       -1.9999166306       -1.1389752087
   H          0.5449036675       -2.7727054321       -1.6082010130
   H          0.9436474597       -1.7754183599       -0.5412815805
   O         -1.7292923239       -1.4280457157        0.7438738242
   H         -1.1832829825       -1.8120189431        0.0578197448
   H         -2.2208679099       -0.7366541285        0.3005196131
    24
 Energy=    -278.045001697479
   O          2.0583029514       -1.0990972664        0.5947727639
   H          1.5019851783       -0.8211092682        1.3224162537
   H          2.3438516418       -0.2823502010        0.1853609706
   O         -2.5830597612        0.8372547717       -0.5620632406
   H         -2.0421253693        1.4392206617       -0.0509283357
   H         -2.1157276061        0.7402070482       -1.3917705601
   O         -0.1379338192        0.6106276192       -1.9570623260
   H         -0.0340627825       -0.3256658843       -1.7873651755
   H         -0.1469032934        1.0124315202       -1.0883247282
   O          0.0515010971       -0.1990393660        2.3095433290
   H         -0.6198884998       -0.6956187765        1.8417006864
   H         -0.0289770516       -0.4849320423        3.2194996385
   O          2.2954485549        1.3216372384       -0.6723947594
   H          1.8334517908        1.1368857927       -1.4901097056
   H          1.6577969931        1.7952125478       -0.1382049503
   O         -0.1804249233        1.9313506682        0.6164484695
   H         -0.2544604566        2.7510551050        1.1051561696
   H         -0.0970869269        1.2568002276        1.2904427733
   O          0.2249627399       -2.0054159830       -1.1437124444
   H          0.5435754727       -2.7722327827       -1.6198529301
   H          0.9380419005       -1.7806936136       -0.5460086653
   O         -1.7331362875       -1.4241687369        0.7393576852
   H         -1.1893399808       -1.8102900885        0.0527517438
   H         -2.2206998431       -0.7293033696        0.2970051780
    24
 Energy=    -278.041904898901
   O          2.0581644556       -1.0993001821        0.5943702775
   H          1.5021792057       -0.8210536934        1.3221691050
   H          2.3442987491       -0.2826770881        0.1851200747
   O         -2.5827713539        0.8389281780       -0.5609016206
   H         -2.0405721804        1.4401089630       -0.0501829505
   H         -2.1167220512        0.7419751946       -1.3913412672
   O         -0.1378129975        0.6106549339       -1.9565667946
   H         -0.0342829434       -0.3257914852       -1.7875062373
   H         -0.1463123450        1.0119049620       -1.0875685115
   O          0.0513101087       -0.1994302264        2.3093768923
   H         -0.6201017194       -0.6956141102        1.8411466599
   H         -0.0295819756       -0.4855853811        3.2192139866
   O          2.2960596448        1.3212639409       -0.6724068282
   H          1.8339645480        1.1370167994       -1.4901799950
   H          1.6585858175        1.7948117557       -0.1379805688
   O         -0.1795053201        1.9311410043        0.6169996550
   H         -0.2538986819        2.7508426080        1.1056577652
   H         -0.0964536275        1.2566079586        1.2910467058
   O          0.2239383007       -2.0064014557       -1.1446061656
   H          0.5430611627       -2.7724736340       -1.6216028706
   H          0.9370095899       -1.7816580561       -0.5469009030
   O         -1.7337647289       -1.4237247012        0.7387532261
   H         -1.1901887308       -1.8100539544        0.0520897842
   H         -2.2208745673       -0.7284647059        0.2965209520
    24
 Energy=    -278.012460096696
   O          2.0475742081       -1.1052857600        0.5809723153
   H          1.4978555313       -0.8271579113        1.3135609557
   H          2.3367952360       -0.2884527540        0.1743190511
   O         -2.5774278948        0.8545887418       -0.5467101430
   H         -2.0223557007        1.4482004979       -0.0409910684
   H         -2.1247984223        0.7581982395       -1.3846046899
   O         -0.1327583321        0.6093146354       -1.9522907237
   H         -0.0353944666       -0.3286435084       -1.7880146204
   H         -0.1404170303        1.0059966407       -1.0811899425
   O          0.0511444399       -0.2011117467        2.3106970818
   H         -0.6215263594       -0.6934664583        1.8402370158
   H         -0.0334900392       -0.4878056671        3.2200239982
   O          2.3045460396        1.3187691683       -0.6697726006
   H          1.8425714495        1.1419042541       -1.4892420145
   H          1.6697300611        1.7946888597       -0.1342906113
   O         -0.1701259573        1.9318575062        0.6194722787
   H         -0.2441206222        2.7537304707        1.1045304811
   H         -0.0897529920        1.2600080071        1.2965175335
   O          0.2118662783       -2.0156554466       -1.1509861473
   H          0.5365316403       -2.7732683457       -1.6376553756
   H          0.9248961758       -1.7908518705       -0.5532541359
   O         -1.7396849593       -1.4204067065        0.7347248483
   H         -1.1959402456       -1.8054084361        0.0474496526
   H         -2.2227253748       -0.7207982894        0.2948932218
    24
 Energy=    -277.978892143165
   O          2.0321570433       -1.1140127592        0.5701067529
   H          1.4905704464       -0.8369412586        1.3091244669
   H          2.3265140691       -0.2965212697        0.1684931999
   O         -2.5627918612        0.8667001219       -0.5333755330
   H         -1.9934111938        1.4507051701       -0.0324008837
   H         -2.1228060390        0.7687550799       -1.3777990553
   O         -0.1228306249        0.6144067612       -1.9575112231
   H         -0.0377626239       -0.3247595752       -1.7933105290
   H         -0.1331516401        1.0104163142       -1.0861319999
   O          0.0490332510       -0.2034501419        2.3124888866
   H         -0.6260093497       -0.6958132042        1.8454471945
   H         -0.0345929422       -0.4860915495        3.2231767225
   O          2.3122017510        1.3114453573       -0.6670622297
   H          1.8517473270        1.1400270708       -1.4885421957
   H          1.6786867218        1.7897093269       -0.1321284738
   O         -0.1601672916        1.9327096429        0.6221607798
   H         -0.2333357872        2.7553133858        1.1061042615
   H         -0.0809095636        1.2616542508        1.3001244316
   O          0.1913280292       -2.0155124587       -1.1610567780
   H          0.5209063441       -2.7661852046       -1.6551219588
   H          0.9040857323       -1.7900139180       -0.5632619094
   O         -1.7443256734       -1.4212682057        0.7404375310
   H         -1.2008458629       -1.8015354281        0.0503227760
   H         -2.2233596126       -0.7150122763        0.3068929689
    24
 Energy=    -277.965134908798
   O          2.0250917812       -1.1179622575        0.5675765714
   H          1.4860232306       -0.8407068974        1.3083642623
   H          2.3225041595       -0.3005855569        0.1679854722
   O         -2.5557441986        0.8691685463       -0.5292713160
   H         -1.9812779024        1.4495019499       -0.0298381821
   H         -2.1198090738        0.7702202024       -1.3756764390
   O         -0.1182697440        0.6179378173       -1.9622812033
   H         -0.0389519306       -0.3217345709       -1.7980973818
   H         -0.1295077944        1.0137202538       -1.0908101428
   O          0.0490931328       -0.2038921472        2.3137868057
   H         -0.6265598274       -0.6974563817        1.8489005144
   H         -0.0331951655       -0.4843477432        3.2252719316
   O          2.3144602971        1.3077108648       -0.6664927463
   H          1.8547197794        1.1368299487       -1.4884843575
   H          1.6806901735        1.7861576510       -0.1320248398
   O         -0.1570510022        1.9329100089        0.6230972543
   H         -0.2303777500        2.7547967462        1.1082335434
   H         -0.0776619305        1.2608872972        1.3000866857
   O          0.1840408051       -2.0114072843       -1.1637996192
   H          0.5148852082       -2.7606496438       -1.6591880603
   H          0.8966194788       -1.7854303092       -0.5659719848
   O         -1.7471675566       -1.4235168489        0.7434256886
   H         -1.2042976790       -1.8017270358        0.0517023403
   H         -2.2250592138       -0.7146551008        0.3128836742
    24
 Energy=    -277.949442022306
   O          2.0202515781       -1.1215351494        0.5676499928
   H          1.4827976568       -0.8441250080        1.3095520995
   H          2.3194897779       -0.3042657728        0.1692041296
   O         -2.5516789785        0.8701713275       -0.5281421057
   H         -1.9743291386        1.4479263014       -0.0290447280
   H         -2.1173156270        0.7702873277       -1.3752451132
   O         -0.1158559614        0.6199343398       -1.9654683678
   H         -0.0399524596       -0.3200502374       -1.8014577183
   H         -0.1269003804        1.0154989235       -1.0938959262
   O          0.0486966699       -0.2049936150        2.3136300894
   H         -0.6273268369       -0.6997878043        1.8505936238
   H         -0.0322588988       -0.4837133837        3.2257667713
   O          2.3162019540        1.3060785326       -0.6671612116
   H          1.8569818241        1.1352980075       -1.4894645161
   H          1.6820152806        1.7842611682       -0.1329510749
   O         -0.1554825266        1.9333253243        0.6235675255
   H         -0.2294808829        2.7545479567        1.1097253921
   H         -0.0757303005        1.2605076581        1.2997241720
   O          0.1797561327       -2.0063510338       -1.1648795253
   H          0.5113727002       -2.7546112590       -1.6612351715
   H          0.8922590003       -1.7801529172       -0.5670451706
   O         -1.7476119011       -1.4256260543        0.7466677986
   H         -1.2051904134       -1.8025230706        0.0538767704
   H         -2.2248627736       -0.7151566360        0.3180693264
    24
 Energy=    -277.896702487456
   O          2.0135596214       -1.1262334454        0.5656884063
   H          1.4773810239       -0.8445433930        1.3069002964
   H          2.3223434432       -0.3114307747        0.1694801286
   O         -2.5383077967        0.8706866327       -0.5232334668
   H         -1.9525873510        1.4425182247       -0.0270762035
   H         -2.1111691406        0.7695016854       -1.3738485471
   O         -0.1099188179        0.6322456521       -1.9760952562
   H         -0.0444530580       -0.3087129089       -1.8131748439
   H         -0.1229994366        1.0264718712       -1.1039447958
   O          0.0462629366       -0.2039977256        2.3156738948
   H         -0.6301908685       -0.7015971736        1.8562863907
   H         -0.0319335407       -0.4793138771        3.2290840807
   O          2.3178410221        1.3001864779       -0.6637415319
   H          1.8597725321        1.1275420552       -1.4862979140
   H          1.6826492658        1.7789222299       -0.1312235957
   O         -0.1489031930        1.9291803212        0.6230961452
   H         -0.2229778169        2.7475338174        1.1140567804
   H         -0.0685056966        1.2524791960        1.2952893240
   O          0.1674549595       -1.9996714291       -1.1690567484
   H          0.4997718089       -2.7486751002       -1.6638201792
   H          0.8794222944       -1.7720673783       -0.5711179974
   O         -1.7537889359       -1.4309771848        0.7534138605
   H         -1.2136109150       -1.8047337379        0.0571771300
   H         -2.2301092829       -0.7166035174        0.3303050915
    24
 Energy=    -277.804949069063
   O          2.0029462365       -1.1264040028        0.5602916518
   H          1.4666802381       -0.8447371777        1.3014491375
   H          2.3270676241       -0.3121275377        0.1754137432
   O         -2.5430548819        0.8741691188       -0.5092259337
   H         -1.9410302117        1.4371270056       -0.0225262788
   H         -2.1434756660        0.7870096015       -1.3746573340
   O         -0.0929873560        0.6423283225       -1.9760534646
   H         -0.0382994475       -0.2991780155       -1.8123253726
   H         -0.1160523631        1.0366033304       -1.1041319867
   O          0.0377344492       -0.2090792425        2.3104175056
   H         -0.6382873003       -0.7070553524        1.8508022010
   H         -0.0399558308       -0.4851810016        3.2236337336
   O          2.3427534536        1.3019601197       -0.6596923618
   H          1.8857939426        1.1230054063       -1.4815165862
   H          1.7074396200        1.7862601212       -0.1323768193
   O         -0.1452282452        1.9244554043        0.6174383640
   H         -0.2008166880        2.7417135950        1.1126462142
   H         -0.0713594706        1.2433431980        1.2859152944
   O          0.1576573887       -1.9955371414       -1.1712088885
   H          0.4841168955       -2.7614106965       -1.6435368762
   H          0.8673499169       -1.7621343328       -0.5728014317
   O         -1.7645441666       -1.4397338337        0.7534448476
   H         -1.2316030235       -1.8145316215        0.0522086560
   H         -2.2419982888       -0.7232464425        0.3352161787
    24
 Energy=    -277.784303608679
   O          2.0022818596       -1.1262396059        0.5608976554
   H          1.4660566289       -0.8447611946        1.3021562108
   H          2.3279737849       -0.3119433076        0.1773899652
   O         -2.5434691779        0.8751588597       -0.5076187496
   H         -1.9395396058        1.4373228376       -0.0223635859
   H         -2.1476302802        0.7899678094       -1.3749629096
   O         -0.0905901865        0.6427213030       -1.9758763809
   H         -0.0372091790       -0.2989057574       -1.8124114392
   H         -0.1151226914        1.0366695939       -1.1038472872
   O          0.0373049607       -0.2093128782        2.3098521191
   H         -0.6386363588       -0.7072035642        1.8500260243
   H         -0.0404579139       -0.4856821781        3.2229812367
   O          2.3454209376        1.3023315762       -0.6594499296
   H          1.8884837026        1.1224924907       -1.4810934694
   H          1.7100758054        1.7871560670       -0.1326543183
   O         -0.1449278864        1.9241977770        0.6172914571
   H         -0.1981799135        2.7412774603        1.1130503225
   H         -0.0718741776        1.2425182520        1.2852794965
   O          0.1554262252       -1.9954987452       -1.1724957934
   H          0.4810834315       -2.7635421788       -1.6418448192
   H          0.8648250449       -1.7613302349       -0.5740392258
   O         -1.7659828200       -1.4410880384        0.7527885005
   H         -1.2339056774       -1.8161173268        0.0510201718
   H         -2.2433651965       -0.7242427407        0.3350915699
    24
 Energy=    -277.615533909000
   O          1.9905182371       -1.1252347447        0.5534365856
   H          1.4541209915       -0.8476681674        1.2960445779
   H          2.3194999087       -0.3091097803        0.1766834274
   O         -2.5447578528        0.8941881749       -0.4874702069
   H         -1.9315752050        1.4620750783       -0.0208404336
   H         -2.1867894362        0.8307480344       -1.3729451084
   O         -0.0669946494        0.6296988044       -1.9757426395
   H         -0.0238070160       -0.3140585204       -1.8218310408
   H         -0.1141231229        1.0137304190       -1.1002253833
   O          0.0268803754       -0.2154379729        2.3042719607
   H         -0.6480301801       -0.7090562084        1.8383657257
   H         -0.0548261836       -0.4980777985        3.2151345229
   O          2.3504149859        1.3079286339       -0.6511919276
   H          1.8894908674        1.1187485253       -1.4684995095
   H          1.7161771965        1.7950760489       -0.1252055566
   O         -0.1422904816        1.9324049644        0.6243457448
   H         -0.1734832199        2.7489366835        1.1228783963
   H         -0.0763004092        1.2473918773        1.2896533585
   O          0.1526277863       -2.0189971798       -1.1812935986
   H          0.4700896086       -2.8066035508       -1.6230243262
   H          0.8595325979       -1.7782338362       -0.5825027840
   O         -1.7677140164       -1.4316009233        0.7396614490
   H         -1.2411211161       -1.8119724716        0.0366328275
   H         -2.2378054323       -0.7091224409        0.3234034244
    24
 Energy=    -277.524516022022
   O          1.9887192621       -1.1249946616        0.5549268858
   H          1.4527724851       -0.8486033120        1.2982980678
   H          2.3160566871       -0.3081905060        0.1782134381
   O         -2.5395349547        0.9006562139       -0.4835141359
   H         -1.9256788418        1.4716230666       -0.0215516204
   H         -2.1920617853        0.8449763540       -1.3736792833
   O         -0.0613428262        0.6213064377       -1.9775126491
   H         -0.0208045499       -0.3234277080       -1.8289667568
   H         -0.1177086638        0.9999846964       -1.1002113846
   O          0.0228453840       -0.2184173433        2.3015108085
   H         -0.6515607316       -0.7114859903        1.8342940058
   H         -0.0594579577       -0.5025650058        3.2118503637
   O          2.3447219186        1.3086950481       -0.6499793268
   H          1.8819004247        1.1167519100       -1.4655686453
   H          1.7106925501        1.7950241152       -0.1229853626
   O         -0.1417282434        1.9382999894        0.6305485836
   H         -0.1692322841        2.7540536654        1.1305698910
   H         -0.0765656815        1.2519123463        1.2945197305
   O          0.1514519570       -2.0284606434       -1.1858818244
   H          0.4670097186       -2.8202406350       -1.6214728986
   H          0.8578295531       -1.7862557705       -0.5870501858
   O         -1.7652078458       -1.4238356390        0.7361860935
   H         -1.2392708229       -1.8057324100        0.0334934550
   H         -2.2327145261       -0.6998152449        0.3196962224
    24
 Energy=    -277.320733959710
   O          1.9813759662       -1.1272125310        0.5420465457
   H          1.4430014253       -0.8505561100        1.2835625054
   H          2.3099603403       -0.3105436851        0.1661261482
   O         -2.5458958195        0.9113787517       -0.4787389349
   H         -1.9300874351        1.4889052136       -0.0276568364
   H         -2.2081415350        0.8514503530       -1.3723621610
   O         -0.0529335796        0.6169406589       -1.9679527589
   H         -0.0171119383       -0.3290175880       -1.8261372263
   H         -0.1051513235        0.9897404216       -1.0878814640
   O          0.0319394125       -0.2130509066        2.3164345163
   H         -0.6418952745       -0.7014584299        1.8435320466
   H         -0.0556077771       -0.5015643111        3.2249098021
   O          2.3476232359        1.3097487171       -0.6455135044
   H          1.8833829811        1.1148192464       -1.4595867979
   H          1.7135711665        1.7955758392       -0.1180840581
   O         -0.1423254863        1.9417699136        0.6230137292
   H         -0.1634597994        2.7574044213        1.1235389839
   H         -0.0794155432        1.2546414947        1.2864357028
   O          0.1541857848       -2.0308253257       -1.1835746299
   H          0.4675592922       -2.8272923436       -1.6121410474
   H          0.8599502573       -1.7869715543       -0.5846892590
   O         -1.7734706405       -1.4349616794        0.7215182603
   H         -1.2493401675       -1.8190627371        0.0186772650
   H         -2.2351966436       -0.7066718063        0.3060248201
    24
 Energy=    -276.984709988077
   O          1.9832945091       -1.1225258923        0.5414165271
   H          1.4453556225       -0.8480870104        1.2840718270
   H          2.3128174153       -0.3048080904        0.1686108259
   O         -2.5778395970        0.8911206848       -0.4818306883
   H         -1.9563133849        1.4732960636       -0.0447851117
   H         -2.2376814673        0.8017023473       -1.3720714690
   O         -0.0527825278        0.6474642855       -1.9389527753
   H         -0.0337389497       -0.2970649044       -1.7848950208
   H         -0.0582126238        1.0334284848       -1.0630338344
   O          0.0246284698       -0.2168605138        2.3012342808
   H         -0.6485099263       -0.7082368252        1.8304202408
   H         -0.0609947467       -0.5033257024        3.2105407201
   O          2.3795663955        1.3174885232       -0.6348239734
   H          1.9178201566        1.1218870929       -1.4501535579
   H          1.7443456547        1.8048927494       -0.1102636138
   O         -0.1437622096        1.9215571200        0.6065452315
   H         -0.1539936342        2.7436463137        1.0967457166
   H         -0.0826815022        1.2423584710        1.2782521485
   O          0.1489349222       -2.0324606721       -1.1911307616
   H          0.4617788173       -2.8300430920       -1.6180064117
   H          0.8545310703       -1.7882389393       -0.5921969914
   O         -1.7645919494       -1.4322946003        0.7247008904
   H         -1.2414335496       -1.8167429797        0.0213257612
   H         -2.2222571557       -0.7004869404        0.3108990684
    24
 Energy=    -276.397687649753
   O          1.9663643649       -1.1320637834        0.5399954794
   H          1.4278727913       -0.8595491124        1.2829587486
   H          2.2823341824       -0.3126510291        0.1592624331
   O         -2.5105244955        0.9132183477       -0.4878386551
   H         -1.8849518059        1.5009107408       -0.0641544554
   H         -2.2375232166        0.8929932268       -1.4050589591
   O         -0.0562264383        0.6023932931       -1.9471647209
   H         -0.0600111555       -0.3465527542       -1.8217896228
   H         -0.1300325794        0.9615800946       -1.0629875129
   O          0.0186581013       -0.2035239774        2.3031685347
   H         -0.6519885346       -0.6851105707        1.8188759755
   H         -0.0759896780       -0.5037558755        3.2071234259
   O          2.3313121333        1.3278533975       -0.6201564650
   H          1.8588890729        1.1156646230       -1.4251559780
   H          1.6968854713        1.8096198712       -0.0894628477
   O         -0.1440829790        1.9506303988        0.6504347589
   H         -0.1444710640        2.7630864451        1.1565442947
   H         -0.0842203194        1.2580292696        1.3084256236
   O          0.1584139895       -2.0885729067       -1.2003333170
   H          0.4610531732       -2.9060319088       -1.5958104268
   H          0.8614757279       -1.8370011224       -0.6014613196
   O         -1.7567819132       -1.3955215900        0.6910360921
   H         -1.2358253329       -1.7877504671       -0.0096725416
   H         -2.1976209395       -0.6540923040        0.2760958472
    24
 Energy=    -276.213048440773
   O          1.9660187356       -1.1327945042        0.5402779699
   H          1.4274574244       -0.8601471643        1.2831420100
   H          2.2811901236       -0.3134156137        0.1588109727
   O         -2.5038603771        0.9136246607       -0.4914627990
   H         -1.8773371629        1.4990729832       -0.0660797202
   H         -2.2355737155        0.9017013694       -1.4102184478
   O         -0.0605133626        0.6025656948       -1.9485417886
   H         -0.0648838065       -0.3463455340       -1.8229224467
   H         -0.1412251948        0.9619785429       -1.0650601279
   O          0.0173332137       -0.2017515247        2.3025664953
   H         -0.6534504839       -0.6823183177        1.8174514280
   H         -0.0778851228       -0.5029568416        3.2061375580
   O          2.3282856446        1.3295896956       -0.6181832956
   H          1.8554078641        1.1164388718       -1.4226614936
   H          1.6940064694        1.8115686228       -0.0875062926
   O         -0.1438831455        1.9513656026        0.6535348197
   H         -0.1441361209        2.7629521201        1.1610376282
   H         -0.0840006196        1.2576312192        1.3103289490
   O          0.1592062049       -2.0941456235       -1.2001756990
   H          0.4611906085       -2.9127980917       -1.5936796968
   H          0.8621145759       -1.8421086031       -0.6013192869
   O         -1.7547229415       -1.3942078097        0.6911046733
   H         -1.2338427924       -1.7867855083       -0.0094654236
   H         -2.1948555982       -0.6524071245        0.2760783754
    24
 Energy=    -275.690060156914
   O          1.9540172364       -1.1396875105        0.5416021671
   H          1.4164520531       -0.8687611270        1.2858161205
   H          2.2600130344       -0.3191245285        0.1552411905
   O         -2.4575301620        0.9599361122       -0.4879580028
   H         -1.8326563370        1.5410412913       -0.0542745773
   H         -2.2326534086        1.0159270547       -1.4166814816
   O         -0.0478816678        0.5504160766       -1.9972274082
   H         -0.0314603483       -0.4014819740       -1.8979687487
   H         -0.2166187571        0.8808379832       -1.1148550388
   O          0.0145989836       -0.2010533247        2.3091740807
   H         -0.6534819961       -0.6786475008        1.8174389410
   H         -0.0843663859       -0.5091457547        3.2100163256
   O          2.2799046758        1.3255160591       -0.6202086322
   H          1.7977981210        1.1016252170       -1.4162475764
   H          1.6478194634        1.8033741747       -0.0832246980
   O         -0.1372742985        1.9933657122        0.7063295858
   H         -0.1364972096        2.7960925001        1.2277324437
   H         -0.0775422918        1.2883740533        1.3510393564
   O          0.1624742199       -2.1308581804       -1.1992787558
   H          0.4584305136       -2.9602411466       -1.5744661858
   H          0.8639582543       -1.8743752225       -0.6006398983
   O         -1.7531189406       -1.3823222776        0.6771709995
   H         -1.2326665424       -1.7799697425       -0.0208530938
   H         -2.1895689104       -0.6405279472        0.2582623755
    24
 Energy=    -275.688088191101
   O          1.9545271397       -1.1394829481        0.5415508618
   H          1.4169152475       -0.8684696775        1.2856994361
   H          2.2609392585       -0.3189761494        0.1554005715
   O         -2.4591527103        0.9569555718       -0.4882597185
   H         -1.8341139287        1.5379187744       -0.0546237896
   H         -2.2322552110        1.0103918039       -1.4166421472
   O         -0.0491709028        0.5534377582       -1.9953428970
   H         -0.0335685260       -0.3983086434       -1.8945103978
   H         -0.2142563298        0.8855811946       -1.1129261137
   O          0.0148655962       -0.2008496012        2.3088690116
   H         -0.6532766159       -0.6786771771        1.8174439084
   H         -0.0839002446       -0.5086119128        3.2098459859
   O          2.2823622156        1.3259706050       -0.6198980706
   H          1.8007183674        1.1025768732       -1.4163566596
   H          1.6501785312        1.8041178706       -0.0832875772
   O         -0.1375315395        1.9912647649        0.7040792312
   H         -0.1368507254        2.7943901266        1.2248680846
   H         -0.0777836834        1.2867711136        1.3493316849
   O          0.1625163581       -2.1295614268       -1.1990993251
   H          0.4587587223       -2.9584507063       -1.5751510023
   H          0.8640675020       -1.8732890311       -0.6004489333
   O         -1.7535457606       -1.3824958580        0.6776620480
   H         -1.2330282547       -1.7798613658       -0.0204740557
   H         -2.1904704525       -0.6409249453        0.2588527417
    24
 Energy=    -275.654096918885
   O          1.9444116739       -1.1435103124        0.5426034324
   H          1.4077200272       -0.8742057248        1.2880354919
   H          2.2425593586       -0.3219325122        0.1522834147
   O         -2.4272179548        1.0162649685       -0.4818340058
   H         -1.8050879774        1.5993263758       -0.0468334006
   H         -2.2411506807        1.1199714914       -1.4150305374
   O         -0.0227356469        0.4928493278       -2.0322233087
   H          0.0090194506       -0.4612430638       -1.9620010747
   H         -0.2593760057        0.7903979563       -1.1537598807
   O          0.0095520931       -0.2049735109        2.3148888118
   H         -0.6573719374       -0.6781429069        1.8173399195
   H         -0.0931724625       -0.5192619851        3.2131661970
   O          2.2332812207        1.3167673678       -0.6263263772
   H          1.7425129786        1.0835019371       -1.4143400899
   H          1.6031806871        1.7891734456       -0.0822329521
   O         -0.1326476587        2.0328246772        0.7485300099
   H         -0.1299192786        2.8279941598        1.2813807300
   H         -0.0732431529        1.3185711919        1.3829942747
   O          0.1617213781       -2.1548087380       -1.2029298600
   H          0.4522245345       -2.9933088400       -1.5617575835
   H          0.8619491594       -1.8943214601       -0.6045493186
   O         -1.7451942972       -1.3786793531        0.6677005279
   H         -1.2260034479       -1.7816277556       -0.0282199323
   H         -2.1725741851       -0.6326431393        0.2469770567
    24
 Energy=    -275.631798253178
   O          1.9416456506       -1.1446180228        0.5428826377
   H          1.4052009782       -0.8757684206        1.2886566282
   H          2.2375383644       -0.3227669895        0.1514235455
   O         -2.4184295752        1.0323922889       -0.4801747838
   H         -1.7968604154        1.6155572155       -0.0445117398
   H         -2.2437823752        1.1499166731       -1.4139403939
   O         -0.0156444382        0.4763569543       -2.0422128740
   H          0.0206194408       -0.4781271005       -1.9799476344
   H         -0.2716897523        0.7644554542       -1.1660440024
   O          0.0081098013       -0.2060726655        2.3165241269
   H         -0.6584771783       -0.6779578879        1.8173067639
   H         -0.0957008691       -0.5221392149        3.2140524669
   O          2.2199154139        1.3142833906       -0.6280578247
   H          1.7266916044        1.0783106072       -1.4137288495
   H          1.5904332831        1.7851649981       -0.0819309175
   O         -0.1312990287        2.0441419203        0.7606704976
   H         -0.1279705691        2.8371153118        1.2967805252
   H         -0.0720035471        1.3272600077        1.3921736324
   O          0.1615153066       -2.1617431026       -1.2039653178
   H          0.4504291452       -3.0027989674       -1.5580637029
   H          0.8613847724       -1.9000915366       -0.6056735588
   O         -1.7429371859       -1.3775980709        0.6649630765
   H         -1.2241199825       -1.7820556929       -0.0303602882
   H         -2.1677080101       -0.6303575345        0.2437349107
    24
 Energy=    -275.625242068747
   O          1.9405872959       -1.1451439541        0.5428762050
   H          1.4042145462       -0.8764337827        1.2887521714
   H          2.2356901222       -0.3232089186        0.1509974491
   O         -2.4144461490        1.0370673232       -0.4800374016
   H         -1.7928004272        1.6198976582       -0.0440359829
   H         -2.2440301575        1.1597771889       -1.4139177573
   O         -0.0145082306        0.4712099606       -2.0454338713
   H          0.0233154329       -0.4833680352       -1.9855835551
   H         -0.2776270555        0.7562952486       -1.1703757575
   O          0.0077126409       -0.2060981734        2.3170089854
   H         -0.6587370737       -0.6774964831        1.8171487534
   H         -0.0965249044       -0.5228378030        3.2142505254
   O          2.2156101178        1.3137890601       -0.6283422206
   H          1.7215551716        1.0768491779       -1.4131995594
   H          1.5863649064        1.7842585571       -0.0815874709
   O         -0.1306070510        2.0478449810        0.7650942713
   H         -0.1269976909        2.8400561841        1.3023281331
   H         -0.0713968461        1.3300530265        1.3955708384
   O          0.1616016858       -2.1647541723       -1.2041972010
   H          0.4499475646       -3.0067127113       -1.5566093358
   H          0.8613433220       -1.9026872678       -0.6059377087
   O         -1.7424582872       -1.3766531525        0.6637347939
   H         -1.2237755584       -1.7815939995       -0.0314076211
   H         -2.1664137121       -0.6290380044        0.2423499010
    24
 Energy=    -275.624230634624
   O          1.9400054575       -1.1454495178        0.5428249642
   H          1.4036636213       -0.8768065950        1.2887473830
   H          2.2347023322       -0.3234738691        0.1507259652
   O         -2.4118318909        1.0391635978       -0.4802553698
   H         -1.7900198601        1.6216181720       -0.0439890436
   H         -2.2437373031        1.1648278384       -1.4141635817
   O         -0.0146146434        0.4687767673       -2.0468974255
   H          0.0241333963       -0.4858311320       -1.9881250849
   H         -0.2817185329        0.7524032722       -1.1725729103
   O          0.0075255570       -0.2059838162        2.3172181304
   H         -0.6588471124       -0.6771037186        1.8169928380
   H         -0.0969592668       -0.5231010040        3.2142975309
   O          2.2134842734        1.3136471719       -0.6283775411
   H          1.7190156789        1.0762016431       -1.4128214651
   H          1.5843692978        1.7839645879       -0.0813421533
   O         -0.1301175674        2.0496727747        0.7674430727
   H         -0.1263419429        2.8414800617        1.3052709307
   H         -0.0709706191        1.3313986659        1.3973762304
   O          0.1616451416       -2.1664988546       -1.2042469728
   H          0.4496849787       -3.0089415581       -1.5557511457
   H          0.8613178080       -1.9042083259       -0.6060048158
   O         -1.7422709299       -1.3760164691        0.6630297341
   H         -1.2236645334       -1.7811949009       -0.0320311869
   H         -2.1658343075       -0.6282196021        0.2415730329
    24
 Energy=    -275.626309774083
   O          1.9391797460       -1.1458837695        0.5427513971
   H          1.4028816603       -0.8773356933        1.2887394225
   H          2.2333008919       -0.3238511375        0.1503396957
   O         -2.4080777361        1.0421267519       -0.4805915932
   H         -1.7860162679        1.6240196442       -0.0439315062
   H         -2.2432850537        1.1720104340       -1.4145109906
   O         -0.0148174466        0.4653371240       -2.0489584028
   H          0.0252655264       -0.4893070429       -1.9916896522
   H         -0.2876116214        0.7468979594       -1.1757237985
   O          0.0072612213       -0.2058176973        2.3175136767
   H         -0.6590016890       -0.6765417927        1.8167698297
   H         -0.0975752560       -0.5234709628        3.2143623573
   O          2.2104687542        1.3134451362       -0.6284280395
   H          1.7154130948        1.0752833339       -1.4122843337
   H          1.5815414681        1.7835515056       -0.0809955685
   O         -0.1294105320        2.0522609020        0.7707768783
   H         -0.1254006036        2.8434934570        1.3094482107
   H         -0.0703539568        1.3333024871        1.3999373972
   O          0.1617032076       -2.1689731585       -1.2043099016
   H          0.4493086470       -3.0121004044       -1.5545261181
   H          0.8612781508       -1.9063651547       -0.6060927377
   O         -1.7420082260       -1.3751138519        0.6620332163
   H         -1.2235101368       -1.7806281894       -0.0329126043
   H         -2.1650186688       -0.6270614339        0.2404746969
    24
 Energy=    -275.632202032107
   O          1.9383083475       -1.1463610891        0.5425947227
   H          1.4020430992       -0.8778971925        1.2886366516
   H          2.2318706426       -0.3242776166        0.1498711775
   O         -2.4035279250        1.0444611428       -0.4814158825
   H         -1.7810012996        1.6254652623       -0.0442355377
   H         -2.2421846088        1.1789107156       -1.4152914024
   O         -0.0161496817        0.4623937727       -2.0506326581
   H          0.0253832348       -0.4922585388       -1.9945450393
   H         -0.2949793828        0.7421175307       -1.1787149688
   O          0.0070388073       -0.2054498591        2.3177484808
   H         -0.6591091241       -0.6757356997        1.8164401908
   H         -0.0981897649       -0.5236791342        3.2143470064
   O          2.2076840988        1.3134458724       -0.6282690218
   H          1.7120834995        1.0745705341       -1.4115636399
   H          1.5789488346        1.7834441044       -0.0805232145
   O         -0.1284928768        2.0546742119        0.7741260466
   H         -0.1242161843        2.8453270447        1.3136458775
   H         -0.0695569858        1.3350253952        1.4025080811
   O          0.1617736934       -2.1717432522       -1.2042580822
   H          0.4489319192       -3.0155716402       -1.5531501068
   H          0.8612480145       -1.9088091091       -0.6060665154
   O         -1.7418496224       -1.3739906905        0.6609353799
   H         -1.2234712063       -1.7798138147       -0.0339194607
   H         -2.1643581444       -0.6256995855        0.2392971334
    24
 Energy=    -275.656480453375
   O          1.9352917002       -1.1482237703        0.5418337773
   H          1.3990942521       -0.8799681473        1.2879993470
   H          2.2270585342       -0.3260122096        0.1480418221
   O         -2.3870879310        1.0495274269       -0.4850916232
   H         -1.7624062283        1.6268074449       -0.0460558716
   H         -2.2372529157        1.1993727152       -1.4185409779
   O         -0.0233923759        0.4546205919       -2.0554779113
   H          0.0225422770       -0.4999961263       -2.0022917389
   H         -0.3219474458        0.7291963720       -1.1884687700
   O          0.0066339095       -0.2034592878        2.3183971152
   H         -0.6591031733       -0.6722503828        1.8151467940
   H         -0.0999628701       -0.5236450418        3.2141370605
   O          2.1996119205        1.3143216597       -0.6269742217
   H          1.7023080140        1.0730990327       -1.4084678613
   H          1.5715320787        1.7842241477       -0.0783949620
   O         -0.1250100343        2.0619378538        0.7852678900
   H         -0.1197336684        2.8507457613        1.3274727268
   H         -0.0665650607        1.3400962010        1.4111757532
   O          0.1624884826       -2.1821645782       -1.2037655884
   H          0.4481984172       -3.0282405275       -1.5483771977
   H          0.8616373047       -1.9181755912       -0.6056580904
   O         -1.7421580183       -1.3690259726        0.6567623622
   H         -1.2241658222       -1.7757293906       -0.0378657791
   H         -2.1632761456       -0.6200670323        0.2349189451
    24
 Energy=    -275.838886661317
   O          1.9226127006       -1.1562149268        0.5384377807
   H          1.3866460786       -0.8887438850        1.2850507071
   H          2.2069802435       -0.3335596903        0.1401849684
   O         -2.3174842606        1.0682279897       -0.5014924956
   H         -1.6821540101        1.6276430486       -0.0546792184
   H         -2.2154556714        1.2823961617       -1.4288295438
   O         -0.0561945569        0.4241284231       -2.0747095085
   H          0.0070289904       -0.5299898066       -2.0312005802
   H         -0.4351178564        0.6781551904       -1.2332112170
   O          0.0052634875       -0.1944911544        2.3209784796
   H         -0.6587034305       -0.6569841145        1.8096272953
   H         -0.1070981764       -0.5228142232        3.2130606837
   O          2.1671066917        1.3187395971       -0.6209074240
   H          1.6629046982        1.0677896603       -1.3948817898
   H          1.5418151133        1.7885868534       -0.0691050701
   O         -0.1101166407        2.0914439071        0.8315890971
   H         -0.1004643446        2.8725805760        1.3847293846
   H         -0.0538549625        1.3606906644        1.4472725887
   O          0.1658841450       -2.2265741005       -1.2014209597
   H          0.4455222668       -3.0816940233       -1.5282301983
   H          0.8636960613       -1.9581730870       -0.6037159610
   O         -1.7442048760       -1.3473012643        0.6389288655
   H         -1.2278228087       -1.7575188221       -0.0548311477
   H         -2.1597892423       -0.5957000381        0.2162977363
    24
 Energy=    -276.352659351329
   O          1.9098842221       -1.1642537704        0.5350117804
   H          1.3741202349       -0.8975217291        1.2820344093
   H          2.1868485606       -0.3412528210        0.1322810608
   O         -2.2478876224        1.0866625421       -0.5183382655
   H         -1.5999578392        1.6253497346       -0.0642072881
   H         -2.1930740236        1.3649956996       -1.4325362544
   O         -0.0891971930        0.3938241326       -2.0935493578
   H         -0.0101767291       -0.5594232571       -2.0573966231
   H         -0.5453722430        0.6276494507       -1.2851794645
   O          0.0039383922       -0.1854412083        2.3235717934
   H         -0.6582041972       -0.6415473909        1.8041815919
   H         -0.1142142823       -0.5218400961        3.2118890643
   O          2.1345960238        1.3232205926       -0.6147860653
   H          1.6236167064        1.0625300988       -1.3810578471
   H          1.5121786278        1.7931704332       -0.0598305964
   O         -0.0952402783        2.1209615815        0.8780314648
   H         -0.0809993430        2.8943097546        1.4419123378
   H         -0.0412703376        1.3815002869        1.4834371794
   O          0.1693901988       -2.2711971806       -1.1990664814
   H          0.4428239453       -3.1349572985       -1.5079099450
   H          0.8658821568       -1.9983020243       -0.6018571159
   O         -1.7463686547       -1.3253103913        0.6209191224
   H         -1.2316121490       -1.7390077334       -0.0719820891
   H         -2.1564305040       -0.5711138805        0.1975177256
    24
 Energy=    -277.153447313769
   O          1.8971678623       -1.1721950923        0.5316388780
   H          1.3615898883       -0.9061855082        1.2790524013
   H          2.1666901492       -0.3489321738        0.1244193501
   O         -2.1785439946        1.1056219750       -0.5353953303
   H         -1.5163964276        1.6211548294       -0.0749408640
   H         -2.1697390516        1.4472986091       -1.4294934182
   O         -0.1213758689        0.3628172175       -2.1119380255
   H         -0.0280370558       -0.5893425390       -2.0817469021
   H         -0.6509547666        0.5765186339       -1.3437520222
   O          0.0024719409       -0.1766290635        2.3262390581
   H         -0.6578139905       -0.6262808259        1.7989178834
   H         -0.1214542478       -0.5210137097        3.2107012422
   O          2.1014534527        1.3273540545       -0.6089335063
   H          1.5838153147        1.0568512921       -1.3672941419
   H          1.4819420631        1.7974108877       -0.0508259434
   O         -0.0807171831        2.1509973643        0.9247175019
   H         -0.0617212157        2.9163880238        1.4992156583
   H         -0.0290974286        1.4029778874        1.5197251515
   O          0.1727938710       -2.3155253392       -1.1968640188
   H          0.4398656927       -3.1875513875       -1.4875099427
   H          0.8679798764       -2.0380372588       -0.6002497186
   O         -1.7481830955       -1.3033257442        0.6026980473
   H         -1.2350720730       -1.7205321107       -0.0893191247
   H         -2.1526684837       -0.5465706036        0.1784987216
    24
 Energy=    -280.632403040267
   O          1.8745670644       -1.1827047143        0.5294677126
   H          1.3400029894       -0.9193773484        1.2785550160
   H          2.1275244788       -0.3585124338        0.1135933673
   O         -2.0646670376        1.1637111162       -0.5493732991
   H         -1.3905961593        1.6604597634       -0.0855833978
   H         -2.1364610906        1.5941215910       -1.4013265122
   O         -0.1185525492        0.2644566368       -2.1437986105
   H          0.0056493832       -0.6843979492       -2.1657233579
   H         -0.7551099789        0.4070452825       -1.4433023887
   O         -0.0053477760       -0.1750474077        2.3376987777
   H         -0.6620664571       -0.6168353077        1.7993904410
   H         -0.1362226419       -0.5312733264        3.2164517033
   O          2.0078313616        1.3148735309       -0.6158274432
   H          1.4777345373        1.0210329752       -1.3566964766
   H          1.3907539505        1.7747121058       -0.0466211592
   O         -0.0784988023        2.2359466495        1.0222955207
   H         -0.0523815749        2.9843198283        1.6185230911
   H         -0.0281259675        1.4707929897        1.5952128747
   O          0.1778361358       -2.3763353543       -1.2022717667
   H          0.4320796413       -3.2632218710       -1.4572705635
   H          0.8706504289       -2.0898176427       -0.6071685856
   O         -1.7383320208       -1.2611050682        0.5560301139
   H         -1.2275555771       -1.6874872368       -0.1321105046
   H         -2.1332579761       -0.5022876409        0.1265403680
    24
 Energy=    -284.504344278872
   O          1.8581836526       -1.1898586887        0.5340728111
   H          1.3251437117       -0.9300536897        1.2854725874
   H          2.0931596200       -0.3646630299        0.1097259488
   O         -2.0204089675        1.2184805863       -0.5806388422
   H         -1.3646367625        1.7244828779       -0.1008927258
   H         -2.1315080787        1.6907841183       -1.4057559255
   O         -0.0637943596        0.2328737941       -2.1713160095
   H          0.0438167104       -0.7179385590       -2.1959648821
   H         -0.7516088753        0.3797959748       -1.5220418727
   O         -0.0190812647       -0.1649785850        2.3342915095
   H         -0.6721922620       -0.5931468466        1.7808027518
   H         -0.1618158889       -0.5362292293        3.2049416264
   O          1.9052322180        1.3087284584       -0.6150076833
   H          1.3533328254        0.9971734706       -1.3323446961
   H          1.3023826366        1.7683452394       -0.0305792130
   O         -0.0749230950        2.2708854732        1.0833122000
   H         -0.0439659533        3.0056076394        1.6960575255
   H         -0.0240363281        1.4929263629        1.6386697423
   O          0.1709809400       -2.3971173941       -1.2175974464
   H          0.4132525988       -3.2960767748       -1.4398772594
   H          0.8616684270       -2.1021814177       -0.6241369128
   O         -1.6936824014       -1.2955448529        0.5652820750
   H         -1.1873021616       -1.7339540725       -0.1185367964
   H         -2.0557977759       -0.5203727248        0.1360822761
    24
 Energy=    -287.103596581085
   O          1.8465549193       -1.1874089434        0.5314318515
   H          1.3162287654       -0.9329193236        1.2865616707
   H          2.0674733330       -0.3601448598        0.1035755317
   O         -2.0005899905        1.2307021668       -0.5770394516
   H         -1.3560180319        1.7222381438       -0.0679704843
   H         -2.1388247990        1.7588935825       -1.3632562195
   O         -0.0304515096        0.2136986978       -2.2119629692
   H          0.0493259267       -0.7397477494       -2.1835504194
   H         -0.7593271728        0.4111718951       -1.6237653460
   O         -0.0189772215       -0.1827659082        2.3531826624
   H         -0.6588699001       -0.6163532762        1.7885844034
   H         -0.1672808909       -0.5620702385        3.2194194007
   O          1.8825033367        1.3018951744       -0.6120812126
   H          1.3092148552        0.9851763037       -1.3101222673
   H          1.2987807111        1.7726276656       -0.0171773060
   O         -0.0810838684        2.2789889833        1.0942437240
   H         -0.0428620246        3.0042533656        1.7177519488
   H         -0.0321649237        1.4925111302        1.6376509042
   O          0.1534225260       -2.3740556740       -1.2215948500
   H          0.3865159379       -3.2814959449       -1.4176852784
   H          0.8422311284       -2.0719041209       -0.6295821911
   O         -1.6831824951       -1.3007156687        0.5706855704
   H         -1.1778483514       -1.7480693063       -0.1080956655
   H         -2.0277057121       -0.5195885154        0.1378161174
    24
 Energy=    -290.463267428075
   O          1.8411541470       -1.1742776616        0.5318075575
   H          1.3231847203       -0.9233698233        1.2966505281
   H          2.0506849835       -0.3453579507        0.1014347176
   O         -1.9902156463        1.2719151504       -0.6058948633
   H         -1.3386554410        1.6853193254       -0.0395044265
   H         -2.1900209350        1.9356168900       -1.2660536984
   O         -0.0096943005        0.2155215630       -2.2541299662
   H          0.0446640678       -0.7280329219       -2.1025320047
   H         -0.7927828351        0.4904820614       -1.7772642499
   O         -0.0238257720       -0.2102972246        2.3936417206
   H         -0.6584650949       -0.6440748017        1.8232893879
   H         -0.1718349665       -0.5982010411        3.2561124433
   O          1.8896329383        1.2787207000       -0.6451483391
   H          1.2986461432        0.9690095055       -1.3314758295
   H          1.3274046896        1.7749051477       -0.0502263020
   O         -0.0569272637        2.2178225529        1.1008862928
   H          0.0026825007        2.9364351647        1.7303896130
   H         -0.0132053595        1.4255474844        1.6362557455
   O          0.1368321431       -2.3335544927       -1.1907189876
   H          0.3621465840       -3.2486456571       -1.3582701849
   H          0.8229374312       -2.0216333678       -0.6006371412
   O         -1.7133502439       -1.2936816738        0.5836600805
   H         -1.2074980840       -1.7540038850       -0.0860031888
   H         -2.0375844347       -0.5086987488        0.1421786686
    24
 Energy=    -291.606976908742
   O          1.8543912366       -1.1614827546        0.5549676664
   H          1.3455950558       -0.9073194069        1.3248762838
   H          2.0656705152       -0.3338369046        0.1230009391
   O         -2.0081331992        1.2907615644       -0.6213078314
   H         -1.3537617899        1.6668977994       -0.0326216404
   H         -2.2344214775        2.0053744165       -1.2165841762
   O         -0.0119849687        0.2206137178       -2.2754212882
   H          0.0406383953       -0.7119260447       -2.0660598477
   H         -0.8010420349        0.5233210600       -1.8259893675
   O         -0.0386395188       -0.2478915828        2.3980040074
   H         -0.6833924572       -0.6765270843        1.8351566965
   H         -0.1801453756       -0.6340795688        3.2623342521
   O          1.9262374319        1.2660720654       -0.6705312759
   H          1.3369173084        0.9650213565       -1.3621251616
   H          1.3651173864        1.7663773992       -0.0780190755
   O         -0.0385009374        2.1689363060        1.0874826454
   H          0.0334171622        2.8908599600        1.7118910573
   H          0.0036940547        1.3796156214        1.6273199168
   O          0.1240104189       -2.3034579042       -1.1698232513
   H          0.3534280499       -3.2168120125       -1.3412398883
   H          0.8095382512       -1.9905294821       -0.5796036026
   O         -1.7335520436       -1.2655089554        0.6042727592
   H         -1.2243661592       -1.7301430871       -0.0598632951
   H         -2.0581415977       -0.4849733307        0.1552320038
    24
 Energy=    -292.346606634115
   O          1.8607574430       -1.1608902555        0.5709192229
   H          1.3527688759       -0.8983991275        1.3385635828
   H          2.0780335840       -0.3374658465        0.1338892911
   O         -2.0139176465        1.2933209598       -0.6406543079
   H         -1.3581576349        1.6481168381       -0.0403789277
   H         -2.2617407511        2.0358747154       -1.1914986315
   O         -0.0238000284        0.2287782446       -2.2911813688
   H          0.0311662062       -0.6966600970       -2.0529075163
   H         -0.8068503795        0.5462844888       -1.8414550382
   O         -0.0280080113       -0.2628604267        2.4127842720
   H         -0.6832438699       -0.6758254082        1.8503273994
   H         -0.1724810410       -0.6520690528        3.2752667525
   O          1.9599194184        1.2534488933       -0.6930413036
   H          1.3768369476        0.9575915209       -1.3921229065
   H          1.3930289803        1.7473335747       -0.1006351991
   O         -0.0318173731        2.1313429355        1.0806748782
   H          0.0502740175        2.8573153817        1.6991058371
   H          0.0083526110        1.3457578957        1.6260869771
   O          0.1191367171       -2.2743830907       -1.1388664979
   H          0.3568386803       -3.1826115046       -1.3255500937
   H          0.8048379690       -1.9634912899       -0.5477726632
   O         -1.7684573199       -1.2433703977        0.6041009770
   H         -1.2554100559       -1.7104476658       -0.0553330003
   H         -2.0952653271       -0.4674942257        0.1486401860
    24
 Energy=    -293.375209786985
   O          1.8900969632       -1.1768041456        0.6030321009
   H          1.3720389742       -0.8927408131        1.3561295601
   H          2.1205948068       -0.3654265106        0.1505181038
   O         -1.9905148677        1.3039570894       -0.6849813891
   H         -1.3431039896        1.6573253517       -0.0748815069
   H         -2.2904487266        2.0640686381       -1.1834810920
   O         -0.0410607156        0.2369407197       -2.3174188736
   H          0.0168675205       -0.6855913794       -2.0688013248
   H         -0.7912928220        0.5712984851       -1.8259023315
   O         -0.0245510836       -0.2959713263        2.4219907061
   H         -0.7066059215       -0.6658093597        1.8614080920
   H         -0.1775769952       -0.6925792216        3.2796136347
   O          1.9671990116        1.2252718438       -0.7128148492
   H          1.4002117683        0.9428050587       -1.4304288271
   H          1.3829161273        1.6906095888       -0.1142280683
   O         -0.0184085598        2.0795665990        1.0529048689
   H          0.0874973094        2.8185434284        1.6520117312
   H          0.0166557874        1.3067168029        1.6165585960
   O          0.1040275206       -2.2290554866       -1.0823862044
   H          0.3688734723       -3.1153544440       -1.3284809423
   H          0.7920617042       -1.9292288762       -0.4882946239
   O         -1.8130476952       -1.1834728097        0.6238675672
   H         -1.2894101596       -1.6559137942       -0.0233071291
   H         -2.1391280344       -0.4156426948        0.1544632990
    24
 Energy=    -294.045426385094
   O          1.8972796552       -1.2052177179        0.6184804488
   H          1.3685802734       -0.9271926018        1.3664181724
   H          2.1112603736       -0.3924040256        0.1604651720
   O         -1.9592805934        1.3154945188       -0.7042851586
   H         -1.3265708381        1.7007352217       -0.0980675357
   H         -2.3076310931        2.0609394074       -1.1933615202
   O         -0.0324289248        0.2290370391       -2.3545334128
   H          0.0003298165       -0.6946439947       -2.1055915469
   H         -0.7687524568        0.5855516319       -1.8575858891
   O         -0.0167701451       -0.2879804332        2.4193401500
   H         -0.7074440406       -0.6408380810        1.8583652035
   H         -0.1718989522       -0.6912345001        3.2734789272
   O          1.9248215590        1.1857232752       -0.6980209689
   H          1.3659013176        0.9095637654       -1.4243651909
   H          1.3295411250        1.6251864437       -0.0907770572
   O         -0.0104702255        2.1061200606        1.0767424114
   H          0.1180761197        2.8530685485        1.6613582113
   H          0.0177808732        1.3425156547        1.6532335446
   O          0.0904429445       -2.2318675490       -1.0777918577
   H          0.3770279602       -3.0943140045       -1.3782697772
   H          0.7819658670       -1.9432263557       -0.4822130223
   O         -1.8176835332       -1.1537356732        0.6271417024
   H         -1.2886380552       -1.6369826126       -0.0075354736
   H         -2.1141000780       -0.3779008227        0.1512747497
    24
 Energy=    -294.268493069827
   O          1.8952500414       -1.2203655983        0.6270620526
   H          1.3606806833       -0.9446283245        1.3716669124
   H          2.0977192014       -0.4079882147        0.1630781456
   O         -1.9313838457        1.3194465937       -0.7037256096
   H         -1.3034088824        1.7170878090       -0.1005997941
   H         -2.3073801790        2.0591961229       -1.1808306624
   O         -0.0290859102        0.2169726179       -2.3628523214
   H         -0.0027650281       -0.7039327632       -2.1030979563
   H         -0.7679327147        0.5825313247       -1.8763298950
   O         -0.0163860060       -0.2766598670        2.4215352166
   H         -0.7063538211       -0.6294897161        1.8596746006
   H         -0.1700644602       -0.6831839389        3.2743851165
   O          1.9050771869        1.1758581803       -0.6838777823
   H          1.3483496094        0.9085609036       -1.4152042553
   H          1.3106141949        1.6208639257       -0.0798782146
   O         -0.0137513450        2.1214638110        1.0870090481
   H          0.1299107943        2.8692222414        1.6670524600
   H          0.0097395322        1.3600986842        1.6666668457
   O          0.0779111062       -2.2378494012       -1.0942612534
   H          0.3739964390       -3.0875555673       -1.4207038164
   H          0.7715642731       -1.9546592329       -0.4985428193
   O         -1.8113961091       -1.1433103692        0.6179742009
   H         -1.2819452944       -1.6356027587       -0.0093709019
   H         -2.0824862450       -0.3594159717        0.1402174095
    24
 Energy=    -294.468888594732
   O          1.8830898751       -1.2242565842        0.6259101349
   H          1.3469924001       -0.9495188793        1.3697854812
   H          2.0796304437       -0.4122005839        0.1588248137
   O         -1.9271404932        1.3226332720       -0.7063033266
   H         -1.2983231650        1.7205219962       -0.1042193035
   H         -2.3206927091        2.0638646858       -1.1666558920
   O         -0.0242513934        0.2100524095       -2.3693067041
   H          0.0031740952       -0.7080268855       -2.0998441081
   H         -0.7654927621        0.5790726380       -1.8890805655
   O         -0.0221785614       -0.2733514624        2.4225798414
   H         -0.7097247807       -0.6293185350        1.8597304126
   H         -0.1744269261       -0.6815842074        3.2748698750
   O          1.9027124416        1.1685446620       -0.6745122044
   H          1.3462531017        0.9077037014       -1.4083697085
   H          1.3117081450        1.6247674683       -0.0755076031
   O         -0.0103927407        2.1345309101        1.0947606728
   H          0.1424399178        2.8800229118        1.6753773225
   H          0.0106463708        1.3718720374        1.6728096670
   O          0.0815812704       -2.2427701367       -1.0964914989
   H          0.3828923994       -3.0846042748       -1.4381912613
   H          0.7766544294       -1.9628744895       -0.5008711749
   O         -1.8078440199       -1.1408923599        0.6125920923
   H         -1.2796550332       -1.6399871936       -0.0104268329
   H         -2.0612979831       -0.3515617558        0.1341047613
    24
 Energy=    -294.658070272220
   O          1.8692423375       -1.2235620808        0.6283569290
   H          1.3338457983       -0.9505697789        1.3733788005
   H          2.0619479320       -0.4108991214        0.1607296113
   O         -1.9204488851        1.3256227063       -0.7025995290
   H         -1.2906946649        1.7216248466       -0.1002509862
   H         -2.3360590574        2.0695691251       -1.1385396059
   O         -0.0163910964        0.2082274960       -2.3687467615
   H          0.0143159818       -0.7050996716       -2.0839268182
   H         -0.7634431760        0.5806996737       -1.9003350760
   O         -0.0357191825       -0.2664275203        2.4231523166
   H         -0.7182940917       -0.6281641709        1.8579356068
   H         -0.1865758522       -0.6770427066        3.2745448664
   O          1.9054209545        1.1605704483       -0.6742772702
   H          1.3487575366        0.9079031070       -1.4108347316
   H          1.3214745913        1.6377744908       -0.0847734224
   O         -0.0073228826        2.1425418698        1.0980179447
   H          0.1562508477        2.8819429886        1.6834762783
   H          0.0112224518        1.3750676146        1.6697444337
   O          0.0893673394       -2.2515624879       -1.0958669893
   H          0.3955398349       -3.0853095267       -1.4527368793
   H          0.7860455273       -1.9750135905       -0.5005586239
   O         -1.8093508164       -1.1418543768        0.6012956098
   H         -1.2829766011       -1.6493065561       -0.0164861568
   H         -2.0481213548       -0.3500735974        0.1193167023
    24
 Energy=    -294.785318582032
   O          1.8670900978       -1.2223712153        0.6385813180
   H          1.3302949519       -0.9478701699        1.3820407907
   H          2.0618483350       -0.4104859413        0.1704538023
   O         -1.9186613403        1.3274515933       -0.7034344692
   H         -1.2893520568        1.7219862960       -0.0996596485
   H         -2.3596563230        2.0727289371       -1.1112542162
   O         -0.0109245066        0.1996096143       -2.3711392634
   H          0.0192085220       -0.7104951575       -2.0761254590
   H         -0.7609519262        0.5763489115       -1.9109673261
   O         -0.0588749823       -0.2606613458        2.4176747303
   H         -0.7357964337       -0.6258446273        1.8478937553
   H         -0.2115004213       -0.6743118047        3.2672808822
   O          1.9134505925        1.1534859831       -0.6714456134
   H          1.3554195910        0.9032238665       -1.4077893608
   H          1.3355604533        1.6466260067       -0.0891332023
   O          0.0035613998        2.1540908533        1.0982363396
   H          0.1778301342        2.8845503816        1.6917775140
   H          0.0195335651        1.3792824494        1.6600625291
   O          0.0892702346       -2.2532532693       -1.0957650785
   H          0.3998195147       -3.0792205182       -1.4666681498
   H          0.7874641472       -1.9797961872       -0.5008043027
   O         -1.8102000016       -1.1447731740        0.5966399906
   H         -1.2850789461       -1.6601452140       -0.0156274161
   H         -2.0400270100       -0.3538418624        0.1089525430
    24
 Energy=    -294.909459891686
   O          1.8641639458       -1.2253695158        0.6476216161
   H          1.3235683587       -0.9466411950        1.3867418867
   H          2.0658212711       -0.4155066188        0.1789124832
   O         -1.9125121207        1.3262983777       -0.7028538532
   H         -1.2852697435        1.7211298928       -0.0971254363
   H         -2.3760147496        2.0704113967       -1.0871622813
   O         -0.0077206555        0.1959666293       -2.3699766918
   H          0.0182698540       -0.7123846535       -2.0692205106
   H         -0.7588632189        0.5777415128       -1.9158130344
   O         -0.0690266534       -0.2501634660        2.4164216905
   H         -0.7397836543       -0.6163876117        1.8400565624
   H         -0.2271738093       -0.6666180958        3.2636447181
   O          1.9222159579        1.1502276066       -0.6731906688
   H          1.3625825749        0.8976789490       -1.4075349287
   H          1.3481445898        1.6538246147       -0.0960737327
   O          0.0099640671        2.1583725565        1.0936671955
   H          0.1946098870        2.8803446088        1.6944118308
   H          0.0226101279        1.3770119484        1.6464307229
   O          0.0915801360       -2.2516395335       -1.0893414442
   H          0.4047354046       -3.0725898481       -1.4690863569
   H          0.7908238376       -1.9801486248       -0.4947131803
   O         -1.8232722315       -1.1496484271        0.5872695699
   H         -1.2985406367       -1.6704007032       -0.0207646894
   H         -2.0517992248       -0.3621732154        0.0934173205
    24
 Energy=    -295.008360527888
   O          1.8662003062       -1.2253833099        0.6555445437
   H          1.3221371312       -0.9420693866        1.3903644689
   H          2.0764306794       -0.4175404075        0.1871164541
   O         -1.9090647626        1.3240193431       -0.7047033536
   H         -1.2850888624        1.7210702056       -0.0970549943
   H         -2.3862971366        2.0654708560       -1.0771691308
   O         -0.0037728310        0.1986975574       -2.3658138707
   H          0.0167496338       -0.7099526272       -2.0655381466
   H         -0.7528796155        0.5846243934       -1.9117969738
   O         -0.0761359120       -0.2472471492        2.4073850844
   H         -0.7447128929       -0.6132301197        1.8283400725
   H         -0.2382879234       -0.6630862850        3.2541532807
   O          1.9276980103        1.1469871645       -0.6781464704
   H          1.3668098142        0.8882477465       -1.4093715966
   H          1.3535124051        1.6517659762       -0.1021767819
   O          0.0122606596        2.1577186589        1.0889752394
   H          0.2050919841        2.8755280806        1.6921315660
   H          0.0219514798        1.3737192042        1.6380497181
   O          0.0902363135       -2.2514740332       -1.0827590685
   H          0.4035492987       -3.0718942910       -1.4635180656
   H          0.7897339356       -1.9802236464       -0.4883197157
   O         -1.8310876202       -1.1487385718        0.5889575313
   H         -1.3058532040       -1.6707208240       -0.0175860998
   H         -2.0641933471       -0.3649834318        0.0913417753
    24
 Energy=    -295.316840889316
   O          1.8510119680       -1.2337834353        0.6566790136
   H          1.2986897058       -0.9436481067        1.3826221586
   H          2.0784095289       -0.4287200561        0.1914960981
   O         -1.8933059568        1.3298372532       -0.7257220870
   H         -1.2794884113        1.7408909477       -0.1170393116
   H         -2.4476813655        2.0486122802       -1.0294690322
   O          0.0300409443        0.1800700402       -2.3596751115
   H          0.0208296133       -0.7279401865       -2.0569137869
   H         -0.7172685626        0.5868523247       -1.9211679692
   O         -0.0814370806       -0.2392223966        2.3986573692
   H         -0.7651807522       -0.6032994896        1.8363635830
   H         -0.2464034780       -0.6263026795        3.2584170928
   O          1.9505153161        1.1420606280       -0.6695080785
   H          1.3977835444        0.8653770654       -1.4003744375
   H          1.3624298582        1.6344643913       -0.0968599598
   O          0.0238244717        2.1629023683        1.0711743866
   H          0.2854598598        2.8774104745        1.6519126493
   H          0.0133408207        1.3882821058        1.6333890983
   O          0.0579962274       -2.2621362581       -1.0587785557
   H          0.3632924879       -3.0952835600       -1.4177933279
   H          0.7567167497       -1.9859431165       -0.4657028267
   O         -1.8585129726       -1.1265306281        0.5912089105
   H         -1.3334636592       -1.6498849154       -0.0143118146
   H         -2.0695926179       -0.3320286228        0.1008582331
    24
 Energy=    -295.324469953212
   O          1.8502719003       -1.2336495481        0.6565693158
   H          1.2984616908       -0.9433439893        1.3828337409
   H          2.0776856676       -0.4286513539        0.1912815277
   O         -1.8920065551        1.3301076756       -0.7260814008
   H         -1.2779606916        1.7415137668       -0.1178671740
   H         -2.4486743609        2.0481166611       -1.0274381506
   O          0.0311929268        0.1794299150       -2.3605725820
   H          0.0212945135       -0.7285944344       -2.0578753036
   H         -0.7165532300        0.5864294848       -1.9230124430
   O         -0.0823362215       -0.2388906260        2.3985172666
   H         -0.7661154687       -0.6027215651        1.8361074259
   H         -0.2479276270       -0.6254752611        3.2583798407
   O          1.9501421624        1.1413668208       -0.6691616860
   H          1.3981792692        0.8650779798       -1.4007580781
   H          1.3613522283        1.6330820566       -0.0966458518
   O          0.0246856228        2.1630256249        1.0714454678
   H          0.2878477924        2.8773400214        1.6517319964
   H          0.0141219090        1.3884990837        1.6337877879
   O          0.0566503572       -2.2626066329       -1.0586636827
   H          0.3614581005       -3.0965050029       -1.4163473253
   H          0.7553120017       -1.9861168517       -0.4656568130
   O         -1.8583899530       -1.1255710992        0.5919023692
   H         -1.3331749502       -1.6491447919       -0.0132848987
   H         -2.0686706825       -0.3308998856        0.1014826336
    24
 Energy=    -295.371273753060
   O          1.8369380029       -1.2384353659        0.6609202885
   H          1.2940006348       -0.9440453059        1.3922104818
   H          2.0657425988       -0.4351796217        0.1933087977
   O         -1.8801876776        1.3294137110       -0.7315995190
   H         -1.2629976253        1.7447714507       -0.1292821381
   H         -2.4656708272        2.0371051720       -1.0010695873
   O          0.0417863478        0.1758492716       -2.3754107900
   H          0.0256134129       -0.7325703412       -2.0741732040
   H         -0.7087904094        0.5849189034       -1.9446807030
   O         -0.0895093085       -0.2358561287        2.4057723158
   H         -0.7695388477       -0.5966880680        1.8369208612
   H         -0.2668863271       -0.6191382295        3.2647624580
   O          1.9511306034        1.1362866651       -0.6663173724
   H          1.4064973418        0.8663872546       -1.4057501000
   H          1.3567870363        1.6235579815       -0.0957437765
   O          0.0331875280        2.1682549118        1.0738856326
   H          0.3146286847        2.8786764545        1.6503610848
   H          0.0220550352        1.3933878299        1.6357476378
   O          0.0459309802       -2.2648674017       -1.0567755811
   H          0.3434344377       -3.1093398683       -1.3952867122
   H          0.7438832085       -1.9842211233       -0.4648869147
   O         -1.8585873584       -1.1169254619        0.5923884923
   H         -1.3316287159       -1.6455651417       -0.0068497892
   H         -2.0581555223       -0.3215805693        0.0985961373
    24
 Energy=    -295.382549225010
   O          1.8378743704       -1.2380402888        0.6634195860
   H          1.2962552860       -0.9428560208        1.3953668896
   H          2.0675032309       -0.4350948149        0.1956792815
   O         -1.8791496322        1.3289078351       -0.7310302263
   H         -1.2630155963        1.7458035564       -0.1286942342
   H         -2.4660921169        2.0352399633       -1.0008918286
   O          0.0408111781        0.1779714772       -2.3754947162
   H          0.0251609692       -0.7305446511       -2.0745207045
   H         -0.7092800011        0.5867909324       -1.9436825859
   O         -0.0895635306       -0.2335107198        2.4068102411
   H         -0.7680313066       -0.5941484189        1.8359742166
   H         -0.2686163356       -0.6179629861        3.2649293400
   O          1.9501987109        1.1353395493       -0.6670186975
   H          1.4051448980        0.8669500013       -1.4066910787
   H          1.3571177600        1.6248339681       -0.0970344525
   O          0.0317276466        2.1649880714        1.0743820566
   H          0.3135858470        2.8752530201        1.6508467108
   H          0.0209137708        1.3899854686        1.6360633414
   O          0.0470223975       -2.2647923879       -1.0592043193
   H          0.3437067600       -3.1103409115       -1.3957424647
   H          0.7449192963       -1.9837732421       -0.4674273357
   O         -1.8582997666       -1.1171473253        0.5910845470
   H         -1.3311944065       -1.6468083218       -0.0071219459
   H         -2.0580200430       -0.3227869233        0.0957713097
    24
 Energy=    -295.385647340534
   O          1.8381508317       -1.2387171836        0.6637705420
   H          1.2969679829       -0.9432071906        1.3959090591
   H          2.0687322669       -0.4358360996        0.1963884641
   O         -1.8791973785        1.3283906272       -0.7313687866
   H         -1.2642916785        1.7463719357       -0.1285301299
   H         -2.4679568547        2.0334084706       -1.0007086455
   O          0.0392812646        0.1786917980       -2.3754336193
   H          0.0238199015       -0.7300165869       -2.0750307940
   H         -0.7101919407        0.5873816670       -1.9424274468
   O         -0.0901928557       -0.2319908759        2.4077455292
   H         -0.7676201430       -0.5930273622        1.8359267065
   H         -0.2700772822       -0.6167889695        3.2655356319
   O          1.9487445941        1.1335590794       -0.6668879458
   H          1.4032146315        0.8656769047       -1.4063932131
   H          1.3566233745        1.6247783683       -0.0973899990
   O          0.0309581539        2.1645469047        1.0742649012
   H          0.3137283857        2.8747124826        1.6504052382
   H          0.0200285024        1.3896433347        1.6360805648
   O          0.0494144499       -2.2639254090       -1.0602403445
   H          0.3452635506       -3.1105160354       -1.3948886089
   H          0.7472508836       -1.9826141407       -0.4685308531
   O         -1.8565340148       -1.1167729142        0.5909947893
   H         -1.3294820297       -1.6474077057       -0.0063951696
   H         -2.0560102733       -0.3230714995        0.0945281474
    24
 Energy=    -295.387123321586
   O          1.8375602918       -1.2410800913        0.6652245887
   H          1.2961262038       -0.9458362079        1.3972847076
   H          2.0688950177       -0.4379608723        0.1986245408
   O         -1.8797784788        1.3283809882       -0.7316719606
   H         -1.2666485593        1.7472883472       -0.1276685116
   H         -2.4717295076        2.0315675858       -0.9987944578
   O          0.0372407883        0.1785751601       -2.3769134379
   H          0.0218372184       -0.7303264202       -2.0770926793
   H         -0.7114987716        0.5872603028       -1.9426354561
   O         -0.0888564863       -0.2294864616        2.4087125769
   H         -0.7655804617       -0.5913769320        1.8366008846
   H         -0.2692026715       -0.6137689424        3.2666368558
   O          1.9472024300        1.1320883944       -0.6667020094
   H          1.4010663301        0.8635553206       -1.4055234958
   H          1.3558565632        1.6249029012       -0.0977769109
   O          0.0297243410        2.1662731131        1.0737850859
   H          0.3145167344        2.8764181333        1.6489539158
   H          0.0181491992        1.3918641335        1.6362693864
   O          0.0517029471       -2.2642032239       -1.0603366846
   H          0.3464737350       -3.1120458583       -1.3927594425
   H          0.7494576628       -1.9826657244       -0.4686384228
   O         -1.8539984513       -1.1166024873        0.5904037955
   H         -1.3271625140       -1.6483501069       -0.0061866872
   H         -2.0533142867       -0.3236519299        0.0926745004
    24
 Energy=    -295.388707467989
   O          1.8382087793       -1.2406357735        0.6655297402
   H          1.2962669845       -0.9453676119        1.3972042879
   H          2.0696834978       -0.4375531466        0.1989361387
   O         -1.8798474565        1.3284456638       -0.7320256237
   H         -1.2669694771        1.7471881236       -0.1276522501
   H         -2.4726543605        2.0313543316       -0.9979790393
   O          0.0373304227        0.1780203611       -2.3767122987
   H          0.0218458193       -0.7308360117       -2.0767587012
   H         -0.7113306361        0.5868534379       -1.9424382212
   O         -0.0890574743       -0.2291304308        2.4081133679
   H         -0.7660506861       -0.5913593420        1.8365346357
   H         -0.2690559811       -0.6128324178        3.2663704172
   O          1.9461792312        1.1311266659       -0.6666436764
   H          1.4000554859        0.8620877478       -1.4052902464
   H          1.3547384694        1.6240284665       -0.0978928695
   O          0.0297361497        2.1673249594        1.0736516116
   H          0.3150947988        2.8775361834        1.6484579258
   H          0.0179797311        1.3931262156        1.6364214861
   O          0.0511592812       -2.2650731454       -1.0607053297
   H          0.3457692989       -3.1130576390       -1.3929086955
   H          0.7488956834       -1.9835861899       -0.4689614266
   O         -1.8528263137       -1.1161043645        0.5911703823
   H         -1.3260891994       -1.6479172303       -0.0054492018
   H         -2.0523013410       -0.3232478941        0.0933549839
    24
 Energy=    -295.390313448926
   O          1.8380331222       -1.2402830074        0.6654220423
   H          1.2949677505       -0.9447189605        1.3961434230
   H          2.0687925976       -0.4375561853        0.1978628977
   O         -1.8790625370        1.3287129981       -0.7323661841
   H         -1.2660127874        1.7466060800       -0.1275792658
   H         -2.4725753391        2.0317630439       -0.9963643408
   O          0.0379165526        0.1755592681       -2.3763780887
   H          0.0218912650       -0.7329516736       -2.0754081584
   H         -0.7110057075        0.5851100510       -1.9432321035
   O         -0.0881830942       -0.2280811826        2.4074819620
   H         -0.7660608980       -0.5906194293        1.8371491268
   H         -0.2673174087       -0.6107163147        3.2663958651
   O          1.9456850231        1.1319454206       -0.6670688915
   H          1.3998620838        0.8619303741       -1.4055816088
   H          1.3536850960        1.6244362566       -0.0985438677
   O          0.0298698002        2.1684530707        1.0733014533
   H          0.3153286917        2.8788812713        1.6477897761
   H          0.0182606934        1.3944571396        1.6363532868
   O          0.0501998584       -2.2663423390       -1.0596797356
   H          0.3450985463       -3.1137780504       -1.3930253806
   H          0.7479538714       -1.9853022974       -0.4677442050
   O         -1.8533426452       -1.1160314456        0.5916152861
   H         -1.3269018743       -1.6473284116       -0.0057250597
   H         -2.0538238638       -0.3231374216        0.0942641148
    24
 Energy=    -295.392160116768
   O          1.8383122128       -1.2395620164        0.6672442221
   H          1.2951988488       -0.9434399834        1.3977039784
   H          2.0680912540       -0.4373128336        0.1983842420
   O         -1.8787075756        1.3281379983       -0.7336917803
   H         -1.2667456542        1.7461657426       -0.1278970530
   H         -2.4763459831        2.0294079601       -0.9930768507
   O          0.0375909004        0.1730072663       -2.3773109811
   H          0.0214806714       -0.7349238155       -2.0746008043
   H         -0.7109418371        0.5836064954       -1.9444843946
   O         -0.0877379794       -0.2251775180        2.4084819457
   H         -0.7650643079       -0.5887572589        1.8381569010
   H         -0.2671112269       -0.6070080928        3.2677039719
   O          1.9445748396        1.1308816919       -0.6684007170
   H          1.3985513689        0.8601720683       -1.4065108098
   H          1.3530025122        1.6248765604       -0.1007361228
   O          0.0290336667        2.1700684278        1.0719551518
   H          0.3153385469        2.8806549524        1.6458263451
   H          0.0183240697        1.3962139530        1.6352192074
   O          0.0508319842       -2.2675189053       -1.0582697903
   H          0.3451752429       -3.1152170534       -1.3914390203
   H          0.7485452029       -1.9870369292       -0.4660215607
   O         -1.8524590297       -1.1158453218        0.5920599505
   H         -1.3268902090       -1.6477923856       -0.0054696103
   H         -2.0536328026       -0.3234753469        0.0941535576
    24
 Energy=    -295.394453203621
   O          1.8389224934       -1.2393073743        0.6700374023
   H          1.2976069944       -0.9418173105        1.4012754159
   H          2.0674602929       -0.4379480697        0.1990537730
   O         -1.8793180260        1.3261057129       -0.7359955037
   H         -1.2677559832        1.7455785258       -0.1307961423
   H         -2.4839351031        2.0239709623       -0.9882931927
   O          0.0368058669        0.1709270574       -2.3808971775
   H          0.0218527109       -0.7360144964       -2.0751762897
   H         -0.7119024811        0.5821550852       -1.9489722319
   O         -0.0871284255       -0.2229822377        2.4106527037
   H         -0.7632662494       -0.5868135280        1.8390791956
   H         -0.2680719486       -0.6047155379        3.2695886553
   O          1.9426779324        1.1289872289       -0.6704684053
   H          1.3971169625        0.8586222107       -1.4090466509
   H          1.3512523254        1.6244853065       -0.1039622302
   O          0.0274449487        2.1703882895        1.0698976404
   H          0.3150397714        2.8819360610        1.6419298309
   H          0.0191108679        1.3972605048        1.6341988114
   O          0.0522291221       -2.2663048036       -1.0559302841
   H          0.3455437754       -3.1146133613       -1.3884523812
   H          0.7498192404       -1.9866763720       -0.4631336857
   O         -1.8500135515       -1.1137955844        0.5945582921
   H         -1.3254167290       -1.6475796039       -0.0021867409
   H         -2.0503802161       -0.3221229953        0.0952191775
    24
 Energy=    -295.395525799813
   O          1.8405231001       -1.2392148664        0.6702339198
   H          1.2988344722       -0.9412049882        1.4009837970
   H          2.0687839873       -0.4382537138        0.1984394313
   O         -1.8820975357        1.3244667956       -0.7357111670
   H         -1.2693864319        1.7448505629       -0.1323087876
   H         -2.4887132973        2.0213408911       -0.9859423657
   O          0.0352102385        0.1705540005       -2.3806583785
   H          0.0209260734       -0.7361710540       -2.0742640606
   H         -0.7141053269        0.5814189234       -1.9494414509
   O         -0.0842941321       -0.2208523349        2.4105645290
   H         -0.7615876564       -0.5853348084        1.8407769822
   H         -0.2636979272       -0.6013462107        3.2703729547
   O          1.9421954120        1.1282545059       -0.6715166863
   H          1.3967110091        0.8577445829       -1.4100984271
   H          1.3504808308        1.6230553184       -0.1047029159
   O          0.0268244024        2.1706986410        1.0667507953
   H          0.3140392433        2.8834827887        1.6374330484
   H          0.0190957148        1.3985993439        1.6324669633
   O          0.0527065859       -2.2658988735       -1.0547549340
   H          0.3459083771       -3.1138834471       -1.3882016504
   H          0.7501953288       -1.9871470258       -0.4614264406
   O         -1.8493448584       -1.1140606870        0.5968700690
   H         -1.3241762007       -1.6474209702        0.0002491431
   H         -2.0508795987       -0.3228850922        0.0972134202
    24
 Energy=    -295.395831531290
   O          1.8418052389       -1.2380087065        0.6711224370
   H          1.3005722726       -0.9396268800        1.4020581400
   H          2.0689000502       -0.4373952345        0.1981765045
   O         -1.8838713080        1.3222181009       -0.7348107701
   H         -1.2706937406        1.7438967102       -0.1327872978
   H         -2.4912375144        2.0183291935       -0.9853451550
   O          0.0327503929        0.1700268939       -2.3819145370
   H          0.0203807780       -0.7364789021       -2.0747890343
   H         -0.7164950336        0.5800635592       -1.9497883239
   O         -0.0827569724       -0.2189147097        2.4115139350
   H         -0.7595830959       -0.5845556363        1.8419132403
   H         -0.2619101516       -0.5988932720        3.2716024598
   O          1.9402985663        1.1279698422       -0.6735976261
   H          1.3944105860        0.8574617132       -1.4118817889
   H          1.3490745278        1.6234045696       -0.1068257080
   O          0.0259231805        2.1715069453        1.0652366037
   H          0.3118156093        2.8853364859        1.6352758533
   H          0.0193119756        1.3999664195        1.6317287475
   O          0.0546514312       -2.2653984426       -1.0545195938
   H          0.3467087832       -3.1143723591       -1.3864497553
   H          0.7519387741       -1.9870960451       -0.4607435611
   O         -1.8470339232       -1.1154841944        0.5986577673
   H         -1.3215758785       -1.6481536930        0.0016746113
   H         -2.0498836409       -0.3245382957        0.0991696120
    24
 Energy=    -295.395831531289
   O          0.0546514254       -2.2653985006       -1.0545196579
   H          0.7519387411       -1.9870960435       -0.4607436213
   H          0.3467088387       -3.1143724053       -1.3864497961
   O          1.9402985947        1.1279698578       -0.6735976228
   H          1.3944106121        0.8574617288       -1.4118817839
   H          1.3490745600        1.6234045922       -0.1068257069
   O          0.0259232094        2.1715069626        1.0652365963
   H          0.3118157230        2.8853364692        1.6352758460
   H          0.0193119774        1.3999664249        1.6317287235
   O         -1.8470338780       -1.1154842369        0.5986577676
   H         -2.0498836126       -0.3245383402        0.0991696160
   H         -1.3215758773       -1.6481537502        0.0016745860
   O         -0.0827570016       -0.2189146517        2.4115139559
   H         -0.7595830954       -0.5845556421        1.8419132669
   H         -0.2619103001       -0.5988930216        3.2716025409
   O          1.8418051669       -1.2380086946        0.6711224164
   H          1.3005722298       -0.9396268758        1.4020581442
   H          2.0688999982       -0.4373952128        0.1981765101
   O         -1.8838713091        1.3222180818       -0.7348107345
   H         -2.4912375479        2.0183291555       -0.9853450934
   H         -1.2706937290        1.7438967101       -0.1327872884
   O          0.0327504004        0.1700269052       -2.3819145088
   H          0.0203807801       -0.7364789103       -2.0747890638
   H         -0.7164950279        0.5800635456       -1.9497882753
    24
 Energy=    -295.393612978094
   O          0.0525989928       -2.2651301339       -1.0521599418
   H          0.7502783649       -1.9873437440       -0.4586028213
   H          0.3428912061       -3.1153308942       -1.3824945267
   O          1.9385350886        1.1244367926       -0.6757559390
   H          1.3925732822        0.8549065800       -1.4143431109
   H          1.3480275044        1.6214258951       -0.1095983063
   O          0.0264465770        2.1708659523        1.0654729868
   H          0.3077711058        2.8865253863        1.6354904638
   H          0.0204326151        1.4001452179        1.6330866070
   O         -1.8466896203       -1.1102509768        0.5999518541
   H         -2.0477547774       -0.3195908236        0.0992911260
   H         -1.3220852453       -1.6448080000        0.0039058168
   O         -0.0817329646       -0.2187823685        2.4145735820
   H         -0.7589405976       -0.5824775946        1.8441812222
   H         -0.2587912494       -0.6036482551        3.2729210951
   O          1.8413333498       -1.2387107167        0.6730029995
   H          1.3012913981       -0.9394597472        1.4044641314
   H          2.0676895685       -0.4386561091        0.1987590463
   O         -1.8807815419        1.3241379876       -0.7382618202
   H         -2.4903600775        2.0192090679       -0.9862981931
   H         -1.2692248497        1.7454843967       -0.1343599608
   O          0.0322586068        0.1673284386       -2.3854868042
   H          0.0201061431       -0.7381140192       -2.0752318876
   H         -0.7154002042        0.5794130398       -1.9525613791
    24
 Energy=    -295.392233349724
   O          0.0515566631       -2.2655909791       -1.0518602560
   H          0.7493805322       -1.9885220391       -0.4581376859
   H          0.3408356273       -3.1163010402       -1.3817722334
   O          1.9384487237        1.1227708514       -0.6764109654
   H          1.3918891256        0.8529110956       -1.4144354622
   H          1.3484140354        1.6200627641       -0.1100262374
   O          0.0280266332        2.1714223367        1.0657576343
   H          0.3111197637        2.8868002938        1.6352525842
   H          0.0211338431        1.4009332503        1.6336756716
   O         -1.8467658241       -1.1086902120        0.5993888572
   H         -2.0473975707       -0.3179065871        0.0987492655
   H         -1.3222204522       -1.6433977389        0.0034258940
   O         -0.0821303738       -0.2179712510        2.4150249554
   H         -0.7593702448       -0.5816071287        1.8446330327
   H         -0.2577238303       -0.6047408379        3.2728175089
   O          1.8401792180       -1.2397537105        0.6740285680
   H          1.2995866839       -0.9394402467        1.4046470563
   H          2.0678658673       -0.4402676218        0.1994628469
   O         -1.8792714930        1.3258530155       -0.7387235541
   H         -2.4903110051        2.0201177794       -0.9854197078
   H         -1.2686782821        1.7472865229       -0.1339082354
   O          0.0319017951        0.1659559906       -2.3860467146
   H          0.0195741402       -0.7389674675       -2.0742881478
   H         -0.7152237096        0.5791023374       -1.9532125474
    24
 Energy=    -295.390164136206
   O          0.0507147437       -2.2660524528       -1.0507919023
   H          0.7486409958       -1.9897210030       -0.4568460154
   H          0.3389545002       -3.1173056199       -1.3802121934
   O          1.9388197681        1.1208298943       -0.6765123008
   H          1.3919050693        0.8504876622       -1.4140970279
   H          1.3490083939        1.6183205936       -0.1100695526
   O          0.0302830619        2.1728415426        1.0656237307
   H          0.3179126082        2.8870146504        1.6343572854
   H          0.0218170831        1.4023524223        1.6335204491
   O         -1.8472966017       -1.1075032282        0.5988222155
   H         -2.0475557907       -0.3168243950        0.0978680460
   H         -1.3231223596       -1.6427564181        0.0030225624
   O         -0.0832808001       -0.2162676569        2.4144063755
   H         -0.7603924211       -0.5799705035        1.8439049013
   H         -0.2568529422       -0.6057609597        3.2713775060
   O          1.8383055536       -1.2415643251        0.6752650155
   H          1.2967316570       -0.9393681972        1.4043788988
   H          2.0674672889       -0.4431998176        0.1995225935
   O         -1.8772268639        1.3276881941       -0.7388499925
   H         -2.4903432873        2.0206714868       -0.9839912729
   H         -1.2673545456        1.7498209323       -0.1337949977
   O          0.0315527669        0.1642348715       -2.3867774744
   H          0.0177005808       -0.7403408814       -2.0740752769
   H         -0.7144628859        0.5792706168       -1.9538365824
    24
 Energy=    -295.387309322518
   O          0.0482709746       -2.2675235113       -1.0504953834
   H          0.7458376378       -1.9909532347       -0.4562383074
   H          0.3365122895       -3.1190998098       -1.3790780855
   O          1.9394339776        1.1182054728       -0.6767922065
   H          1.3928815715        0.8480706179       -1.4147213817
   H          1.3495866457        1.6163781786       -0.1109866566
   O          0.0327762898        2.1748737780        1.0648170746
   H          0.3253413098        2.8877231014        1.6326932857
   H          0.0225105666        1.4044197840        1.6327317673
   O         -1.8487936819       -1.1065226591        0.5987059807
   H         -2.0474474201       -0.3156550084        0.0974107670
   H         -1.3250381193       -1.6427514249        0.0034155797
   O         -0.0850684778       -0.2142465317        2.4133040409
   H         -0.7621059130       -0.5781297996        1.8428295728
   H         -0.2560666668       -0.6068750846        3.2693614448
   O          1.8374409055       -1.2419710754        0.6776416697
   H          1.2950723944       -0.9381376139        1.4054833186
   H          2.0676156564       -0.4446154135        0.2006978863
   O         -1.8751099981        1.3283777502       -0.7391133210
   H         -2.4904397729        2.0200895116       -0.9822921591
   H         -1.2650454527        1.7514045200       -0.1348770737
   O          0.0326925030        0.1631639984       -2.3867330061
   H          0.0169780046       -0.7413540253       -2.0739518695
   H         -0.7124726149        0.5797701493       -1.9538356716
    24
 Energy=    -295.384041115246
   O          0.0466185925       -2.2678053482       -1.0482105893
   H          0.7440284439       -1.9910817959       -0.4538408267
   H          0.3346368298       -3.1197645649       -1.3759953175
   O          1.9419674139        1.1161079435       -0.6763220516
   H          1.3961616455        0.8470544319       -1.4151983004
   H          1.3528029190        1.6177522421       -0.1128772578
   O          0.0352378587        2.1760084279        1.0629769529
   H          0.3285501839        2.8886520500        1.6307258304
   H          0.0238555318        1.4057305370        1.6311092027
   O         -1.8520734669       -1.1048061849        0.5987792960
   H         -2.0452742814       -0.3127714694        0.0971955096
   H         -1.3289666073       -1.6432943311        0.0049598202
   O         -0.0880581559       -0.2125391753        2.4135425408
   H         -0.7654399906       -0.5769155983        1.8437921459
   H         -0.2550320263       -0.6088460167        3.2686989324
   O          1.8345206282       -1.2424142853        0.6786740923
   H          1.2925272763       -0.9388989559        1.4069278197
   H          2.0637343054       -0.4449403058        0.2014653515
   O         -1.8718149231        1.3283948681       -0.7398985022
   H         -2.4895868984        2.0190489509       -0.9798705099
   H         -1.2605653195        1.7519384890       -0.1372239936
   O          0.0348651306        0.1614922954       -2.3882152265
   H          0.0186975359       -0.7430290689       -2.0754668446
   H         -0.7103387968        0.5783487469       -1.9556257613
    24
 Energy=    -295.382550697504
   O          0.0461281335       -2.2679673839       -1.0480357641
   H          0.7434813973       -1.9911303248       -0.4536524633
   H          0.3341835174       -3.1199834598       -1.3756400104
   O          1.9423539985        1.1156622539       -0.6764542109
   H          1.3966840455        0.8469049129       -1.4155385322
   H          1.3533955948        1.6181280217       -0.1135261596
   O          0.0356409029        2.1761153123        1.0627890986
   H          0.3281802777        2.8889577006        1.6306872265
   H          0.0242168681        1.4058861083        1.6309865157
   O         -1.8527788766       -1.1043531132        0.5988385503
   H         -2.0446901726       -0.3120031329        0.0972576462
   H         -1.3297446098       -1.6432814098        0.0053545262
   O         -0.0885314115       -0.2123972324        2.4138066182
   H         -0.7659886504       -0.5769107166        1.8442335770
   H         -0.2548139949       -0.6092233815        3.2688568799
   O          1.8341974886       -1.2422323802        0.6789229574
   H          1.2924434311       -0.9390992011        1.4075138281
   H          2.0631153477       -0.4445256774        0.2019612501
   O         -1.8713068658        1.3281767048       -0.7402495767
   H         -2.4894059869        2.0187716768       -0.9795483462
   H         -1.2597730621        1.7516340623       -0.1378028045
   O          0.0354879245        0.1614238964       -2.3883507265
   H          0.0195858108       -0.7430574894       -2.0754731378
   H         -0.7099305187        0.5780833879       -1.9559411375
    24
 Energy=    -295.378914324324
   O          0.0461522276       -2.2686074864       -1.0468965213
   H          0.7435020909       -1.9916319049       -0.4525737677
   H          0.3343129917       -3.1206003890       -1.3744683575
   O          1.9429383563        1.1141890049       -0.6776670850
   H          1.3976923346        0.8454190229       -1.4170596145
   H          1.3537224464        1.6168840537       -0.1152134074
   O          0.0374581492        2.1775750585        1.0621440134
   H          0.3326030920        2.8900553745        1.6291476308
   H          0.0249539662        1.4077449221        1.6308592730
   O         -1.8545113028       -1.1041918508        0.5979983519
   H         -2.0456637035       -0.3115972857        0.0965140997
   H         -1.3315896309       -1.6433437143        0.0046181760
   O         -0.0886179953       -0.2106917041        2.4145084290
   H         -0.7658393174       -0.5754091716        1.8447854352
   H         -0.2537955684       -0.6090374399        3.2690661415
   O          1.8319524582       -1.2429786157        0.6790266777
   H          1.2896489706       -0.9390816942        1.4068902834
   H          2.0620353472       -0.4456707355        0.2019587074
   O         -1.8713283525        1.3276548374       -0.7407919287
   H         -2.4903970895        2.0178819360       -0.9786412321
   H         -1.2591761556        1.7512391470       -0.1390628697
   O          0.0369828727        0.1615436309       -2.3868974461
   H          0.0203487007       -0.7430605464       -2.0744131637
   H         -0.7087810900        0.5783224292       -1.9551991890
    24
 Energy=    -295.375882107889
   O          0.0440059319       -2.2704787985       -1.0458973213
   H          0.7408348026       -1.9913286951       -0.4519810100
   H          0.3338821191       -3.1222934215       -1.3724175874
   O          1.9446725564        1.1129225197       -0.6761381779
   H          1.3994559287        0.8455845335       -1.4160713303
   H          1.3553761713        1.6143318369       -0.1126221558
   O          0.0405830526        2.1800950255        1.0596789897
   H          0.3463415356        2.8912955111        1.6226509778
   H          0.0251619737        1.4118776251        1.6304995010
   O         -1.8549434925       -1.1046079281        0.5984494111
   H         -2.0464747504       -0.3119461095        0.0972160738
   H         -1.3321590441       -1.6435222734        0.0047326529
   O         -0.0906574914       -0.2077209249        2.4114938811
   H         -0.7677306452       -0.5722244382        1.8414579408
   H         -0.2537678307       -0.6092391904        3.2649632359
   O          1.8308178031       -1.2439416912        0.6806296752
   H          1.2867253842       -0.9367387058        1.4057652525
   H          2.0641670510       -0.4485453106        0.2019600958
   O         -1.8706603560        1.3287351457       -0.7391002727
   H         -2.4917627501        2.0176100531       -0.9755638387
   H         -1.2580544497        1.7536706247       -0.1387872857
   O          0.0367916331        0.1594109737       -2.3871511999
   H          0.0185721275       -0.7454121937       -2.0753901932
   H         -0.7103218184        0.5762510021       -1.9578520951
    24
 Energy=    -295.372854403580
   O          0.0439142172       -2.2711800933       -1.0457112686
   H          0.7406620237       -1.9917914589       -0.4518120136
   H          0.3340431234       -3.1229252038       -1.3721884109
   O          1.9446743435        1.1124663139       -0.6762632305
   H          1.3996703101        0.8448734456       -1.4162608659
   H          1.3548621533        1.6128732726       -0.1123959624
   O          0.0414286778        2.1811507661        1.0593636701
   H          0.3514461688        2.8914807694        1.6211040743
   H          0.0250976693        1.4132036838        1.6305225070
   O         -1.8549455858       -1.1050156105        0.5982184043
   H         -2.0476187626       -0.3126105409        0.0970167557
   H         -1.3321600353       -1.6435465512        0.0041548268
   O         -0.0906229261       -0.2066862199        2.4107347520
   H         -0.7675529862       -0.5710268657        1.8404248122
   H         -0.2535709154       -0.6089157382        3.2639001565
   O          1.8304324166       -1.2444571082        0.6810913342
   H          1.2854957986       -0.9358711428        1.4050047435
   H          2.0649596303       -0.4498969228        0.2016093869
   O         -1.8709796091        1.3288945512       -0.7387357156
   H         -2.4925507212        2.0173431969       -0.9752090859
   H         -1.2584327721        1.7543577264       -0.1387362997
   O          0.0366375058        0.1592928152       -2.3864821645
   H          0.0172951273       -0.7456802253       -2.0752242194
   H         -0.7102704516        0.5766859235       -1.9573629081
    24
 Energy=    -295.366750510711
   O          0.0424243703       -2.2728482065       -1.0463682211
   H          0.7386817935       -1.9945864688       -0.4513658295
   H          0.3327756710       -3.1240189841       -1.3741429450
   O          1.9497802433        1.1109709634       -0.6770770111
   H          1.4039324399        0.8408938896       -1.4155486691
   H          1.3601851273        1.6118217240       -0.1133767762
   O          0.0446297364        2.1814187323        1.0560277726
   H          0.3532564597        2.8930626873        1.6168702346
   H          0.0267434938        1.4148414955        1.6289773885
   O         -1.8536332136       -1.1036337335        0.5994031675
   H         -2.0473463483       -0.3116742686        0.0978981649
   H         -1.3311179677       -1.6422032720        0.0051368046
   O         -0.0947713829       -0.2043201235        2.4105480380
   H         -0.7714041357       -0.5693192850        1.8403063612
   H         -0.2551768902       -0.6092596759        3.2629129083
   O          1.8249780493       -1.2451962054        0.6825646509
   H          1.2794838526       -0.9343520271        1.4050906491
   H          2.0634950169       -0.4516804944        0.2033211714
   O         -1.8721430922        1.3293736627       -0.7397848302
   H         -2.4953639616        2.0178949346       -0.9716598960
   H         -1.2570289328        1.7539115071       -0.1417597223
   O          0.0393576911        0.1588618448       -2.3830388966
   H          0.0171776468       -0.7464860420       -2.0730629467
   H         -0.7082516936        0.5771233292       -1.9559916177
    24
 Energy=    -295.360410211217
   O          0.0390710282       -2.2748309692       -1.0482919917
   H          0.7345398838       -1.9978144096       -0.4517882310
   H          0.3298207059       -3.1253504079       -1.3774016229
   O          1.9559247496        1.1098341686       -0.6769564261
   H          1.4088371537        0.8370049091       -1.4134964437
   H          1.3669717034        1.6117422097       -0.1135254476
   O          0.0469816488        2.1804218418        1.0513030137
   H          0.3523086518        2.8935805503        1.6120274717
   H          0.0275608945        1.4149844349        1.6257246796
   O         -1.8543341122       -1.1032724559        0.5981753773
   H         -2.0489395620       -0.3118563251        0.0961583788
   H         -1.3320966024       -1.6420884848        0.0038883168
   O         -0.0968059551       -0.2006809455        2.4132559739
   H         -0.7729930068       -0.5665092904        1.8430169597
   H         -0.2547270302       -0.6082517545        3.2648302864
   O          1.8205188652       -1.2449903241        0.6849164601
   H          1.2746139851       -0.9322937163        1.4063321054
   H          2.0628607301       -0.4522715556        0.2062733627
   O         -1.8723631026        1.3303318310       -0.7399793377
   H         -2.4972281411        2.0189796063       -0.9670030484
   H         -1.2544556397        1.7538659435       -0.1441261152
   O          0.0417952287        0.1580016540       -2.3801809817
   H          0.0171023071       -0.7476589328       -2.0713104569
   H         -0.7067896426        0.5769004126       -1.9554735995
    24
 Energy=    -295.355361112023
   O          0.0377015417       -2.2752835376       -1.0486318583
   H          0.7328307774       -1.9987626277       -0.4515025825
   H          0.3287453653       -3.1254261846       -1.3784542538
   O          1.9599243291        1.1089785463       -0.6772482445
   H          1.4119136152        0.8353181922       -1.4127930141
   H          1.3719605471        1.6124931550       -0.1142176326
   O          0.0484770434        2.1794070722        1.0488971532
   H          0.3468366314        2.8948358384        1.6104798067
   H          0.0284045234        1.4148696930        1.6244938261
   O         -1.8549818083       -1.1021974381        0.5981178616
   H         -2.0484157711       -0.3106423625        0.0958672228
   H         -1.3330468448       -1.6417092046        0.0041963283
   O         -0.0988935298       -0.1993638711        2.4152816583
   H         -0.7747880779       -0.5661212146        1.8452926665
   H         -0.2550046203       -0.6082912078        3.2665393166
   O          1.8167267597       -1.2448538979        0.6852744030
   H          1.2716258076       -0.9320729868        1.4072611714
   H          2.0608026691       -0.4519232589        0.2078649434
   O         -1.8723765136        1.3303357190       -0.7410344471
   H         -2.4980111430        2.0196119778       -0.9639949582
   H         -1.2521843252        1.7523218607       -0.1464579713
   O          0.0443455947        0.1577930089       -2.3786913629
   H          0.0191826302       -0.7478911598       -2.0699279395
   H         -0.7056264534        0.5763398637       -1.9560895439
    24
 Energy=    -295.351155943460
   O          0.0373594914       -2.2751109144       -1.0484687558
   H          0.7325681295       -1.9990873092       -0.4512018482
   H          0.3281788238       -3.1251535571       -1.3787466107
   O          1.9619924637        1.1084982461       -0.6774197862
   H          1.4132827208        0.8344465713       -1.4122974206
   H          1.3748901296        1.6134282785       -0.1147579412
   O          0.0490837997        2.1789297533        1.0476543454
   H          0.3432919318        2.8955800924        1.6098693457
   H          0.0290730037        1.4147117656        1.6236771534
   O         -1.8556563866       -1.1017099339        0.5978004011
   H         -2.0482933348       -0.3100335807        0.0954346002
   H         -1.3338821956       -1.6416389979        0.0041168664
   O         -0.0994165578       -0.1986733532        2.4168249447
   H         -0.7752568662       -0.5658223320        1.8470237996
   H         -0.2546352368       -0.6082004978        3.2679574370
   O          1.8144197376       -1.2450149335        0.6848946551
   H          1.2695983656       -0.9327524324        1.4073167222
   H          2.0590701233       -0.4516542470        0.2084947707
   O         -1.8723130346        1.3302079545       -0.7415212049
   H         -2.4983137159        2.0197399943       -0.9626558996
   H         -1.2512072271        1.7514786612       -0.1473912465
   O          0.0455446360        0.1576903319       -2.3779788877
   H          0.0205575439       -0.7479703863       -2.0691324068
   H         -0.7051485860        0.5758535628       -1.9562787112
    24
 Energy=    -295.341620180374
   O          0.0386594217       -2.2741145369       -1.0472401697
   H          0.7344311683       -1.9990412310       -0.4501905964
   H          0.3285060532       -3.1242710505       -1.3780795154
   O          1.9629161277        1.1084297448       -0.6776601020
   H          1.4136983842        0.8338822690       -1.4119729740
   H          1.3764884594        1.6147128154       -0.1155107604
   O          0.0492178651        2.1789422846        1.0471659118
   H          0.3417526367        2.8959533358        1.6097940305
   H          0.0298532968        1.4145895213        1.6230319612
   O         -1.8564097864       -1.1016994042        0.5971040926
   H         -2.0487865936       -0.3099985642        0.0946771985
   H         -1.3347270587       -1.6418020561        0.0034980809
   O         -0.0987218325       -0.1982187945        2.4182520638
   H         -0.7746539197       -0.5653497358        1.8485481710
   H         -0.2537104233       -0.6078859338        3.2693591145
   O          1.8121250818       -1.2460811594        0.6833693026
   H          1.2670026346       -0.9346849306        1.4059381548
   H          2.0566087016       -0.4521915838        0.2077655374
   O         -1.8723806443        1.3299902374       -0.7416457810
   H         -2.4985391900        2.0194375753       -0.9625975491
   H         -1.2513729641        1.7512447159       -0.1474017524
   O          0.0456835180        0.1576220510       -2.3776165411
   H          0.0210853714       -0.7480433996       -2.0687527155
   H         -0.7050725749        0.5755214896       -1.9557668188
    24
 Energy=    -295.338407396925
   O          0.0338966545       -2.2763528695       -1.0489443154
   H          0.7276704011       -1.9978635410       -0.4511537815
   H          0.3277406034       -3.1255912093       -1.3786135675
   O          1.9665076224        1.1079756749       -0.6763818000
   H          1.4174853512        0.8360690398       -1.4118225981
   H          1.3801474752        1.6129742936       -0.1130080227
   O          0.0505426442        2.1768391312        1.0449263967
   H          0.3315537504        2.8972884354        1.6090340089
   H          0.0271941273        1.4143650725        1.6231305100
   O         -1.8573613837       -1.1009484783        0.5982883944
   H         -2.0472195535       -0.3087840138        0.0956342622
   H         -1.3365347452       -1.6424419812        0.0051979805
   O         -0.1031607992       -0.1969952033        2.4182127443
   H         -0.7780282177       -0.5661575321        1.8485593564
   H         -0.2559774071       -0.6081833562        3.2689790032
   O          1.8120954008       -1.2435411191        0.6864239313
   H          1.2703916676       -0.9294852326        1.4104113659
   H          2.0587404601       -0.4509070957        0.2098430255
   O         -1.8706966787        1.3302211448       -0.7427699251
   H         -2.4974236071        2.0213418054       -0.9567732655
   H         -1.2451567042        1.7483187066       -0.1510554593
   O          0.0494393774        0.1572992859       -2.3783741942
   H          0.0229000830       -0.7483035097       -2.0694873502
   H         -0.7036890880        0.5753990539       -1.9609751780
    24
 Energy=    -295.325621465126
   O          0.0344502233       -2.2766262166       -1.0467200884
   H          0.7270620822       -1.9954314616       -0.4488487288
   H          0.3311282997       -3.1252163940       -1.3755189172
   O          1.9670527818        1.1083696874       -0.6758124278
   H          1.4196819298        0.8389507134       -1.4133965972
   H          1.3790365620        1.6101320276       -0.1112742809
   O          0.0514186441        2.1765086967        1.0446611008
   H          0.3272397786        2.8982114629        1.6097271668
   H          0.0239727584        1.4150663776        1.6240436670
   O         -1.8591170943       -1.1015414345        0.5981189267
   H         -2.0480740746       -0.3092395334        0.0953418419
   H         -1.3392198854       -1.6438765788        0.0049820761
   O         -0.1051438531       -0.1960903408        2.4182271922
   H         -0.7786462547       -0.5668399317        1.8479894384
   H         -0.2575254459       -0.6078825477        3.2687792885
   O          1.8108703138       -1.2437175591        0.6861538419
   H          1.2717960214       -0.9261591894        1.4105759764
   H          2.0586681967       -0.4530790231        0.2068639977
   O         -1.8696097032        1.3299636938       -0.7435815813
   H         -2.4964126688        2.0223255098       -0.9533075884
   H         -1.2409772227        1.7459761610       -0.1536776301
   O          0.0514882172        0.1574240832       -2.3795645467
   H          0.0220139951       -0.7483376827       -2.0714107969
   H         -0.7022965441        0.5767503284       -1.9645875910
    24
 Energy=    -295.321476257549
   O          0.0347384117       -2.2768654556       -1.0465244019
   H          0.7269485561       -1.9950172988       -0.4484954958
   H          0.3321746380       -3.1252899229       -1.3750658065
   O          1.9664406034        1.1088504196       -0.6755519579
   H          1.4196938585        0.8396436963       -1.4136763220
   H          1.3774692399        1.6088186205       -0.1104180172
   O          0.0514593467        2.1764144624        1.0448540609
   H          0.3294416837        2.8977480459        1.6093321577
   H          0.0228741095        1.4152911700        1.6246006073
   O         -1.8588700041       -1.1018372683        0.5979999416
   H         -2.0482791990       -0.3096167520        0.0952647723
   H         -1.3389791578       -1.6440031949        0.0047028357
   O         -0.1055846248       -0.1961960371        2.4176125768
   H         -0.7787426885       -0.5671607845        1.8471082232
   H         -0.2582655245       -0.6079241554        3.2681420233
   O          1.8113795205       -1.2436809906        0.6866101398
   H          1.2727189068       -0.9247465979        1.4107354303
   H          2.0596616432       -0.4538715542        0.2062052254
   O         -1.8696163166        1.3302883525       -0.7435126315
   H         -2.4962887163        2.0228368135       -0.9530124466
   H         -1.2405598846        1.7461554137       -0.1539581958
   O          0.0513894913        0.1573162586       -2.3798760266
   H          0.0211610943       -0.7485015161       -2.0719600590
   H         -0.7024114103        0.5770021541       -1.9652921511
    24
 Energy=    -295.270078694014
   O          0.0377451493       -2.2759717961       -1.0442535797
   H          0.7302937231       -1.9943670241       -0.4465019044
   H          0.3348280437       -3.1244259802       -1.3730378421
   O          1.9669387000        1.1103959299       -0.6761160616
   H          1.4198357505        0.8412782939       -1.4140089404
   H          1.3783690150        1.6107376119       -0.1108941874
   O          0.0529329358        2.1751616097        1.0473082727
   H          0.3309397688        2.8975044133        1.6104822376
   H          0.0247346524        1.4150015099        1.6283360858
   O         -1.8539669940       -1.1002047744        0.6034325556
   H         -2.0425479322       -0.3074424790        0.1012403487
   H         -1.3340405523       -1.6422047921        0.0100150667
   O         -0.1113196451       -0.1967985224        2.4121709970
   H         -0.7854111276       -0.5673569927        1.8425053639
   H         -0.2628238954       -0.6088738278        3.2627427134
   O          1.8087475631       -1.2462813191        0.6849533774
   H          1.2704397632       -0.9275408338        1.4094263276
   H          2.0568512333       -0.4563372475        0.2046776519
   O         -1.8714881159        1.3301856961       -0.7462306755
   H         -2.4980560610        2.0230204474       -0.9550953627
   H         -1.2422150286        1.7454911870       -0.1565116145
   O          0.0516357162        0.1576549600       -2.3797840141
   H          0.0212392568       -0.7481981917       -2.0719886880
   H         -0.7020415596        0.5774453663       -1.9650812063
    24
 Energy=    -295.210340352769
   O          0.0238685583       -2.2748995117       -1.0461599064
   H          0.7178790516       -1.9941991950       -0.4496797245
   H          0.3190754423       -3.1239017797       -1.3752189961
   O          1.9787950988        1.1028970327       -0.6762130230
   H          1.4329536692        0.8393321137       -1.4170385809
   H          1.3969294514        1.6237796356       -0.1227281340
   O          0.0551107419        2.1751593401        1.0388054550
   H          0.2651674889        2.9045363027        1.6220011765
   H          0.0383483212        1.4077662971        1.6106959854
   O         -1.8663577987       -1.0994291622        0.6059542042
   H         -2.0454605873       -0.3068668704        0.0999907225
   H         -1.3513595712       -1.6496368242        0.0158015170
   O         -0.1097730585       -0.1926526115        2.4197266405
   H         -0.7848846277       -0.5648736656        1.8523575402
   H         -0.2553528260       -0.6074958294        3.2699874686
   O          1.8060896312       -1.2409863115        0.6850119024
   H          1.2700185407       -0.9347391303        1.4164982590
   H          2.0432867654       -0.4438890704        0.2110864359
   O         -1.8616288376        1.3258804716       -0.7428186347
   H         -2.4912545799        2.0183343257       -0.9435944412
   H         -1.2301194455        1.7390745297       -0.1540076309
   O          0.0577703897        0.1579338073       -2.3838515441
   H          0.0268431340       -0.7481659986       -2.0768360938
   H         -0.6940658275        0.5784962813       -1.9665970078
    24
 Energy=    -294.906113544696
   O          0.0281953291       -2.2708657832       -1.0401243646
   H          0.7259118297       -1.9911189132       -0.4475324194
   H          0.3195568256       -3.1210925233       -1.3694491417
   O          1.9840601688        1.1022012390       -0.6805630904
   H          1.4310863437        0.8410018160       -1.4169234982
   H          1.4138995769        1.6401820270       -0.1312677133
   O          0.0570999123        2.1759696612        1.0396845034
   H          0.2487113630        2.9123501383        1.6204259990
   H          0.0409456892        1.4127774917        1.6171865324
   O         -1.8765369063       -1.0988677402        0.6024739222
   H         -2.0476790426       -0.3042097874        0.0970424756
   H         -1.3622379008       -1.6514902383        0.0139701011
   O         -0.1043615907       -0.1899201015        2.4355142723
   H         -0.7808243741       -0.5623749449        1.8699107607
   H         -0.2467586956       -0.6057851107        3.2858149242
   O          1.7938307178       -1.2461516319        0.6725756527
   H          1.2567309161       -0.9530709293        1.4086866122
   H          2.0269556911       -0.4411644381        0.2101038107
   O         -1.8633641083        1.3170066105       -0.7521097688
   H         -2.4933368569        2.0105135842       -0.9481053137
   H         -1.2313193754        1.7268212662       -0.1615141003
   O          0.0652510028        0.1635776430       -2.3785838765
   H          0.0402882294       -0.7415506678       -2.0681785914
   H         -0.6887226250        0.5810128782       -1.9620464435
    24
 Energy=    -294.683771376280
   O          0.0094658838       -2.2732377318       -1.0492745673
   H          0.7135997830       -1.9998638813       -0.4613170605
   H          0.2917493555       -3.1252431982       -1.3818923164
   O          1.9910575163        1.0902985514       -0.6751736469
   H          1.4187542654        0.8361809439       -1.3991384738
   H          1.4476228772        1.6563059422       -0.1269526454
   O          0.0389656918        2.1959548588        1.0505277089
   H          0.1202670126        2.9445103307        1.6415324811
   H          0.0255915661        1.4336229940        1.6292358397
   O         -1.8674988096       -1.0884887698        0.6120756771
   H         -2.0373536463       -0.2931569460        0.1072703043
   H         -1.3563150530       -1.6425441302        0.0222064843
   O         -0.0910942386       -0.2002459019        2.4141501191
   H         -0.7767507270       -0.5680489191        1.8566306482
   H         -0.2215165441       -0.6208351688        3.2640480723
   O          1.8050400332       -1.2622229431        0.6656376043
   H          1.2663804371       -0.9581802447        1.3961413463
   H          2.0556105283       -0.4625311003        0.2031019587
   O         -1.8543589130        1.3305369775       -0.7418413893
   H         -2.4940430760        2.0137018996       -0.9426440308
   H         -1.2316186163        1.7515688959       -0.1492551200
   O          0.0580472237        0.1577532231       -2.3784209846
   H          0.0385894164       -0.7457517252       -2.0629339926
   H         -0.6945577803        0.5746920833       -1.9589218370
    24
 Energy=    -294.291324068128
   O          0.0034005469       -2.2771444745       -1.0460610165
   H          0.7113860813       -2.0132367649       -0.4584037661
   H          0.2775009249       -3.1295804141       -1.3843712169
   O          1.9816909468        1.0822653282       -0.6747105087
   H          1.4052897673        0.8305805792       -1.3962701441
   H          1.4452524370        1.6564547701       -0.1281100605
   O          0.0419574775        2.2145203781        1.0637513191
   H          0.0253208970        2.9534007291        1.6720365245
   H          0.0407423026        1.4402618407        1.6265604169
   O         -1.8651373686       -1.0853181504        0.6118862203
   H         -2.0381329506       -0.2892264623        0.1093502586
   H         -1.3569506978       -1.6381497866        0.0182909630
   O         -0.0702962965       -0.1953639150        2.3944917136
   H         -0.7587947592       -0.5606681243        1.8388348577
   H         -0.1972985904       -0.6186662379        3.2435602626
   O          1.8093352876       -1.2838620605        0.6615445037
   H          1.2698248462       -0.9579826742        1.3819353345
   H          2.0749409879       -0.4969781934        0.1856251495
   O         -1.8523943406        1.3339846470       -0.7407379474
   H         -2.4997944586        2.0087229092       -0.9452696190
   H         -1.2383130396        1.7632984269       -0.1450654919
   O          0.0462270258        0.1614144844       -2.3713032969
   H          0.0188354754       -0.7427219760       -2.0582237482
   H         -0.6963416851        0.5865515812       -1.9422555156
    24
 Energy=    -293.472217360595
   O         -0.0173177973       -2.2881104528       -1.0559739259
   H          0.6903846733       -2.0297317471       -0.4655253697
   H          0.2540142822       -3.1402024302       -1.3973681331
   O          1.9559398617        1.0842981648       -0.6617428992
   H          1.3794012896        0.8365179040       -1.3845430496
   H          1.4188253481        1.6535280795       -0.1106375160
   O          0.0574690348        2.2211648834        1.0534958540
   H         -0.0452863703        2.9395861509        1.6776304943
   H          0.0724026333        1.4324914125        1.5957162740
   O         -1.8633306715       -1.0841202091        0.6102292530
   H         -2.0403505743       -0.2878438457        0.1093902100
   H         -1.3573663078       -1.6355140254        0.0134070332
   O         -0.0532434340       -0.1877956719        2.3791950477
   H         -0.7431235847       -0.5511791339        1.8239926726
   H         -0.1788834874       -0.6131324703        3.2274491517
   O          1.8290360173       -1.2962841225        0.6732881991
   H          1.2891557160       -0.9490683035        1.3833602203
   H          2.1064970172       -0.5227462481        0.1824864159
   O         -1.8450692452        1.3394912027       -0.7328975667
   H         -2.4985485698        2.0072429508       -0.9409942151
   H         -1.2382571673        1.7757102655       -0.1347973482
   O          0.0358126675        0.1631497889       -2.3654036305
   H         -0.0013639798       -0.7416359478       -2.0552222195
   H         -0.6962438517        0.5972800541       -1.9273899258
    24
 Energy=    -292.808295097590
   O         -0.0130400992       -2.2891654935       -1.0560631370
   H          0.6931838583       -2.0360116601       -0.4615947203
   H          0.2568349555       -3.1404676226       -1.4005685504
   O          2.0027983625        1.0489123411       -0.7014416788
   H          1.4284007600        0.8048212605       -1.4271956168
   H          1.4649672880        1.6176652349       -0.1505426671
   O          0.0203742526        2.2441520394        1.0853028133
   H         -0.1227311212        2.9355097676        1.7316596680
   H          0.0650418203        1.4389914813        1.6010092453
   O         -1.8620661186       -1.0804834072        0.6142391049
   H         -2.0444860318       -0.2855412882        0.1132183042
   H         -1.3564447467       -1.6305403456        0.0158945279
   O         -0.0556239301       -0.1714007039        2.3649719036
   H         -0.7480143301       -0.5320089834        1.8110864979
   H         -0.1789273641       -0.5991710805        3.2123446717
   O          1.8303376302       -1.3052236532        0.6769361696
   H          1.2911112491       -0.9475552076        1.3823013466
   H          2.1128015922       -0.5384698369        0.1784037882
   O         -1.8522327599        1.3518998561       -0.7106616482
   H         -2.5100661711        2.0142734712       -0.9221994394
   H         -1.2510930300        1.7936544643       -0.1108985856
   O          0.0300391097        0.1552208606       -2.3719095679
   H         -0.0140476710       -0.7510913536       -2.0671369214
   H         -0.6959142125        0.5933522680       -1.9277649024
    24
 Energy=    -292.042188120659
   O         -0.0078727891       -2.2861088364       -1.0537842995
   H          0.6985135094       -2.0349658766       -0.4586562032
   H          0.2609605369       -3.1371570281       -1.3997285988
   O          2.0304958490        1.0343235117       -0.7165969914
   H          1.4598680665        0.7892079877       -1.4449747462
   H          1.4880889819        1.5994617596       -0.1664648335
   O          0.0016848511        2.2547760620        1.0933227745
   H         -0.1560642040        2.9328903048        1.7502155734
   H          0.0575924432        1.4420995591        1.5959788029
   O         -1.8654647730       -1.0816709592        0.6125169079
   H         -2.0505735408       -0.2879463119        0.1105529965
   H         -1.3601978722       -1.6317998697        0.0139391095
   O         -0.0547542383       -0.1636012414        2.3656967369
   H         -0.7481311282       -0.5230008410        1.8122599687
   H         -0.1772497774       -0.5923733372        3.2126803098
   O          1.8263077573       -1.3110617253        0.6765398010
   H          1.2871978741       -0.9505733339        1.3805571968
   H          2.1083796864       -0.5463399833        0.1746753530
   O         -1.8537087818        1.3612450672       -0.6952238468
   H         -2.5129157719        2.0217494871       -0.9083245166
   H         -1.2543442057        1.8051971247       -0.0953067562
   O          0.0245758054        0.1475578455       -2.3802737057
   H         -0.0206931193       -0.7594275612       -2.0776848155
   H         -0.7006503679        0.5856223348       -1.9348768705
    24
 Energy=    -290.508144859897
   O          0.0194540773       -2.2712157230       -1.0345457479
   H          0.7290103334       -2.0246101191       -0.4412941693
   H          0.2834896595       -3.1224490628       -1.3837145503
   O          2.0662316703        1.0199752354       -0.7351458287
   H          1.4913762841        0.7747012285       -1.4601380953
   H          1.5326635888        1.5993721854       -0.1912376408
   O         -0.0231575163        2.2646582599        1.1053735862
   H         -0.1788028544        2.9343451208        1.7713509711
   H          0.0436250959        1.4468986323        1.5983655883
   O         -1.8718603258       -1.0836030424        0.6076189944
   H         -2.0598865674       -0.2911259620        0.1047690669
   H         -1.3669067191       -1.6336796463        0.0087288336
   O         -0.0526791398       -0.1591586755        2.3719642675
   H         -0.7459526277       -0.5180936896        1.8180966239
   H         -0.1754363495       -0.5885161899        3.2186133283
   O          1.8020700944       -1.3229737917        0.6569970788
   H          1.2633180682       -0.9605441280        1.3602913508
   H          2.0842579102       -0.5596019083        0.1531466602
   O         -1.8563642638        1.3669682872       -0.6831752608
   H         -2.5173236382        2.0252880644       -0.8976038414
   H         -1.2598295814        1.8128177771       -0.0818463616
   O          0.0171408750        0.1411769763       -2.3860665773
   H         -0.0295159571       -0.7668018934       -2.0866849609
   H         -0.7074541864        0.5787591716       -1.9391709973
    24
 Energy=    -289.997671332570
   O         -0.0216952929       -2.2857873844       -1.0632827918
   H          0.6815577694       -2.0387402594       -0.4627541177
   H          0.2473949172       -3.1359579792       -1.4111796999
   O          2.0167617499        1.0060836841       -0.7403602296
   H          1.4395686599        0.7716340150       -1.4670742927
   H          1.4847539549        1.5767770263       -0.1858256001
   O         -0.0223990960        2.2516168222        1.0914358058
   H         -0.1758671315        2.9188099047        1.7604147238
   H          0.0488685059        1.4324229454        1.5814094388
   O         -1.8641546904       -1.0936461820        0.6062461871
   H         -2.0528871183       -0.3020863905        0.1022174110
   H         -1.3603464114       -1.6449628496        0.0075317394
   O         -0.0568400184       -0.1497538474        2.3666572801
   H         -0.7525494223       -0.5071557410        1.8148564539
   H         -0.1769201449       -0.5801836508        3.2131457842
   O          1.8508054631       -1.2978577790        0.6835883584
   H          1.3106233108       -0.9357801148        1.3859663531
   H          2.1394537467       -0.5337055037        0.1846040816
   O         -1.8577184465        1.3865938825       -0.6651483487
   H         -2.5204798730        2.0417633473       -0.8836251299
   H         -1.2630142368        1.8374504612       -0.0657427361
   O          0.0558261207        0.1385976243       -2.3770041865
   H          0.0083791766       -0.7699316388       -2.0794219194
   H         -0.6679083343        0.5760973009       -1.9286356867
    24
 Energy=    -289.208766840342
   O         -0.0141091925       -2.2790961142       -1.0665052713
   H          0.6883288084       -2.0318356373       -0.4651110982
   H          0.2556151399       -3.1292347358       -1.4139890099
   O          2.0556611044        0.9861885808       -0.7720628299
   H          1.4400909344        0.7665358170       -1.4713895556
   H          1.5972720792        1.6413495025       -0.2458732174
   O         -0.0814436528        2.2537696698        1.1220052843
   H         -0.1697725007        2.9224511949        1.8011922045
   H          0.0135969497        1.4326114123        1.6046006013
   O         -1.8629004314       -1.0988957137        0.6019884415
   H         -2.0531595289       -0.3064492213        0.0999308029
   H         -1.3568475468       -1.6471681044        0.0023721445
   O         -0.0541137146       -0.1523424324        2.3675395277
   H         -0.7483209672       -0.5101645030        1.8141215155
   H         -0.1755001225       -0.5833328126        3.2135563550
   O          1.8558649494       -1.2928963709        0.6819264481
   H          1.3145982558       -0.9271903698        1.3815844554
   H          2.1479792969       -0.5310802679        0.1813894631
   O         -1.8612149376        1.3849033203       -0.6630255743
   H         -2.5304639308        2.0330842390       -0.8825685583
   H         -1.2788688098        1.8382451189       -0.0534469976
   O          0.0568185381        0.1489209512       -2.3699983868
   H          0.0090628866       -0.7610910835       -2.0770319478
   H         -0.6666135520        0.5844391976       -1.9192193855
    24
 Energy=    -288.553571178971
   O         -0.0482758011       -2.2967179418       -1.0892066575
   H          0.6474213521       -2.0339348734       -0.4865605175
   H          0.2352526179       -3.1461521725       -1.4272968281
   O          2.0675429502        0.9745216364       -0.7783512414
   H          1.4620494938        0.7404032342       -1.4817700981
   H          1.5987539231        1.6348577525       -0.2680328095
   O         -0.0809433773        2.2921882155        1.1243980637
   H         -0.1733202487        2.9494804150        1.8140830048
   H          0.0120328634        1.4632004529        1.5938302186
   O         -1.8520386656       -1.0973512415        0.6115444097
   H         -2.0347068234       -0.3003189805        0.1139464202
   H         -1.3406296629       -1.6419553973        0.0131306853
   O         -0.0485283502       -0.1773817425        2.3745906357
   H         -0.7417516347       -0.5354052874        1.8200706099
   H         -0.1713829757       -0.6081060551        3.2205310281
   O          1.8713791375       -1.2867083532        0.7042917954
   H          1.3293626384       -0.9198078566        1.4027429249
   H          2.1582763931       -0.5263154983        0.1985996846
   O         -1.8661771739        1.3670656075       -0.6903811384
   H         -2.5333789029        2.0210347345       -0.8987031818
   H         -1.2836568025        1.8072793932       -0.0714193626
   O          0.0508050450        0.1757426164       -2.3555751608
   H          0.0132771905       -0.7324529758       -2.0555680500
   H         -0.6778196569        0.6064523650       -1.9085550311
    24
 Energy=    -287.966324547543
   O         -0.0377476612       -2.2900125758       -1.0889216524
   H          0.6569446764       -2.0236910002       -0.4866698659
   H          0.2484794894       -3.1393738838       -1.4249145493
   O          2.1188364030        0.9501359268       -0.8161827318
   H          1.4865800083        0.7198024372       -1.4969397918
   H          1.7176835447        1.6870841828       -0.3555142043
   O         -0.1364914780        2.3108808953        1.1626057880
   H         -0.1694694635        2.9664492824        1.8592939408
   H         -0.0238618111        1.4784456183        1.6215152646
   O         -1.8481972783       -1.0993354281        0.6118500846
   H         -2.0304057455       -0.3002517956        0.1173834398
   H         -1.3328229008       -1.6398023668        0.0130875447
   O         -0.0460967478       -0.1908344360        2.3784614292
   H         -0.7377564130       -0.5492317300        1.8222329445
   H         -0.1704522108       -0.6220515239        3.2239313470
   O          1.8665777640       -1.2854247465        0.6991548498
   H          1.3240136604       -0.9149368603        1.3952832572
   H          2.1553919022       -0.5274828439        0.1908810006
   O         -1.8769208872        1.3573289977       -0.7006164261
   H         -2.5491510184        2.0071574795       -0.9057052726
   H         -1.3053196034        1.7943651177       -0.0693452941
   O          0.0475183609        0.1945445690       -2.3439915365
   H          0.0132264628       -0.7145206244       -2.0462393241
   H         -0.6827361861        0.6215072715       -1.8960373120
    24
 Energy=    -287.552317229595
   O         -0.0236105864       -2.2817759469       -1.0872184513
   H          0.6709791458       -2.0146988311       -0.4851829389
   H          0.2630288950       -3.1312170475       -1.4226576624
   O          2.1623818533        0.9310946714       -0.8488604047
   H          1.5030439839        0.7096166049       -1.5064719010
   H          1.8371294844        1.7353117224       -0.4442894327
   O         -0.1908852716        2.3199583041        1.1991630934
   H         -0.1590413701        2.9766897449        1.8948078451
   H         -0.0592559075        1.4860152089        1.6502112776
   O         -1.8459628116       -1.1015401371        0.6103035613
   H         -2.0292079872       -0.3012259608        0.1182159016
   H         -1.3277082098       -1.6384873903        0.0108607742
   O         -0.0448102160       -0.1992882776        2.3797695247
   H         -0.7348542087       -0.5582290764        1.8218872512
   H         -0.1705683332       -0.6309420788        3.2248090101
   O          1.8631280577       -1.2837124906        0.6924259521
   H          1.3199620017       -0.9098436537        1.3862736071
   H          2.1550375570       -0.5279703377        0.1826470956
   O         -1.8858645581        1.3504763832       -0.7056213552
   H         -2.5636235166        1.9948238068       -0.9098051744
   H         -1.3256195567        1.7866824151       -0.0636854735
   O          0.0463826438        0.2080995849       -2.3355950190
   H          0.0128534806       -0.7021652624       -2.0414427746
   H         -0.6843012352        0.6326466734       -1.8860478262
    24
 Energy=    -287.522947079193
   O         -0.0223444496       -2.2810682100       -1.0870140422
   H          0.6722585929       -2.0139256071       -0.4850229434
   H          0.2643152445       -3.1305192323       -1.4224108527
   O          2.1660876701        0.9296047260       -0.8514750773
   H          1.5047257960        0.7087426225       -1.5072587631
   H          1.8471412530        1.7389262677       -0.4520959777
   O         -0.1953153525        2.3208261420        1.2022502975
   H         -0.1580925201        2.9776046283        1.8975835419
   H         -0.0621809585        1.4867405598        1.6525927391
   O         -1.8457859857       -1.1016975739        0.6101854696
   H         -2.0291036334       -0.3012704999        0.1183084735
   H         -1.3272917226       -1.6383463851        0.0106826818
   O         -0.0446721924       -0.2000483955        2.3799036110
   H         -0.7345672589       -0.5590431632        1.8218718968
   H         -0.1705626284       -0.6317323733        3.2249079787
   O          1.8627135735       -1.2836642520        0.6918250706
   H          1.3194931757       -0.9095105980        1.3854766277
   H          2.1548298111       -0.5281140702        0.1818801065
   O         -1.8866332300        1.3497950283       -0.7061729364
   H         -2.5648360166        1.9937131459       -0.9102373336
   H         -1.3273234372        1.7858621346       -0.0633277961
   O          0.0461429949        0.2092741516       -2.3349179663
   H          0.0126877509       -0.7010880415       -2.0410587073
   H         -0.6845819000        0.6336147473       -1.8852424980
    24
 Energy=    -287.453154794758
   O         -0.0042862348       -2.2712440560       -1.0837380497
   H          0.6912878480       -2.0065424478       -0.4817898843
   H          0.2801380512       -3.1209592303       -1.4203666107
   O          2.2006542723        0.9172938863       -0.8774939201
   H          1.5129047558        0.7107597799       -1.5104047396
   H          1.9645414553        1.7813122432       -0.5399219181
   O         -0.2476469593        2.3187579499        1.2364039202
   H         -0.1416344411        2.9796032101        1.9207114008
   H         -0.0960563409        1.4853215824        1.6820898475
   O         -1.8455828129       -1.1040831712        0.6065175131
   H         -2.0316356456       -0.3034036594        0.1160804602
   H         -1.3255320098       -1.6380125926        0.0059358159
   O         -0.0446045727       -0.2026880032        2.3783031963
   H         -0.7328707202       -0.5623958756        1.8187213911
   H         -0.1717461840       -0.6347452923        3.2229293560
   O          1.8608248842       -1.2815577767        0.6834853255
   H          1.3169851922       -0.9042795667        1.3749557744
   H          2.1573220551       -0.5279054450        0.1732604431
   O         -1.8932425777        1.3464160608       -0.7051370194
   H         -2.5774260595        1.9833977540       -0.9109989288
   H         -1.3456944063        1.7844788811       -0.0535821058
   O          0.0470488436        0.2164149116       -2.3306591871
   H          0.0114788166       -0.6955025624       -2.0419151245
   H         -0.6826998488        0.6399163969       -1.8786136386
    24
 Energy=    -287.162120870281
   O          0.0443363332       -2.2446415337       -1.0759486521
   H          0.7422179768       -1.9860829622       -0.4740013815
   H          0.3231694685       -3.0950171871       -1.4155736964
   O          2.2969340183        0.8864460047       -0.9478624489
   H          1.5566080865        0.7078859234       -1.5277466201
   H          2.2879955304        1.8366762609       -0.8329085292
   O         -0.3944986171        2.3145822984        1.3343478714
   H         -0.1015166445        2.9802072005        1.9567118272
   H         -0.1954200924        1.4817932022        1.7622052102
   O         -1.8445371286       -1.1109797866        0.5964589295
   H         -2.0380627090       -0.3095224467        0.1102019790
   H         -1.3199494794       -1.6370982246       -0.0070632553
   O         -0.0442160053       -0.2109350155        2.3741252912
   H         -0.7278861061       -0.5726086753        1.8101933831
   H         -0.1748694633       -0.6440770737        3.2176592095
   O          1.8569805462       -1.2748910535        0.6613656213
   H          1.3114889372       -0.8888178332        1.3466525780
   H          2.1657426561       -0.5266800383        0.1504076227
   O         -1.9120171318        1.3368128415       -0.7028504568
   H         -2.6120698388        1.9550790147       -0.9123856242
   H         -1.3975715462        1.7770607587       -0.0262713033
   O          0.0500455909        0.2374491480       -2.3180731733
   H          0.0089293461       -0.6785866613       -2.0434467169
   H         -0.6772478166        0.6583022895       -1.8596424015
    24
 Energy=    -287.148390627625
   O          0.0477098809       -2.2427137243       -1.0759859000
   H          0.7456019396       -1.9843946595       -0.4739478820
   H          0.3263580282       -3.0931252011       -1.4156730652
   O          2.3056153830        0.8837285880       -0.9543442556
   H          1.5617160596        0.7064531392       -1.5300343214
   H          2.3165438935        1.8364807665       -0.8628254379
   O         -0.4081138224        2.3146456153        1.3434181556
   H         -0.0985789879        2.9800798188        1.9579239302
   H         -0.2050627957        1.4817644527        1.7692245548
   O         -1.8442335334       -1.1117180145        0.5956275883
   H         -2.0383472884       -0.3101362588        0.1098103604
   H         -1.3191343232       -1.6370568514       -0.0081287913
   O         -0.0441008548       -0.2120230957        2.3738557822
   H         -0.7273527801       -0.5738659639        1.8095257500
   H         -0.1750752343       -0.6452722913        3.2172849057
   O          1.8574755318       -1.2738470112        0.6600353759
   H          1.3118273858       -0.8869517271        1.3447338350
   H          2.1673757687       -0.5261529916        0.1490096073
   O         -1.9137843092        1.3359050617       -0.7027992376
   H         -2.6152219481        1.9525483217       -0.9124851187
   H         -1.4023822077        1.7759896744       -0.0238108252
   O          0.0506261502        0.2397682571       -2.3166620547
   H          0.0091583225       -0.6765993208       -2.0431977583
   H         -0.6765366507        0.6603082697       -1.8577370078
    24
 Energy=    -287.143791288743
   O          0.0493692645       -2.2416787416       -1.0765552934
   H          0.7471313340       -1.9831928079       -0.4744382314
   H          0.3281738502       -3.0921050371       -1.4160769553
   O          2.3121820284        0.8815668421       -0.9593657141
   H          1.5656202042        0.7050813986       -1.5318429371
   H          2.3382027016        1.8356076966       -0.8861481438
   O         -0.4186850645        2.3151856430        1.3502763369
   H         -0.0965054946        2.9802830782        1.9586163458
   H         -0.2127073442        1.4821383317        1.7743484957
   O         -1.8438071861       -1.1124814502        0.5950325307
   H         -2.0382526951       -0.3107315062        0.1096256792
   H         -1.3182283919       -1.6371615871       -0.0088793213
   O         -0.0438518098       -0.2132031629        2.3738506244
   H         -0.7267717547       -0.5751728750        1.8092001870
   H         -0.1750922281       -0.6465347588        3.2171960582
   O          1.8584483062       -1.2727984386        0.6595415801
   H          1.3126594114       -0.8852203125        1.3437414913
   H          2.1691571520       -0.5255483564        0.1483574960
   O         -1.9151153847        1.3351541737       -0.7029990516
   H         -2.6175916525        1.9506226170       -0.9126595592
   H         -1.4060481459        1.7749167235       -0.0220502384
   O          0.0512417981        0.2419682154       -2.3154122185
   H          0.0096640109       -0.6746091174       -2.0426685280
   H         -0.6759221899        0.6622172180       -1.8562225513
    24
 Energy=    -287.143580777597
   O          0.0497466209       -2.2414315405       -1.0767111034
   H          0.7474665045       -1.9829114113       -0.4745598378
   H          0.3285913469       -3.0918615147       -1.4161905839
   O          2.3136090801        0.8810583531       -0.9605864905
   H          1.5663474587        0.7048969619       -1.5322499172
   H          2.3434935532        1.8353211356       -0.8918747717
   O         -0.4213321145        2.3151622097        1.3519150914
   H         -0.0959575892        2.9802099673        1.9586067251
   H         -0.2146153938        1.4821027101        1.7756035471
   O         -1.8436867227       -1.1126969259        0.5948688514
   H         -2.0382277889       -0.3109147370        0.1095535568
   H         -1.3179914720       -1.6372182528       -0.0090795910
   O         -0.0438218803       -0.2134337032        2.3738042135
   H         -0.7266666974       -0.5754328572        1.8090817964
   H         -0.1751181714       -0.6467879027        3.2171293356
   O          1.8587732442       -1.2724698116        0.6594056783
   H          1.3129541183       -0.8847285375        1.3434890257
   H          2.1697293117       -0.5253206197        0.1482244490
   O         -1.9153966503        1.3350548896       -0.7029332650
   H         -2.6181398544        1.9502070186       -0.9126275359
   H         -1.4069243562        1.7747815565       -0.0215169278
   O          0.0515322421        0.2424552249       -2.3150895626
   H          0.0099030129       -0.6741727692       -2.0425240335
   H         -0.6756250946        0.6626501132       -1.8558398446
    24
 Energy=    -287.161672002035
   O          0.0520955637       -2.2395788398       -1.0792052704
   H          0.7491013983       -1.9802689049       -0.4765668513
   H          0.3317844927       -3.0900317917       -1.4179318851
   O          2.3263523454        0.8760299126       -0.9730536973
   H          1.5716472090        0.7040647952       -1.5361522638
   H          2.3970950943        1.8303657371       -0.9513641237
   O         -0.4491447338        2.3141323860        1.3682141792
   H         -0.0902254936        2.9786580618        1.9562740786
   H         -0.2348238010        1.4810878756        1.7881370548
   O         -1.8420369317       -1.1154212112        0.5930761846
   H         -2.0375305292       -0.3132897650        0.1087217315
   H         -1.3150310350       -1.6382456710       -0.0112012426
   O         -0.0436012079       -0.2157221856        2.3731750597
   H         -0.7257050404       -0.5780130538        1.8077446675
   H         -0.1754224996       -0.6493267914        3.2162895435
   O          1.8637275589       -1.2681245956        0.6585827368
   H          1.3176088866       -0.8786670149        1.3414509734
   H          2.1775825755       -0.5220115824        0.1476598071
   O         -1.9178397322        1.3347078500       -0.7015115444
   H         -2.6234035728        1.9464408015       -0.9117359551
   H         -1.4156974918        1.7741881957       -0.0152593778
   O          0.0560844500        0.2475557353       -2.3113959852
   H          0.0139030409       -0.6695192403       -2.0404235553
   H         -0.6710802335        0.6673035215       -1.8517492088
    24
 Energy=    -287.215336967804
   O          0.0514670705       -2.2385598215       -1.0870442237
   H          0.7463111712       -1.9761032684       -0.4832726829
   H          0.3342663145       -3.0889638140       -1.4233022750
   O          2.3489108724        0.8667710493       -0.9965399922
   H          1.5819732435        0.6997369476       -1.5443886230
   H          2.4921520584        1.8106735253       -1.0655466479
   O         -0.5012795596        2.3141674483        1.3980708324
   H         -0.0817658764        2.9760424494        1.9477631032
   H         -0.2738225551        1.4806918243        1.8101552113
   O         -1.8379882156       -1.1211888807        0.5900399601
   H         -2.0347538020       -0.3181131321        0.1077698220
   H         -1.3081005015       -1.6405627922       -0.0146927002
   O         -0.0426793625       -0.2214975757        2.3726953574
   H         -0.7233839985       -0.5843081708        1.8059136441
   H         -0.1755231832       -0.6555779115        3.2154044539
   O          1.8766038144       -1.2584048998        0.6600630826
   H          1.3298685937       -0.8655920902        1.3405118574
   H          2.1957618412       -0.5143726556        0.1493909632
   O         -1.9223483082        1.3339411493       -0.6995862908
   H         -2.6329851360        1.9396587570       -0.9101410789
   H         -1.4319564756        1.7718585892       -0.0039024500
   O          0.0660616527        0.2589034841       -2.3035277220
   H          0.0235643296       -0.6587935400       -2.0347192597
   H         -0.6615734483        0.6776140284       -1.8436793991
    24
 Energy=    -287.250689925325
   O          0.0509051731       -2.2374893687       -1.0949563899
   H          0.7435572741       -1.9718638437       -0.4900531022
   H          0.3368334240       -3.0878314927       -1.4287155058
   O          2.3720538440        0.8583933664       -1.0202114058
   H          1.5945995091        0.6921971522       -1.5532924649
   H          2.5830829900        1.7776258629       -1.1836438290
   O         -0.5539766994        2.3142708211        1.4287055619
   H         -0.0762802224        2.9718598532        1.9342889682
   H         -0.3140569645        1.4802194612        1.8324736758
   O         -1.8338896582       -1.1270345878        0.5869517861
   H         -2.0319773610       -0.3230206938        0.1067906046
   H         -1.3010922089       -1.6428963958       -0.0182302634
   O         -0.0417515448       -0.2273394894        2.3721970022
   H         -0.7210340488       -0.5906746098        1.8040467491
   H         -0.1756288075       -0.6619068167        3.2144914617
   O          1.8896230524       -1.2485577497        0.6615186453
   H          1.3422938167       -0.8523514036        1.3395179662
   H          2.2141642557       -0.5066520109        0.1511455249
   O         -1.9269395272        1.3331904471       -0.6976326721
   H         -2.6425819796        1.9329408934       -0.9083151879
   H         -1.4484082794        1.7689154118        0.0076214949
   O          0.0761704423        0.2703984311       -2.2955522108
   H          0.0333460797       -0.6479278705       -2.0289537906
   H         -0.6519387918        0.6880565796       -1.8354973725
    24
 Energy=    -287.257266803587
   O          0.0508948090       -2.2371862428       -1.0971937983
   H          0.7429633860       -1.9707749701       -0.4919682548
   H          0.3376122507       -3.0875175839       -1.4303027279
   O          2.3786205156        0.8564382321       -1.0266352326
   H          1.5984204703        0.6900022481       -1.5556142422
   H          2.6076668403        1.7662396592       -1.2164535257
   O         -0.5685363297        2.3141621046        1.4373376030
   H         -0.0751392455        2.9703048518        1.9295447267
   H         -0.3252688582        1.4799703710        1.8388060687
   O         -1.8328426294       -1.1285716395        0.5860722052
   H         -2.0313483435       -0.3243206104        0.1064811255
   H         -1.2992633556       -1.6434640079       -0.0192465931
   O         -0.0415423760       -0.2288868452        2.3719624276
   H         -0.7204093182       -0.5923865616        1.8034208979
   H         -0.1757184229       -0.6635817579        3.2141435015
   O          1.8932924680       -1.2457217081        0.6619224333
   H          1.3458041435       -0.8485926594        1.3392531452
   H          2.2193534172       -0.5043938349        0.1516782938
   O         -1.9281657739        1.3329075751       -0.6970578438
   H         -2.6451943434        1.9309836351       -0.9077872841
   H         -1.4529665202        1.7679603578        0.0108592315
   O          0.0787317612        0.2733546626       -2.2934117874
   H          0.0356945669       -0.6451572047       -2.0274877579
   H         -0.6494457843        0.6907898464       -1.8332627142
    24
 Energy=    -287.280945598341
   O          0.0513138381       -2.2367625764       -1.1004690431
   H          0.7426444979       -1.9695063752       -0.4947728472
   H          0.3389116491       -3.0871079460       -1.4327822861
   O          2.3881408352        0.8544111497       -1.0353535366
   H          1.6039151546        0.6880594540       -1.5583726904
   H          2.6430182451        1.7486007589       -1.2627173173
   O         -0.5890961031        2.3135705584        1.4498190669
   H         -0.0732153613        2.9675024540        1.9214884175
   H         -0.3410661948        1.4792899286        1.8481767396
   O         -1.8316241624       -1.1305442635        0.5847274147
   H         -2.0308615747       -0.3260139978        0.1059087171
   H         -1.2970123749       -1.6440796514       -0.0208330547
   O         -0.0413718828       -0.2308751866        2.3713626530
   H         -0.7195705875       -0.5946786928        1.8022182375
   H         -0.1760234804       -0.6657215866        3.2133896096
   O          1.8986788574       -1.2413672994        0.6624619491
   H          1.3509583778       -0.8429853960        1.3388686131
   H          2.2269577453       -0.5008157254        0.1525127574
   O         -1.9297522240        1.3322621239       -0.6961296855
   H         -2.6488033032        1.9278374727       -0.9070500246
   H         -1.4594650891        1.7664071355        0.0156146222
   O          0.0817106802        0.2768649614       -2.2905290746
   H          0.0379874673       -0.6419429391       -2.0257420610
   H         -0.6463725901        0.6942036252       -1.8301433328
    24
 Energy=    -287.544323702184
   O          0.0600009374       -2.2313405290       -1.1106929594
   H          0.7490902014       -1.9610309398       -0.5037987740
   H          0.3503371595       -3.0819188438       -1.4400153676
   O          2.4371921537        0.8474590595       -1.0779352275
   H          1.6356761169        0.6695857555       -1.5700378291
   H          2.8004208368        1.6330800797       -1.4867094640
   O         -0.6888252722        2.3109626475        1.5121665461
   H         -0.0731996877        2.9495063520        1.8720261258
   H         -0.4193873185        1.4758925935        1.8946492698
   O         -1.8261829720       -1.1408153977        0.5774115988
   H         -2.0291274930       -0.3349712570        0.1023741453
   H         -1.2869321866       -1.6478486491       -0.0295132009
   O         -0.0400037219       -0.2399810759        2.3689787424
   H         -0.7147446282       -0.6053622107        1.7967434974
   H         -0.1771546939       -0.6755303057        3.2102387018
   O          1.9181862261       -1.2240346262        0.6599173203
   H          1.3692869843       -0.8194407272        1.3316652188
   H          2.2563612156       -0.4874768354        0.1506510469
   O         -1.9379219386        1.3289292875       -0.6921637153
   H         -2.6665712794        1.9125942889       -0.9034387595
   H         -1.4915687276        1.7570338453        0.0384025984
   O          0.0951732804        0.2944882909       -2.2770330829
   H          0.0481850838       -0.6258556424       -2.0182068982
   H         -0.6325706685        0.7110599898       -1.8154178704
    24
 Energy=    -288.054976341838
   O          0.0833009453       -2.2201217893       -1.1089536660
   H          0.7725289714       -1.9538885992       -0.5004173428
   H          0.3708933005       -3.0709964773       -1.4399139998
   O          2.4773019994        0.8496748762       -1.0971533382
   H          1.6685743429        0.6584749948       -1.5721628360
   H          2.8804135897        1.5657165328       -1.5880883968
   O         -0.7373728624        2.3049804861        1.5507410359
   H         -0.0841458923        2.9363437240        1.8522486267
   H         -0.4555083021        1.4705287727        1.9255403791
   O         -1.8264824468       -1.1370491240        0.5767837073
   H         -2.0334616531       -0.3317890319        0.1024972620
   H         -1.2851130939       -1.6410259736       -0.0308003598
   O         -0.0436829498       -0.2417619254        2.3613341434
   H         -0.7173973530       -0.6076372685        1.7882059062
   H         -0.1812583084       -0.6778408935        3.2022503071
   O          1.9163878967       -1.2191918425        0.6498024945
   H          1.3685350635       -0.8116847499        1.3206430737
   H          2.2631681701       -0.4841868023        0.1440922288
   O         -1.9416542661        1.3236162742       -0.6894331903
   H         -2.6749163959        1.9011142967       -0.9016936975
   H         -1.5067198594        1.7495804868        0.0492266715
   O          0.0859617974        0.2910411272       -2.2754893002
   H          0.0339744451       -0.6305226320       -2.0220146607
   H         -0.6397288453        0.7088042997       -1.8117233434
    24
 Energy=    -289.166603994684
   O          0.1132138108       -2.2198814885       -1.0922276780
   H          0.8087226912       -1.9537618493       -0.4908296610
   H          0.3948522103       -3.0730603807       -1.4223752662
   O          2.4706416534        0.8793661313       -1.1049913268
   H          1.6446792924        0.7169688052       -1.5606722753
   H          2.9578337566        1.4590304005       -1.6905381050
   O         -0.7871875969        2.2834864844        1.5822726361
   H         -0.0701128078        2.8950002792        1.7498628073
   H         -0.4861601041        1.4535018509        1.9520560818
   O         -1.8224872049       -1.1530223853        0.5643012587
   H         -2.0337444365       -0.3477266256        0.0919656137
   H         -1.2793421917       -1.6531149882       -0.0449053754
   O         -0.0415553166       -0.2382144544        2.3466171952
   H         -0.7093553344       -0.6088006207        1.7696069097
   H         -0.1827060333       -0.6732393241        3.1874867914
   O          1.9142456862       -1.2041256008        0.6202030166
   H          1.3655580383       -0.7961952808        1.2901034264
   H          2.2658811806       -0.4691828699        0.1177654570
   O         -1.9416159671        1.3203291683       -0.6760802562
   H         -2.6839859002        1.8837265339       -0.8944884308
   H         -1.5336187188        1.7431369646        0.0795675802
   O          0.1024560889        0.2908907485       -2.2603623706
   H          0.0407494424       -0.6310063994       -2.0103028205
   H         -0.6226295442        0.7134658500       -1.8000223350
    24
 Energy=    -289.523261102807
   O          0.1150539878       -2.2240941892       -1.0949894665
   H          0.8125083327       -1.9510564581       -0.4989696060
   H          0.3981579641       -3.0786823195       -1.4202018679
   O          2.4687721663        0.8989148385       -1.0935892656
   H          1.6357314410        0.7468082785       -1.5398387300
   H          2.9923159527        1.3929205476       -1.7245346699
   O         -0.8022533671        2.2790029542        1.5863532162
   H         -0.0551632880        2.8707700881        1.6752346702
   H         -0.4967206988        1.4498315402        1.9542613500
   O         -1.8229130961       -1.1659775959        0.5548028369
   H         -2.0346187069       -0.3602923222        0.0833329925
   H         -1.2783735883       -1.6645200728       -0.0544294366
   O         -0.0336652979       -0.2390352291        2.3453075577
   H         -0.6988396539       -0.6124510074        1.7670899753
   H         -0.1756362976       -0.6733600482        3.1864009097
   O          1.9218165986       -1.1969764016        0.6117893666
   H          1.3709949390       -0.7916402480        1.2815131470
   H          2.2663419759       -0.4606300822        0.1064892555
   O         -1.9411175708        1.3162588814       -0.6710464104
   H         -2.6883040121        1.8720729273       -0.8924397440
   H         -1.5486206589        1.7356041377        0.0946738845
   O          0.0999022186        0.2965409515       -2.2523403727
   H          0.0407171012       -0.6255389885       -2.0023452803
   H         -0.6300210317        0.7160166702       -1.7968362453
    24
 Energy=    -290.216323472706
   O          0.1315530755       -2.2286264975       -1.0961421530
   H          0.8307679108       -1.9505316447       -0.5045394933
   H          0.4135281355       -3.0861190299       -1.4146205074
   O          2.4340483590        0.9516837939       -1.0400314815
   H          1.5966556441        0.8230759054       -1.4855259170
   H          3.0209835869        1.2783631337       -1.7219548549
   O         -0.7732914781        2.2753493328        1.5590477740
   H          0.0175500460        2.8106217672        1.4935882851
   H         -0.4727795247        1.4482569916        1.9356678278
   O         -1.8188981345       -1.1837970737        0.5512936755
   H         -2.0306424527       -0.3787779185        0.0787046959
   H         -1.2722610892       -1.6820541535       -0.0562914322
   O         -0.0248270362       -0.2529251027        2.3260572546
   H         -0.6935354280       -0.6307108248        1.7547964780
   H         -0.1568666285       -0.6862279071        3.1692927293
   O          1.9269191370       -1.1955784370        0.5951608288
   H          1.3726770766       -0.8124619546        1.2750647481
   H          2.2464672503       -0.4447891759        0.0947246902
   O         -1.9588971965        1.2997158907       -0.6656837411
   H         -2.7154607741        1.8375210394       -0.8993694597
   H         -1.5962536178        1.7212703906        0.1134268277
   O          0.0867325225        0.3123297250       -2.2333697161
   H          0.0411083988       -0.6127994986       -1.9919443674
   H         -0.6553665113        0.7149367745       -1.7823393096
    24
 Energy=    -291.858526220554
   O          0.1364757693       -2.1908788466       -1.1456878858
   H          0.8260753701       -1.9249442045       -0.5374420501
   H          0.4123559688       -3.0520177831       -1.4596332435
   O          2.2937047790        1.0657006306       -0.8397859819
   H          1.5013078570        0.9322833361       -1.3599194105
   H          2.9844149467        1.2082344244       -1.4869609366
   O         -0.5346417771        2.2470687214        1.3535972171
   H          0.3147712026        2.6218958473        1.1207151535
   H         -0.3212722862        1.4251220114        1.7953085553
   O         -1.8203830532       -1.2243399656        0.5719546846
   H         -2.0436237471       -0.4184010489        0.1062746495
   H         -1.2665140994       -1.7093980648       -0.0397475815
   O         -0.0199099468       -0.2962956153        2.3344649470
   H         -0.7079783017       -0.6820453405        1.7922556437
   H         -0.1192571211       -0.7211312433        3.1864489070
   O          1.9304289036       -1.2137674940        0.6093507696
   H          1.3679051310       -0.9227039223        1.3270420977
   H          2.1814658556       -0.4073105746        0.1589736766
   O         -2.0435744347        1.2314359106       -0.6719945839
   H         -2.8121288931        1.7451152007       -0.9203682366
   H         -1.6649071804        1.7079879725        0.0667483232
   O          0.0577039802        0.3825120559       -2.2112616743
   H          0.0593479952       -0.5526169994       -2.0069022187
   H         -0.7088302231        0.7269640378       -1.7529932078
    24
 Energy=    -293.066183736591
   O          0.1385154542       -2.1622513209       -1.1716788969
   H          0.8236580944       -1.9091680818       -0.5530026676
   H          0.4075082446       -3.0246689330       -1.4880814586
   O          2.2085455486        1.1348944160       -0.7213183376
   H          1.4498824871        0.9796635478       -1.2839599435
   H          2.9436117351        1.2219634724       -1.3282190881
   O         -0.3876353928        2.2176577399        1.2242921340
   H          0.4794333994        2.4991990184        0.9324735976
   H         -0.2261110963        1.4103262201        1.7125108951
   O         -1.8215212181       -1.2502307886        0.5832061092
   H         -2.0568469095       -0.4428045780        0.1261321838
   H         -1.2646379395       -1.7227085501       -0.0355649461
   O         -0.0245333422       -0.3209098910        2.3522075719
   H         -0.7173006679       -0.7131375733        1.8207353545
   H         -0.1144721595       -0.7376483548        3.2092209335
   O          1.9202231934       -1.2216649916        0.6216222243
   H          1.3549788965       -0.9791350310        1.3550456648
   H          2.1388841612       -0.3896914176        0.2018137044
   O         -2.0840935660        1.1895982735       -0.6757461643
   H         -2.8564775135        1.7018022358       -0.9151244813
   H         -1.6707075610        1.6924548569        0.0260223925
   O          0.0484290835        0.4245435407       -2.2125853381
   H          0.0713061427       -0.5140604749       -2.0262228367
   H         -0.7295854838        0.7414219960       -1.7537681440
    24
 Energy=    -296.133747907444
   O          0.1551026424       -2.1128912110       -1.1771670547
   H          0.8333223622       -1.8910485952       -0.5391735552
   H          0.4087998623       -2.9748330764       -1.5072061151
   O          2.0771814111        1.2672371285       -0.5708849208
   H          1.3609457923        1.0581944085       -1.1705010644
   H          2.8566537233        1.2879302211       -1.1260664681
   O         -0.2005560407        2.1527940955        1.0751198846
   H          0.6606785495        2.2870509267        0.6795419229
   H         -0.0885207327        1.3884572651        1.6403358959
   O         -1.8089444264       -1.3135302226        0.5827472056
   H         -2.0687822262       -0.5011813363        0.1482297207
   H         -1.2517671073       -1.7593466091       -0.0552441930
   O         -0.0564076113       -0.3472280008        2.3895974245
   H         -0.7415097090       -0.7530904320        1.8584264138
   H         -0.1544741797       -0.7468012427        3.2538635945
   O          1.8877776063       -1.2201991486        0.6256191074
   H          1.3169313653       -1.0248727552        1.3687301417
   H          2.0830459762       -0.3653416621        0.2417952136
   O         -2.1285569646        1.1344250516       -0.6906063292
   H         -2.8974686529        1.6746743390       -0.8726430372
   H         -1.6346608184        1.6318030508       -0.0387523864
   O          0.0703976301        0.4645360810       -2.2361305240
   H          0.0980734530       -0.4780782070       -2.0719836607
   H         -0.7171756092        0.7641833257       -1.7820691168
    24
 Energy=    -298.147588057092
   O          0.1536340450       -2.1123976564       -1.1906154141
   H          0.8274464153       -1.8959349760       -0.5461368361
   H          0.4078024870       -2.9730162224       -1.5237309000
   O          2.0462613794        1.3169865460       -0.5552193192
   H          1.3399808115        1.0856806536       -1.1584582300
   H          2.8317596193        1.3372508831       -1.1018578761
   O         -0.1845695491        2.1179084387        1.0639395573
   H          0.6631243444        2.2034826417        0.6276782152
   H         -0.0756138286        1.3739303667        1.6562714908
   O         -1.8023595980       -1.3369156862        0.5749518295
   H         -2.0753294476       -0.5218490096        0.1537801140
   H         -1.2451864930       -1.7672676000       -0.0735751178
   O         -0.0795128398       -0.3546683777        2.4037514232
   H         -0.7487781366       -0.7686540977        1.8588370939
   H         -0.2001290864       -0.7444927049        3.2696154743
   O          1.8804967893       -1.1912853725        0.6464279443
   H          1.3045324642       -0.9890596362        1.3837214326
   H          2.0850378008       -0.3393352357        0.2609726562
   O         -2.1109520731        1.1225271977       -0.6929294458
   H         -2.8689362663        1.6919756912       -0.8249151120
   H         -1.5737691638        1.5835051306       -0.0485959084
   O          0.0920681704        0.4645943941       -2.2525031143
   H          0.1086564688       -0.4773380316       -2.0830334305
   H         -0.7016591737        0.7731304087       -1.8154284399
    24
 Energy=    -299.773705297051
   O          0.1728611094       -2.1173942315       -1.1848432659
   H          0.8440107279       -1.8973889087       -0.5387877825
   H          0.4324500898       -2.9765706840       -1.5175010852
   O          2.0537049430        1.3314498283       -0.5985809954
   H          1.3496745515        1.0916604067       -1.2011372842
   H          2.8344496043        1.3827292813       -1.1499792468
   O         -0.2353944466        2.0933890925        1.1036902954
   H          0.6066117143        2.1705307709        0.6550182254
   H         -0.1206946286        1.3569633196        1.7043173617
   O         -1.7991900647       -1.3483331363        0.5606185633
   H         -2.0817469229       -0.5318352284        0.1486420732
   H         -1.2423397351       -1.7678861273       -0.0952204704
   O         -0.1030587010       -0.3551308353        2.4173355988
   H         -0.7526303578       -0.7741939615        1.8528228896
   H         -0.2534006785       -0.7381446261        3.2815864685
   O          1.8591444039       -1.1590602817        0.6485727391
   H          1.2775452474       -0.9288800032        1.3731355732
   H          2.0865890379       -0.3201780146        0.2476022659
   O         -2.0670399701        1.1346045006       -0.6820950916
   H         -2.8102091565        1.7324249389       -0.7629784892
   H         -1.4983109428        1.5454512699       -0.0309545034
   O          0.1129165261        0.4442578953       -2.2665251090
   H          0.1133518955       -0.4947791447       -2.0809420066
   H         -0.6884512458        0.7695713990       -1.8563877436
    24
 Energy=    -301.296685706279
   O          0.1902434205       -2.1085166765       -1.2009334982
   H          0.8542801725       -1.8856716182       -0.5485324620
   H          0.4552540631       -2.9676862723       -1.5293064645
   O          2.0117203932        1.3612712401       -0.5734199647
   H          1.3294650242        1.1069266936       -1.1947639138
   H          2.8094090698        1.4113986160       -1.1001189883
   O         -0.1947213612        2.0508040343        1.0456037592
   H          0.6380133232        2.0698244946        0.5739863214
   H         -0.0995416109        1.3331330628        1.6717994409
   O         -1.8005736454       -1.3590929867        0.5608850600
   H         -2.0939409739       -0.5435745166        0.1545636656
   H         -1.2410046050       -1.7683303609       -0.0991445610
   O         -0.1178385598       -0.3671629734        2.4312692243
   H         -0.7626191392       -0.7897515604        1.8638992122
   H         -0.2764691766       -0.7437083991        3.2968798237
   O          1.8426187216       -1.1350812640        0.6517627557
   H          1.2578650893       -0.9185054321        1.3779789346
   H          2.0653075006       -0.2894109027        0.2625543440
   O         -2.0489120372        1.1340925077       -0.6595356230
   H         -2.7832761639        1.7459439618       -0.7103191598
   H         -1.4506817378        1.5292998505       -0.0253719965
   O          0.1102617033        0.4507406356       -2.2588883495
   H          0.1200780708       -0.4876120307       -2.0701298990
   H         -0.7069170672        0.7648521403       -1.8718681179
    24
 Energy=    -303.334655341399
   O          0.2104757410       -2.1354634192       -1.2124921935
   H          0.8524138924       -1.8598812434       -0.5581209577
   H          0.5198103223       -2.9923959728       -1.5061085339
   O          2.0226919026        1.3512435356       -0.6039723987
   H          1.3819961447        1.1152244119       -1.2748194446
   H          2.8422492241        1.4666073159       -1.0848557888
   O         -0.1584014641        2.0173678776        1.0471260355
   H          0.6765673813        1.9771587736        0.5808191675
   H         -0.1110122746        1.3061000980        1.6859407587
   O         -1.7898636753       -1.3405014632        0.5414521445
   H         -2.0729836190       -0.5245243215        0.1288309602
   H         -1.2154292864       -1.7499009244       -0.1055788084
   O         -0.1348233988       -0.3767590833        2.4464029433
   H         -0.7841030168       -0.7885482651        1.8762297351
   H         -0.2998359105       -0.7547497353        3.3101886679
   O          1.8352633402       -1.0823481850        0.6524071859
   H          1.2507324171       -0.8848973831        1.3842327257
   H          2.0309725018       -0.2293512443        0.2646882371
   O         -2.0732150899        1.1584591062       -0.6364040876
   H         -2.7996945927        1.7805502884       -0.6746393200
   H         -1.4527803634        1.5514702541       -0.0225353494
   O          0.0776352466        0.4306544940       -2.2396832753
   H          0.0969582232       -0.5077257081       -2.0517975152
   H         -0.7520626802        0.7324178543       -1.8698562015
    24
 Energy=    -303.551626933167
   O          0.2141937966       -2.1461155409       -1.2047242853
   H          0.8536014262       -1.8555714939       -0.5543598644
   H          0.5339791089       -3.0020433280       -1.4899554499
   O          2.0224572634        1.3510350265       -0.6035866680
   H          1.3870916885        1.1130446467       -1.2787925665
   H          2.8413696217        1.4842882734       -1.0809313669
   O         -0.1551499467        2.0209203678        1.0448336579
   H          0.6770860098        1.9700004604        0.5747035527
   H         -0.1152412167        1.3071884669        1.6814072255
   O         -1.7874195295       -1.3347529576        0.5349030518
   H         -2.0643494608       -0.5193032718        0.1170711920
   H         -1.2100458853       -1.7489846699       -0.1064109146
   O         -0.1400090023       -0.3825319578        2.4463302558
   H         -0.7901521637       -0.7893199453        1.8735569648
   H         -0.3087952727       -0.7622277409        3.3086377109
   O          1.8394127434       -1.0804285303        0.6561849619
   H          1.2574640656       -0.8869864505        1.3911324009
   H          2.0234075587       -0.2265985441        0.2645829922
   O         -2.0779088964        1.1658366515       -0.6343149385
   H         -2.8030570721        1.7893956678       -0.6738891267
   H         -1.4540779311        1.5615362588       -0.0256372014
   O          0.0739207562        0.4277394014       -2.2441988425
   H          0.0906920291       -0.5121044632       -2.0635221301
   H         -0.7509274628        0.7304467636       -1.8644285060
    24
 Energy=    -304.290354953859
   O          0.2293618821       -2.1739793468       -1.1601022666
   H          0.8713010032       -1.8631571662       -0.5217171346
   H          0.5605496486       -3.0283018198       -1.4370131105
   O          1.9670235087        1.3507243212       -0.6092556881
   H          1.3470973301        1.0754686203       -1.2846501449
   H          2.7609774604        1.5810688069       -1.0917599684
   O         -0.1443079572        2.0495828190        1.0588187675
   H          0.6689611141        1.9707316332        0.5602129632
   H         -0.1190696175        1.3186152112        1.6762985020
   O         -1.8085911250       -1.3183917631        0.5182632668
   H         -2.0553739039       -0.5040249844        0.0799290908
   H         -1.2235402425       -1.7560332231       -0.1001356800
   O         -0.1542770319       -0.3820512354        2.4177522505
   H         -0.7957154778       -0.7627225589        1.8178540061
   H         -0.3632938049       -0.7673721958        3.2686762108
   O          1.8796275565       -1.0821119559        0.6704275019
   H          1.3079549553       -0.8988307294        1.4159677550
   H          2.0411011349       -0.2252715902        0.2754810357
   O         -2.0425599174        1.1884052167       -0.6370085289
   H         -2.7587953149        1.8221676671       -0.6768061656
   H         -1.4087948168        1.5799248423       -0.0359378009
   O          0.0635257316        0.3879654282       -2.2589295736
   H          0.0808166936       -0.5539251987       -2.0892978856
   H         -0.7510185202        0.6893669423       -1.8565533453
    24
 Energy=    -304.716121684606
   O          0.2210678206       -2.1804134686       -1.1428271501
   H          0.8781192070       -1.8898110950       -0.5103197778
   H          0.5305297398       -3.0383723275       -1.4332953188
   O          1.9380213060        1.3590411011       -0.6175756890
   H          1.3216728225        1.0522991699       -1.2825988274
   H          2.6971671515        1.6622291844       -1.1155781101
   O         -0.1448204256        2.0642250042        1.0899735330
   H          0.6584799906        1.9909954080        0.5746312122
   H         -0.1100079781        1.3235065954        1.6952471672
   O         -1.8254860286       -1.3032944853        0.5128379116
   H         -2.0606235238       -0.4842508834        0.0768221130
   H         -1.2392175763       -1.7431876877       -0.1028041210
   O         -0.1497274308       -0.3860893674        2.4039735640
   H         -0.7921419957       -0.7461012125        1.7924779889
   H         -0.3803218626       -0.7719479831        3.2490600547
   O          1.8908648856       -1.0839203307        0.6661827446
   H          1.3150815533       -0.8920395345        1.4063767423
   H          2.0628584138       -0.2304534149        0.2683834360
   O         -2.0083315784        1.2003789133       -0.6383658409
   H         -2.7225382069        1.8357596209       -0.6876820458
   H         -1.3831151605        1.5891015395       -0.0266216209
   O          0.0709309425        0.3469195886       -2.2712837573
   H          0.0918263543       -0.5872176682       -2.0634790239
   H         -0.7480807896        0.6599390066       -1.8872649210
    24
 Energy=    -304.894089890188
   O          0.2129529485       -2.1842462718       -1.1428551495
   H          0.8720441769       -1.8947971868       -0.5119432541
   H          0.5195544293       -3.0432937718       -1.4331390877
   O          1.9359008897        1.3645999521       -0.6210999723
   H          1.3229322183        1.0559370059       -1.2883543718
   H          2.6828171874        1.6989506560       -1.1176455302
   O         -0.1407500594        2.0583893037        1.0968114607
   H          0.6623443134        1.9867111350        0.5809301676
   H         -0.1045771564        1.3171751134        1.7013980015
   O         -1.8262148431       -1.2959380325        0.5101238924
   H         -2.0593815290       -0.4743833629        0.0777894599
   H         -1.2389942551       -1.7333257435       -0.1063952162
   O         -0.1443723971       -0.3941922227        2.4095397581
   H         -0.7925355827       -0.7470495372        1.7999431370
   H         -0.3753589843       -0.7792754054        3.2548728161
   O          1.8878583981       -1.0813427600        0.6619149256
   H          1.3076445331       -0.8861418368        1.3977683828
   H          2.0647158515       -0.2293123216        0.2631701285
   O         -2.0066192280        1.2093813052       -0.6415505661
   H         -2.7215109799        1.8434539078       -0.6973498294
   H         -1.3873863969        1.5995429925       -0.0246580320
   O          0.0748893815        0.3369761993       -2.2703679396
   H          0.0915096510       -0.5932507745       -2.0453493098
   H         -0.7421389211        0.6610195565       -1.8913000099
    24
 Energy=    -305.183429095539
   O          0.1988749302       -2.1848327426       -1.1292222987
   H          0.8619396560       -1.8870435970       -0.5064072104
   H          0.5062949398       -3.0454829591       -1.4138377983
   O          1.9379788042        1.3673864204       -0.6225413117
   H          1.3341669040        1.0546425095       -1.2962135431
   H          2.6490896129        1.7817410495       -1.1112779474
   O         -0.1360413615        2.0353720633        1.1021761918
   H          0.6657413305        1.9559707999        0.5853862982
   H         -0.1020120521        1.2988830561        1.7126332242
   O         -1.8342983608       -1.2724052586        0.5131431029
   H         -2.0645412052       -0.4525112797        0.0761145729
   H         -1.2501848643       -1.7162771217       -0.1016910474
   O         -0.1357092181       -0.4187679896        2.4169318076
   H         -0.7973941558       -0.7595924629        1.8150650768
   H         -0.3653899252       -0.7974050300        3.2655262953
   O          1.8879061969       -1.0860268609        0.6565659849
   H          1.3010905848       -0.8918188580        1.3874302192
   H          2.0743471029       -0.2326263798        0.2651847800
   O         -2.0012912174        1.2287195187       -0.6634146061
   H         -2.7151108605        1.8634089045       -0.7255655565
   H         -1.3966220548        1.6092234385       -0.0263715850
   O          0.0786932089        0.3383620399       -2.2742078396
   H          0.0830540611       -0.5890873611       -2.0374581163
   H         -0.7222767921        0.6830602391       -1.8794141606
    24
 Energy=    -305.247211852531
   O          0.1917690395       -2.1775389208       -1.1276754424
   H          0.8567358339       -1.8781186390       -0.5076766543
   H          0.4991430720       -3.0382392121       -1.4121891552
   O          1.9403015033        1.3604827791       -0.6173615238
   H          1.3393187207        1.0479073164       -1.2936367010
   H          2.6353982328        1.8062834601       -1.1014422294
   O         -0.1381234766        2.0240661346        1.1001033359
   H          0.6636817830        1.9416230082        0.5838250229
   H         -0.1049886456        1.2901543698        1.7137053604
   O         -1.8414043162       -1.2621147189        0.5197724531
   H         -2.0697125256       -0.4457655250        0.0751589185
   H         -1.2597923272       -1.7138698364       -0.0916820817
   O         -0.1338759636       -0.4242052920        2.4170985822
   H         -0.7990693650       -0.7642302111        1.8186567445
   H         -0.3634893577       -0.7972962037        3.2681642089
   O          1.8960037335       -1.0925838411        0.6599762054
   H          1.3101200475       -0.9008741255        1.3922463273
   H          2.0833605409       -0.2376683429        0.2723568590
   O         -1.9970488357        1.2338957775       -0.6732252043
   H         -2.7094230724        1.8701206344       -0.7362547083
   H         -1.3974347744        1.6081611854       -0.0277639569
   O          0.0792517686        0.3448952132       -2.2802354481
   H          0.0869291236       -0.5838915960       -2.0488743425
   H         -0.7207525310        0.6853496125       -1.8798409394
    24
 Energy=    -305.258641382725
   O          0.1917263559       -2.1672277522       -1.1197581849
   H          0.8598776742       -1.8738548307       -0.5002922982
   H          0.4942755266       -3.0279689769       -1.4092756858
   O          1.9373690862        1.3556735491       -0.6143817547
   H          1.3380422103        1.0441078922       -1.2925896706
   H          2.6162176403        1.8306383247       -1.0937615023
   O         -0.1380062918        2.0194962944        1.1021430835
   H          0.6637785517        1.9366618153        0.5858957069
   H         -0.1048112022        1.2860925699        1.7163489959
   O         -1.8497772164       -1.2566914555        0.5192896086
   H         -2.0745350121       -0.4419118129        0.0700125143
   H         -1.2699860444       -1.7143732169       -0.0894808260
   O         -0.1266855080       -0.4247501833        2.4233722899
   H         -0.7940461091       -0.7641221308        1.8269761554
   H         -0.3579528929       -0.7922181115        3.2764341625
   O          1.8968674737       -1.1032304832        0.6571051048
   H          1.3124382375       -0.9122784878        1.3907341960
   H          2.0848595209       -0.2477373388        0.2710710260
   O         -1.9986214164        1.2343264415       -0.6848654201
   H         -2.7093118720        1.8722373689       -0.7498312948
   H         -1.4027081471        1.6044460590       -0.0336122557
   O          0.0849484710        0.3484472168       -2.2846469611
   H          0.0949742533       -0.5813499659       -2.0574718684
   H         -0.7162476016        0.6849328020       -1.8832816111
    24
 Energy=    -305.351689683968
   O          0.1930955284       -2.1702907876       -1.1317805453
   H          0.8601078085       -1.8859606777       -0.5068942781
   H          0.4937714294       -3.0288190202       -1.4296985142
   O          1.9372693638        1.3573918720       -0.6015695721
   H          1.3350477990        1.0474965117       -1.2779761751
   H          2.5910486145        1.8687733381       -1.0783226815
   O         -0.1514678853        2.0208596747        1.0989094491
   H          0.6516843968        1.9396600696        0.5845313043
   H         -0.1199812195        1.2854141629        1.7107593727
   O         -1.8365711564       -1.2569047516        0.5190162797
   H         -2.0639871118       -0.4405059212        0.0740367601
   H         -1.2552659967       -1.7094629457       -0.0921361008
   O         -0.1276798417       -0.4214532030        2.4207721061
   H         -0.7919322738       -0.7634458343        1.8224063430
   H         -0.3711880895       -0.7742287739        3.2766254638
   O          1.8980985776       -1.1103682073        0.6605128421
   H          1.3199100279       -0.9122961887        1.3971927701
   H          2.0914186477       -0.2575857351        0.2711271134
   O         -2.0037122630        1.2312645468       -0.6872317730
   H         -2.7100372469        1.8727863605       -0.7633016074
   H         -1.4066525687        1.6072553291       -0.0404068407
   O          0.0909171794        0.3519562911       -2.2787650173
   H          0.0955019660       -0.5776198019       -2.0505127288
   H         -0.7186382273        0.6892521652       -1.8952505108
    24
 Energy=    -305.363752138699
   O          0.1950781041       -2.1706162785       -1.1352203350
   H          0.8603404021       -1.8840146611       -0.5095068001
   H          0.4988633842       -3.0282736268       -1.4324916194
   O          1.9415888698        1.3577877431       -0.5982019258
   H          1.3386518607        1.0481373202       -1.2740831423
   H          2.5914019742        1.8744306057       -1.0747047295
   O         -0.1519266395        2.0200873798        1.0964090949
   H          0.6525999133        1.9375597729        0.5843953647
   H         -0.1226982357        1.2854918313        1.7093910853
   O         -1.8345626668       -1.2599389812        0.5165508813
   H         -2.0662144303       -0.4447878303        0.0714689769
   H         -1.2536017160       -1.7110898047       -0.0959678107
   O         -0.1287833815       -0.4196949440        2.4213340118
   H         -0.7905346256       -0.7644604840        1.8217893068
   H         -0.3767132716       -0.7673059361        3.2780306955
   O          1.8972428649       -1.1113048280        0.6607559598
   H          1.3202866570       -0.9130470170        1.3983515228
   H          2.0932564120       -0.2582373570        0.2733460746
   O         -2.0085242256        1.2305161916       -0.6868919477
   H         -2.7131834425        1.8738075223       -0.7634653889
   H         -1.4102895895        1.6056500440       -0.0406553402
   O          0.0901510978        0.3550644971       -2.2749498024
   H          0.0935940361       -0.5755136432       -2.0507973743
   H         -0.7199836992        0.6912407879       -1.8916758113
    24
 Energy=    -305.373298324139
   O          0.1990987415       -2.1710879489       -1.1389972665
   H          0.8619321504       -1.8826655721       -0.5115450814
   H          0.5064365696       -3.0275419976       -1.4360860779
   O          1.9476446996        1.3590518543       -0.5958066587
   H          1.3437135666        1.0496073740       -1.2708941643
   H          2.5939857019        1.8798762670       -1.0724795863
   O         -0.1528959101        2.0180222780        1.0904323888
   H          0.6528732251        1.9340884525        0.5806058952
   H         -0.1253330102        1.2849104522        1.7052650307
   O         -1.8316630863       -1.2647805057        0.5145099966
   H         -2.0694033039       -0.4514662226        0.0692782526
   H         -1.2510231506       -1.7138216326       -0.0998605524
   O         -0.1329017835       -0.4178634218        2.4212314820
   H         -0.7917399501       -0.7663727472        1.8206439693
   H         -0.3860675859       -0.7585981027        3.2791585149
   O          1.8937278025       -1.1116984580        0.6601424989
   H          1.3177387423       -0.9139730978        1.3986363204
   H          2.0937476351       -0.2578666684        0.2764822564
   O         -2.0129412003        1.2294509861       -0.6835774509
   H         -2.7152161003        1.8753388687       -0.7601976041
   H         -1.4125640835        1.6031101422       -0.0384743640
   O          0.0903834823        0.3604390469       -2.2682671926
   H          0.0949112950       -0.5716855776       -2.0506550987
   H         -0.7212356329        0.6925187665       -1.8845624732
    24
 Energy=    -305.380923530877
   O          0.1997555289       -2.1715419212       -1.1429835703
   H          0.8610201408       -1.8827916088       -0.5140287149
   H          0.5087862855       -3.0273300918       -1.4402350438
   O          1.9515999569        1.3611086269       -0.5944710747
   H          1.3469718108        1.0517200938       -1.2689600520
   H          2.5972589934        1.8822472084       -1.0717244953
   O         -0.1503940123        2.0178039461        1.0890385244
   H          0.6556691747        1.9339336880        0.5796665989
   H         -0.1224880241        1.2854530628        1.7047619036
   O         -1.8311126910       -1.2686904294        0.5132351436
   H         -2.0712641419       -0.4558162691        0.0684939602
   H         -1.2500717028       -1.7161762493       -0.1018905762
   O         -0.1350707299       -0.4163601307        2.4218525603
   H         -0.7927187387       -0.7667899565        1.8210781654
   H         -0.3906291128       -0.7533641881        3.2805434350
   O          1.8920162232       -1.1103340742        0.6612674580
   H          1.3158727186       -0.9131778068        1.3997929542
   H          2.0940417523       -0.2560113278        0.2797570772
   O         -2.0174285569        1.2262916373       -0.6836065710
   H         -2.7181786339        1.8738915849       -0.7597346045
   H         -1.4153413333        1.5988003289       -0.0394326117
   O          0.0909518818        0.3632057119       -2.2647554033
   H          0.0977686848       -0.5698341617       -2.0511624130
   H         -0.7217794862        0.6915118265       -1.8801586553
    24
 Energy=    -305.391685955787
   O          0.2017046999       -2.1674822521       -1.1489798112
   H          0.8616369669       -1.8814766574       -0.5173770541
   H          0.5101564474       -3.0230158686       -1.4475624473
   O          1.9542629554        1.3664049840       -0.5949384854
   H          1.3482157979        1.0584175735       -1.2687948780
   H          2.6033687395        1.8820348785       -1.0734981296
   O         -0.1517331669        2.0169107975        1.0868150660
   H          0.6560705272        1.9395275596        0.5791765466
   H         -0.1199899641        1.2839135516        1.7015827022
   O         -1.8318138792       -1.2783228430        0.5145925298
   H         -2.0705342292       -0.4633124824        0.0730016030
   H         -1.2480467899       -1.7224142693       -0.1004120479
   O         -0.1391211237       -0.4172802906        2.4198597284
   H         -0.7978863440       -0.7691674191        1.8211647533
   H         -0.3956281987       -0.7485429715        3.2804996047
   O          1.8897744718       -1.1057747916        0.6621664328
   H          1.3102456391       -0.9089198099        1.3981190727
   H          2.0932073733       -0.2513306548        0.2816771273
   O         -2.0176590820        1.2165890901       -0.6766630328
   H         -2.7161519856        1.8662846208       -0.7556264477
   H         -1.4117372491        1.5920877111       -0.0378427467
   O          0.0940620463        0.3700789035       -2.2630365579
   H          0.1067441743       -0.5636775603       -2.0528702670
   H         -0.7213016538        0.6916142323       -1.8782913060
    24
 Energy=    -305.394248287005
   O          0.2024310207       -2.1670870614       -1.1481229523
   H          0.8625074370       -1.8808355877       -0.5167822689
   H          0.5109120169       -3.0226530167       -1.4465826837
   O          1.9542390323        1.3662676771       -0.5944071496
   H          1.3481990163        1.0583260135       -1.2682908717
   H          2.6030914932        1.8823097489       -1.0728660341
   O         -0.1516217645        2.0171084824        1.0873354729
   H          0.6562734628        1.9393703917        0.5798968748
   H         -0.1203588169        1.2840899013        1.7021022807
   O         -1.8318469906       -1.2782303380        0.5141162527
   H         -2.0707511419       -0.4632917453        0.0724922762
   H         -1.2482473672       -1.7223703539       -0.1010121614
   O         -0.1385855759       -0.4172310771        2.4199248081
   H         -0.7971222180       -0.7692577156        1.8210604020
   H         -0.3953637656       -0.7483757839        3.2805292378
   O          1.8898241993       -1.1064193604        0.6614986891
   H          1.3104619367       -0.9095024503        1.3975659002
   H          2.0930936296       -0.2520150321        0.2808326644
   O         -2.0183710391        1.2168726774       -0.6772615097
   H         -2.7168789193        1.8665539497       -0.7562097571
   H         -1.4126201302        1.5922249659       -0.0381931754
   O          0.0934938145        0.3697988732       -2.2632724100
   H          0.1053711765       -0.5639429986       -2.0529942960
   H         -0.7215709565        0.6920917439       -1.8785276056
    24
 Energy=    -305.397324280983
   O          0.2051241730       -2.1648950228       -1.1488749977
   H          0.8648563522       -1.8779249383       -0.5175007328
   H          0.5142141799       -3.0204157782       -1.4468337945
   O          1.9548162931        1.3673308588       -0.5925947408
   H          1.3481803724        1.0603834809       -1.2663959036
   H          2.6040500791        1.8828959041       -1.0710506062
   O         -0.1529711429        2.0169620892        1.0876509630
   H          0.6560722848        1.9401101813        0.5819095703
   H         -0.1225203262        1.2835789507        1.7020236185
   O         -1.8317386935       -1.2818612445        0.5127643576
   H         -2.0715722069       -0.4665453516        0.0723421504
   H         -1.2475778229       -1.7243958003       -0.1029880960
   O         -0.1383774821       -0.4180678613        2.4181375792
   H         -0.7962393580       -0.7717165599        1.8194872721
   H         -0.3971447474       -0.7454135826        3.2795991982
   O          1.8917185353       -1.1062178414        0.6607925332
   H          1.3116948009       -0.9094681914        1.3963833724
   H          2.0947796555       -0.2517826763        0.2800845480
   O         -2.0213096490        1.2148541607       -0.6757079301
   H         -2.7187169177        1.8655672144       -0.7558793921
   H         -1.4147340678        1.5905505201       -0.0376247460
   O          0.0923629837        0.3725723292       -2.2623397280
   H          0.1034421169       -0.5613552007       -2.0528439961
   H         -0.7227846766        0.6950923432       -1.8779610444
    24
 Energy=    -305.400439592718
   O          0.2084539415       -2.1627111819       -1.1491614044
   H          0.8683290807       -1.8759761542       -0.5178297447
   H          0.5173317679       -3.0182456418       -1.4473008287
   O          1.9548538379        1.3685649422       -0.5911282602
   H          1.3475624250        1.0627052291       -1.2648335486
   H          2.6051594842        1.8826337172       -1.0697384367
   O         -0.1550181291        2.0159053344        1.0873779010
   H          0.6542285492        1.9396844565        0.5818662480
   H         -0.1248268509        1.2817403929        1.7008289304
   O         -1.8317406229       -1.2852124506        0.5108508115
   H         -2.0733312282       -0.4697187484        0.0717200324
   H         -1.2466545636       -1.7255265801       -0.1056146057
   O         -0.1381973160       -0.4197504922        2.4154155311
   H         -0.7956633344       -0.7752784611        1.8174438445
   H         -0.3990147936       -0.7422508134        3.2780855875
   O          1.8951307720       -1.1057571962        0.6603280744
   H          1.3142257958       -0.9102463447        1.3955537239
   H          2.0966308842       -0.2508879235        0.2797652395
   O         -2.0245928661        1.2140625479       -0.6736931787
   H         -2.7206425746        1.8660895697       -0.7549791309
   H         -1.4175406688        1.5893144234       -0.0358017305
   O          0.0908894132        0.3753806123       -2.2600985860
   H          0.1026281362       -0.5586701057       -2.0511888001
   H         -0.7248865968        0.6969191291       -1.8762309997
    24
 Energy=    -305.403787588155
   O          0.2115734989       -2.1608925013       -1.1497068756
   H          0.8719085545       -1.8750515665       -0.5184506564
   H          0.5197456232       -3.0164249603       -1.4485814200
   O          1.9541863090        1.3698716044       -0.5898437505
   H          1.3462236435        1.0649888191       -1.2633864178
   H          2.6062747052        1.8812808692       -1.0688772853
   O         -0.1567731592        2.0143788833        1.0879315179
   H          0.6520659973        1.9394004577        0.5815825330
   H         -0.1262232655        1.2785453634        1.6993622785
   O         -1.8319497356       -1.2880203550        0.5086349251
   H         -2.0757588668       -0.4724528142        0.0708695382
   H         -1.2451499833       -1.7254040488       -0.1082875944
   O         -0.1374822614       -0.4222221158        2.4123631502
   H         -0.7950988662       -0.7795625286        1.8156386991
   H         -0.4002835847       -0.7389056851        3.2765846620
   O          1.9004923149       -1.1045043996        0.6605720288
   H          1.3184518464       -0.9113633401        1.3955259485
   H          2.0990172106       -0.2487848537        0.2803566101
   O         -2.0288782031        1.2135474721       -0.6725080737
   H         -2.7233608249        1.8670809710       -0.7550895110
   H         -1.4217654023        1.5878693283       -0.0341280653
   O          0.0887839334        0.3782694761       -2.2574675956
   H          0.1025670440       -0.5558470137       -2.0489771897
   H         -0.7278569791        0.6977819739       -1.8737473539
    24
 Energy=    -305.405279339571
   O          0.2133107770       -2.1592788426       -1.1495094376
   H          0.8741047063       -1.8740719864       -0.5184466260
   H          0.5209738976       -3.0147620770       -1.4490485500
   O          1.9529675016        1.3706988015       -0.5901591000
   H          1.3447740130        1.0661501021       -1.2636445193
   H          2.6061925877        1.8804046699       -1.0694593761
   O         -0.1578753344        2.0133233607        1.0888802998
   H          0.6509512712        1.9402241614        0.5822365697
   H         -0.1266482667        1.2760310006        1.6985168193
   O         -1.8315897984       -1.2891573415        0.5084892911
   H         -2.0761771216       -0.4735891292        0.0711594698
   H         -1.2434236933       -1.7250932694       -0.1081567497
   O         -0.1371437215       -0.4238815853        2.4110252760
   H         -0.7954580885       -0.7814946311        1.8152342525
   H         -0.4005979831       -0.7377390084        3.2760785749
   O          1.9022818674       -1.1038849398        0.6602558993
   H          1.3196334398       -0.9121559578        1.3950978192
   H          2.0991755026       -0.2476457917        0.2803621540
   O         -2.0302354302        1.2129664373       -0.6719812256
   H         -2.7240316812        1.8670670636       -0.7558321215
   H         -1.4232736874        1.5874143392       -0.0335315004
   O          0.0882212472        0.3795868551       -2.2569517719
   H          0.1033603395       -0.5545952984       -2.0488499894
   H         -0.7285489766        0.6978918857       -1.8725039224
    24
 Energy=    -305.406789772248
   O          0.2141545514       -2.1579866200       -1.1497853089
   H          0.8754176043       -1.8733366963       -0.5189624845
   H          0.5214134326       -3.0133616321       -1.4500475418
   O          1.9519691068        1.3720506383       -0.5902290756
   H          1.3436151682        1.0674437933       -1.2635432633
   H          2.6064999880        1.8795874166       -1.0700494422
   O         -0.1593252642        2.0119686530        1.0900506131
   H          0.6493235945        1.9413174377        0.5827762602
   H         -0.1269553694        1.2728681666        1.6974339359
   O         -1.8318854239       -1.2901669389        0.5081700810
   H         -2.0770660525       -0.4747018678        0.0709801714
   H         -1.2420071923       -1.7247459827       -0.1077979106
   O         -0.1358847814       -0.4255685393        2.4108402935
   H         -0.7951686898       -0.7829973011        1.8160115381
   H         -0.3999509804       -0.7367270268        3.2766816636
   O          1.9043291701       -1.1026081931        0.6602571319
   H          1.3210600058       -0.9124810945        1.3950228146
   H          2.0993122799       -0.2457872552        0.2806898687
   O         -2.0303671389        1.2121336150       -0.6713184604
   H         -2.7235869583        1.8666419350       -0.7567408290
   H         -1.4238187212        1.5869331919       -0.0326823088
   O          0.0868829444        0.3805290696       -2.2578336991
   H          0.1038744605       -0.5536614791       -2.0499126873
   H         -0.7299331978        0.6973814388       -1.8722849913
    24
 Energy=    -305.408901179165
   O          0.2137709563       -2.1569972275       -1.1494551352
   H          0.8753496593       -1.8712447021       -0.5194623146
   H          0.5216574232       -3.0122242295       -1.4494960301
   O          1.9491491230        1.3746514816       -0.5921777407
   H          1.3415533752        1.0692711252       -1.2658260801
   H          2.6048271956        1.8807248716       -1.0719775209
   O         -0.1596370564        2.0112560342        1.0932674685
   H          0.6484639929        1.9417254924        0.5849663394
   H         -0.1256467393        1.2719881757        1.7003585093
   O         -1.8316122634       -1.2910175468        0.5100219654
   H         -2.0758678035       -0.4757450864        0.0719558900
   H         -1.2413886419       -1.7264319564       -0.1050245439
   O         -0.1349652439       -0.4275486258        2.4118029916
   H         -0.7948613174       -0.7832150213        1.8165967859
   H         -0.4001006861       -0.7383795030        3.2774352479
   O          1.9038269139       -1.1005526336        0.6586690937
   H          1.3210469371       -0.9109087223        1.3939476297
   H          2.0982006388       -0.2435219608        0.2792628195
   O         -2.0275535218        1.2108045165       -0.6707946161
   H         -2.7209474777        1.8650233000       -0.7570178450
   H         -1.4222518489        1.5855516066       -0.0309459283
   O          0.0866893721        0.3796900405       -2.2612606272
   H          0.1041892311       -0.5542702300       -2.0523496223
   H         -0.7289164152        0.6970802154       -1.8735977366
    24
 Energy=    -305.410295232358
   O          0.2148837824       -2.1573234003       -1.1493950263
   H          0.8764501925       -1.8705147208       -0.5198694061
   H          0.5236347466       -3.0123086848       -1.4492363932
   O          1.9454919317        1.3768846308       -0.5932443574
   H          1.3389568370        1.0707753996       -1.2675174159
   H          2.6027862248        1.8811420117       -1.0727446660
   O         -0.1604180705        2.0105964775        1.0961578705
   H          0.6469538875        1.9415598840        0.5866322967
   H         -0.1251280644        1.2712616704        1.7030932035
   O         -1.8310369001       -1.2917346133        0.5098961916
   H         -2.0753151613       -0.4763141036        0.0721184358
   H         -1.2412843260       -1.7272002193       -0.1055657872
   O         -0.1333797666       -0.4300619635        2.4122759666
   H         -0.7930657894       -0.7848423956        1.8163086551
   H         -0.4012272832       -0.7386097258        3.2778900990
   O          1.9056752149       -1.0978793953        0.6565823271
   H          1.3236487823       -0.9098716802        1.3928772211
   H          2.0977007886       -0.2402249638        0.2773899022
   O         -2.0270182925        1.2102301891       -0.6700573976
   H         -2.7202373213        1.8644905586       -0.7573648259
   H         -1.4230944672        1.5845953780       -0.0286849952
   O          0.0854862066        0.3794644621       -2.2622297422
   H          0.1035673305       -0.5541508890       -2.0518318117
   H         -0.7292920693        0.6973902872       -1.8732678278
    24
 Energy=    -305.411305797140
   O          0.2153663748       -2.1583816029       -1.1508728224
   H          0.8768489202       -1.8713415045       -0.5213645509
   H          0.5249583327       -3.0127802224       -1.4515182260
   O          1.9436037439        1.3788106203       -0.5913217556
   H          1.3381771260        1.0716184866       -1.2660983433
   H          2.6007213522        1.8837503977       -1.0703458783
   O         -0.1636674248        2.0095409044        1.0972025109
   H          0.6436664584        1.9420078702        0.5874151726
   H         -0.1270294794        1.2699986515        1.7038051462
   O         -1.8282459393       -1.2902828476        0.5102555262
   H         -2.0734722873       -0.4754277554        0.0719553357
   H         -1.2401601388       -1.7267402715       -0.1060981453
   O         -0.1309107461       -0.4307522612        2.4138232738
   H         -0.7901788423       -0.7848918587        1.8170129499
   H         -0.4022695784       -0.7358914858        3.2795520291
   O          1.9061106823       -1.0980127453        0.6547326756
   H          1.3260968416       -0.9116734510        1.3930371196
   H          2.0966184836       -0.2395557958        0.2765921149
   O         -2.0279909352        1.2103080434       -0.6716131250
   H         -2.7217700589        1.8639880623       -0.7588186318
   H         -1.4248814535        1.5846618164       -0.0294682460
   O          0.0856639906        0.3788189190       -2.2621522627
   H          0.1035500405       -0.5549160878       -2.0522692801
   H         -0.7297516552        0.6964086678       -1.8742528994
    24
 Energy=    -305.411346487458
   O          0.2155993765       -2.1581616805       -1.1507735680
   H          0.8770298139       -1.8712134697       -0.5211686594
   H          0.5251895725       -3.0125396520       -1.4514794580
   O          1.9437540524        1.3786359328       -0.5912765882
   H          1.3383667096        1.0714561928       -1.2660940543
   H          2.6005157553        1.8841611066       -1.0701713618
   O         -0.1633934818        2.0094381354        1.0972649785
   H          0.6439079406        1.9418501725        0.5874335155
   H         -0.1269524926        1.2696748330        1.7036098892
   O         -1.8285826333       -1.2903355397        0.5097541653
   H         -2.0735070784       -0.4753098014        0.0716024768
   H         -1.2401586212       -1.7266038940       -0.1064105408
   O         -0.1314870983       -0.4309341471        2.4135931408
   H         -0.7907345112       -0.7850789610        1.8167630650
   H         -0.4034354364       -0.7352263275        3.2794350492
   O          1.9061751556       -1.0980727686        0.6551809980
   H          1.3258720873       -0.9117789071        1.3932696011
   H          2.0967325384       -0.2396035661        0.2770932407
   O         -2.0278663276        1.2104598970       -0.6715429905
   H         -2.7222698070        1.8636046745       -0.7577842063
   H         -1.4246620247        1.5848362346       -0.0295003385
   O          0.0858009545        0.3789701806       -2.2622001387
   H          0.1037269917       -0.5547614619       -2.0523056008
   H         -0.7296214058        0.6965326689       -1.8742925721
    24
 Energy=    -305.411346487455
   O          0.2155993301       -2.1581617809       -1.1507735979
   H          0.8770297449       -1.8712135386       -0.5211686800
   H          0.5251899241       -3.0125394300       -1.4514799946
   O         -0.1314870927       -0.4309341272        2.4135931246
   H         -0.7907345346       -0.7850789411        1.8167630808
   H         -0.4034353284       -0.7352263983        3.2794350333
   O         -0.1633934753        2.0094381720        1.0972649803
   H         -0.1269524764        1.2696748698        1.7036098906
   H          0.6439079496        1.9418502218        0.5874335194
   O          0.0858010186        0.3789701071       -2.2622000448
   H         -0.7296213573        0.6965326395       -1.8742925471
   H          0.1037269937       -0.5547615338       -2.0523054945
   O          1.9437540876        1.3786360281       -0.5912765601
   H          1.3383667643        1.0714562241       -1.2660940146
   H          2.6005157226        1.8841612793       -1.0701713452
   O          1.9061750831       -1.0980727384        0.6551809155
   H          2.0967325170       -0.2396035296        0.2770931983
   H          1.3258720162       -0.9117788779        1.3932695200
   O         -2.0278663060        1.2104598842       -0.6715429798
   H         -2.7222698684        1.8636045865       -0.7577840969
   H         -1.4246620029        1.5848362430       -0.0295003405
   O         -1.8285826657       -1.2903355463        0.5097541824
   H         -1.2401587120       -1.7266039905       -0.1064105158
   H         -2.0735070292       -0.4753097993        0.0716024644
    24
 Energy=    -305.410347808516
   O          0.2173145083       -2.1573818000       -1.1520185203
   H          0.8775374229       -1.8698947404       -0.5213928520
   H          0.5259650744       -3.0133254453       -1.4492173497
   O         -0.1334321851       -0.4316894468        2.4143379220
   H         -0.7919299423       -0.7860164256        1.8167888146
   H         -0.4035872611       -0.7400243231        3.2793105683
   O         -0.1620209957        2.0095601579        1.0995162381
   H         -0.1267053157        1.2693973162        1.7054400044
   H          0.6443271752        1.9400084054        0.5884418589
   O          0.0847658442        0.3797138422       -2.2646346770
   H         -0.7301923445        0.6962088413       -1.8748835946
   H          0.1041560029       -0.5540899326       -2.0551916728
   O          1.9422359731        1.3777268164       -0.5918633245
   H          1.3371681306        1.0716345478       -1.2674610370
   H          2.5993398284        1.8838485122       -1.0696574144
   O          1.9050421028       -1.0975209570        0.6565897737
   H          2.0949543382       -0.2392249793        0.2777848138
   H          1.3244246312       -0.9110664224        1.3943904908
   O         -2.0258994894        1.2111315104       -0.6701459988
   H         -2.7207853302        1.8639154929       -0.7552258458
   H         -1.4227876698        1.5849718018       -0.0277042430
   O         -1.8280214749       -1.2911530993        0.5079849690
   H         -1.2390923538       -1.7268446886       -0.1081052591
   H         -2.0725409183       -0.4756903423        0.0704206037
    24
 Energy=    -305.409264770658
   O          0.2175450334       -2.1570242559       -1.1518058316
   H          0.8778275870       -1.8687861409       -0.5215855698
   H          0.5262926592       -3.0132138921       -1.4481941757
   O         -0.1338867124       -0.4326935904        2.4146632480
   H         -0.7918613782       -0.7867406446        1.8163724636
   H         -0.4042926121       -0.7421859869        3.2791439857
   O         -0.1614989290        2.0094627196        1.1003656086
   H         -0.1265060371        1.2694812630        1.7065295975
   H          0.6445875244        1.9391150094        0.5889874028
   O          0.0847050768        0.3798903063       -2.2655485436
   H         -0.7305213172        0.6955845491       -1.8757089466
   H          0.1048288728       -0.5539796388       -2.0564700930
   O          1.9411855064        1.3773849627       -0.5927148881
   H          1.3359801339        1.0712840857       -1.2681855021
   H          2.5982662857        1.8833891194       -1.0706651814
   O          1.9048463371       -1.0972607487        0.6568074791
   H          2.0952859050       -0.2390103612        0.2781640012
   H          1.3238529471       -0.9106436879        1.3942711008
   O         -2.0255586681        1.2112221653       -0.6700696215
   H         -2.7208456703        1.8635533181       -0.7553450089
   H         -1.4225491290        1.5857375605       -0.0279251249
   O         -1.8273479989       -1.2905667498        0.5081477666
   H         -1.2387519675       -1.7258233681       -0.1085679118
   H         -2.0714281286       -0.4743981286        0.0716554847
    24
 Energy=    -305.408096423520
   O          0.2183494651       -2.1566032024       -1.1537199836
   H          0.8781685992       -1.8684716680       -0.5229658562
   H          0.5258056864       -3.0140326914       -1.4478580181
   O         -0.1325056434       -0.4328544888        2.4155292416
   H         -0.7902623522       -0.7863806724        1.8166910419
   H         -0.4029097871       -0.7435693763        3.2795718897
   O         -0.1623728125        2.0100914699        1.1012607469
   H         -0.1267863104        1.2703759842        1.7077147362
   H          0.6433026902        1.9396275717        0.5892513101
   O          0.0834387808        0.3799841916       -2.2668172415
   H         -0.7315161836        0.6957084516       -1.8764348166
   H          0.1035747740       -0.5539248398       -2.0579146260
   O          1.9401565886        1.3779440424       -0.5921154324
   H          1.3351937088        1.0713392385       -1.2675747193
   H          2.5968216669        1.8844729337       -1.0700812233
   O          1.9047935841       -1.0976217330        0.6573132788
   H          2.0954097702       -0.2392951907        0.2789313865
   H          1.3235583127       -0.9111414869        1.3946208924
   O         -2.0253077693        1.2108168601       -0.6686721814
   H         -2.7213013748        1.8623105272       -0.7545834312
   H         -1.4228314442        1.5865007948       -0.0267098003
   O         -1.8264409503       -1.2913641038        0.5069582530
   H         -1.2374648970       -1.7253440389       -0.1102940978
   H         -2.0705427487       -0.4744641146        0.0718484282
    24
 Energy=    -305.405831884277
   O          0.2210563677       -2.1555601728       -1.1554938361
   H          0.8797061975       -1.8693626810       -0.5226405850
   H          0.5266806135       -3.0140998128       -1.4482998248
   O         -0.1327885657       -0.4323089657        2.4163477397
   H         -0.7903275521       -0.7855696516        1.8171138879
   H         -0.4029820011       -0.7441856390        3.2800376656
   O         -0.1633105173        2.0116962196        1.1032130987
   H         -0.1269686541        1.2724123483        1.7101484055
   H          0.6415544069        1.9406605675        0.5900092115
   O          0.0821365632        0.3803114949       -2.2688777531
   H         -0.7316755385        0.6971476387       -1.8770148164
   H          0.1018900458       -0.5534132529       -2.0591166144
   O          1.9365901915        1.3763597852       -0.5917255381
   H          1.3328561429        1.0699250404       -1.2683604365
   H          2.5936648457        1.8836946768       -1.0682714924
   O          1.9040385288       -1.0990106019        0.6574925975
   H          2.0937347066       -0.2407393829        0.2785233180
   H          1.3229269366       -0.9126119609        1.3949183253
   O         -2.0244622140        1.2108803129       -0.6678810817
   H         -2.7211013730        1.8615709268       -0.7546419432
   H         -1.4230887824        1.5873588436       -0.0253503419
   O         -1.8230084872       -1.2919461598        0.5064167353
   H         -1.2334621999       -1.7248333698       -0.1110585100
   H         -2.0674376665       -0.4747048887        0.0721323570
    24
 Energy=    -305.399463211112
   O          0.2233495567       -2.1548591245       -1.1598884493
   H          0.8810713947       -1.8707156448       -0.5251473156
   H          0.5267471570       -3.0146691508       -1.4512790030
   O         -0.1325233505       -0.4306709724        2.4174544090
   H         -0.7900152150       -0.7839860075        1.8182008949
   H         -0.4021666850       -0.7433853133        3.2810133550
   O         -0.1647780810        2.0136971134        1.1057452537
   H         -0.1280216298        1.2744250224        1.7126699433
   H          0.6391999090        1.9420094164        0.5912434504
   O          0.0809958919        0.3807788339       -2.2712834880
   H         -0.7308243525        0.6993613465       -1.8767142122
   H          0.1004492658       -0.5525740173       -2.0598458815
   O          1.9328932691        1.3745553940       -0.5903800601
   H          1.3307016407        1.0686575264       -1.2686304396
   H          2.5906189606        1.8829126425       -1.0649342325
   O          1.9036247656       -1.1003966489        0.6597847067
   H          2.0911746616       -0.2423169984        0.2793163243
   H          1.3237457220       -0.9139647849        1.3981716614
   O         -2.0237669805        1.2104965181       -0.6670606993
   H         -2.7205363025        1.8610054414       -0.7541382082
   H         -1.4234485646        1.5865485879       -0.0232948410
   O         -1.8194878387       -1.2930817830        0.5047238931
   H         -1.2286445611       -1.7251776555       -0.1120655509
   H         -2.0649671240       -0.4764397003        0.0699050007
    24
 Energy=    -305.368092809824
   O          0.2246876697       -2.1537256651       -1.1570362107
   H          0.8822187231       -1.8763107096       -0.5191289320
   H          0.5356835169       -3.0039211216       -1.4679720705
   O         -0.1375189848       -0.4232525453        2.4251327230
   H         -0.7913371017       -0.7796415172        1.8236839632
   H         -0.4091401958       -0.7364176057        3.2879081299
   O         -0.1646301470        2.0148504498        1.1064890885
   H         -0.1336730553        1.2754207962        1.7135453346
   H          0.6375468585        1.9353430789        0.5903278057
   O          0.0796303131        0.3748783341       -2.2845144094
   H         -0.7286759767        0.6985698831       -1.8869008245
   H          0.0990728075       -0.5564926859       -2.0645101990
   O          1.9270354997        1.3606771804       -0.5914071638
   H          1.3278276641        1.0613024736       -1.2751882653
   H          2.5919840287        1.8657908580       -1.0593125672
   O          1.9011698025       -1.1048929316        0.6707167434
   H          2.0807960180       -0.2488639856        0.2818971113
   H          1.3215442518       -0.9163811262        1.4087745733
   O         -2.0131029065        1.2180803524       -0.6748501298
   H         -2.7079847921        1.8705075281       -0.7626555137
   H         -1.4156371112        1.5896728543       -0.0258620899
   O         -1.8171438500       -1.2854484933        0.5055288290
   H         -1.2283936207       -1.7239905407       -0.1087071844
   H         -2.0638703618       -0.4732550819        0.0631492060
    24
 Energy=    -305.358681890509
   O          0.2243495125       -2.1538732830       -1.1564446791
   H          0.8818705427       -1.8773986509       -0.5181189685
   H          0.5370914313       -3.0020600964       -1.4710928345
   O         -0.1384561148       -0.4221616960        2.4261675724
   H         -0.7917496221       -0.7789756226        1.8244007944
   H         -0.4104887409       -0.7352172525        3.2888530938
   O         -0.1646530496        2.0148952103        1.1058931369
   H         -0.1345710949        1.2755946011        1.7131505167
   H          0.6372837411        1.9341282513        0.5895541766
   O          0.0799092977        0.3739136928       -2.2860609303
   H         -0.7279983141        0.6984580061       -1.8883322294
   H          0.0992818364       -0.5571066341       -2.0645712113
   O          1.9260073884        1.3581123530       -0.5921858264
   H          1.3272309541        1.0596676510       -1.2767509304
   H          2.5921108045        1.8625575471       -1.0591688296
   O          1.9010947050       -1.1054149926        0.6727836737
   H          2.0797472398       -0.2497350736        0.2827490750
   H          1.3214099518       -0.9164943816        1.4106904629
   O         -2.0111400831        1.2195258434       -0.6759051039
   H         -2.7057518093        1.8722080201       -0.7639526256
   H         -1.4140927551        1.5906122472       -0.0262427231
   O         -1.8170388420       -1.2837855226        0.5060133605
   H         -1.2287610290       -1.7234311893       -0.1078862586
   H         -2.0637781612       -0.4721931093        0.0625392316
    24
 Energy=    -305.320566339402
   O          0.2230557212       -2.1528037168       -1.1513547991
   H          0.8815627218       -1.8786030438       -0.5130646135
   H          0.5445285067       -2.9913174781       -1.4826881060
   O         -0.1419670396       -0.4175750089        2.4313481456
   H         -0.7926906163       -0.7761237356        1.8278305591
   H         -0.4162175339       -0.7302829554        3.2934573304
   O         -0.1608916244        2.0156944617        1.1058687496
   H         -0.1343163565        1.2772769529        1.7143629384
   H          0.6399279791        1.9294229711        0.5886869319
   O          0.0803099721        0.3682700646       -2.2945369116
   H         -0.7262673203        0.6958495503       -1.8965964740
   H          0.0999563133       -0.5612402408       -2.0668167905
   O          1.9245058038        1.3482132682       -0.5936984435
   H          1.3269914411        1.0519843795       -1.2803256144
   H          2.5946053780        1.8493794510       -1.0584896417
   O          1.8990090686       -1.1087631834        0.6804600759
   H          2.0741040600       -0.2547779462        0.2851338831
   H          1.3182896525       -0.9177273361        1.4170074978
   O         -2.0063904001        1.2242688719       -0.6845021799
   H         -2.6995093824        1.8784582100       -0.7731262533
   H         -1.4101491191        1.5931282178       -0.0328343522
   O         -1.8178998352       -1.2759673233        0.5078104965
   H         -1.2330152760       -1.7208121203       -0.1055857857
   H         -2.0635071105       -0.4660138195        0.0607263568
    24
 Energy=    -305.285426605790
   O          0.2191363697       -2.1537680412       -1.1432209767
   H          0.8776681950       -1.8812564939       -0.5042333934
   H          0.5532368394       -2.9788386103       -1.4951688025
   O         -0.1447684422       -0.4133322745        2.4344808655
   H         -0.7943697803       -0.7719072733        1.8297710907
   H         -0.4220812970       -0.7238668742        3.2963959906
   O         -0.1560461776        2.0168159030        1.0999852176
   H         -0.1302294504        1.2817381388        1.7125421677
   H          0.6438750962        1.9259356185        0.5822028603
   O          0.0828941991        0.3607995917       -2.2979059178
   H         -0.7241266005        0.6920659144       -1.9039365122
   H          0.1011639370       -0.5670471809       -2.0633884915
   O          1.9251209171        1.3385193752       -0.5989031001
   H          1.3275063858        1.0414311004       -1.2850716428
   H          2.5976259601        1.8352998781       -1.0649266393
   O          1.8982331225       -1.1116683727        0.6885064067
   H          2.0739994056       -0.2590558768        0.2905240134
   H          1.3153033387       -0.9182272855        1.4226761779
   O         -2.0030185330        1.2289998401       -0.6925194046
   H         -2.6950224769        1.8841173650       -0.7829816081
   H         -1.4065272998        1.5983446445       -0.0413554743
   O         -1.8222922693       -1.2656991036        0.5123335238
   H         -1.2432491374       -1.7154801382       -0.1030020857
   H         -2.0629200956       -0.4539236152        0.0658465187
    24
 Energy=    -305.265820183837
   O          0.2180289641       -2.1539796707       -1.1405774640
   H          0.8766574650       -1.8817857361       -0.5015541469
   H          0.5557330289       -2.9750541752       -1.4983825264
   O         -0.1459191975       -0.4125381437        2.4353096046
   H         -0.7951541611       -0.7710570867        1.8301732814
   H         -0.4241826096       -0.7225246880        3.2971156477
   O         -0.1538207427        2.0172554376        1.0987873753
   H         -0.1278780163        1.2833440206        1.7127359456
   H          0.6457382144        1.9250947211        0.5806718318
   O          0.0842479920        0.3588793468       -2.2986308437
   H         -0.7230193310        0.6908792262       -1.9057855951
   H          0.1023781502       -0.5685249754       -2.0623590503
   O          1.9246487824        1.3355489899       -0.6011880722
   H          1.3270521334        1.0379530244       -1.2871521576
   H          2.5977930272        1.8310154481       -1.0676874341
   O          1.8980782650       -1.1123788280        0.6910337517
   H          2.0744314532       -0.2601494252        0.2924908580
   H          1.3141953169       -0.9182131869        1.4242542143
   O         -2.0026923986        1.2299757395       -0.6957368526
   H         -2.6943977891        1.8853350625       -0.7867294370
   H         -1.4060875570        1.5995285865       -0.0447950761
   O         -1.8234688581       -1.2623193689        0.5141715320
   H         -1.2467459266       -1.7134832816       -0.1023295826
   H         -2.0621583041       -0.4494535740        0.0686287306
    24
 Energy=    -305.182986587826
   O          0.2117722130       -2.1575062547       -1.1296846776
   H          0.8697336932       -1.8857467840       -0.4897899044
   H          0.5689117061       -2.9569821011       -1.5163648989
   O         -0.1446408973       -0.4024017236        2.4377507166
   H         -0.7954343759       -0.7586261328        1.8329335057
   H         -0.4268797922       -0.7064993035        3.3003616996
   O         -0.1503167371        2.0202051005        1.0832263559
   H         -0.1256564952        1.2912503714        1.7031043402
   H          0.6495415292        1.9229871088        0.5664989075
   O          0.0828886293        0.3435406104       -2.2990540065
   H         -0.7254004337        0.6838719891       -1.9155501821
   H          0.0950648587       -0.5811021312       -2.0518306668
   O          1.9356551427        1.3287708799       -0.6038901308
   H          1.3351333418        1.0289537500       -1.2863233475
   H          2.6100543776        1.8176414474       -1.0755076456
   O          1.8965349876       -1.1180452110        0.6989348817
   H          2.0762884930       -0.2672741518        0.2987985022
   H          1.3120977552       -0.9203718156        1.4307751582
   O         -1.9992528585        1.2356996642       -0.7003653167
   H         -2.6891315723        1.8925824070       -0.7941963482
   H         -1.4007393193        1.6071484394       -0.0522610113
   O         -1.8342690461       -1.2516407751        0.5178435571
   H         -1.2616539986       -1.7085731890       -0.0982381068
   H         -2.0658727042       -0.4372165553        0.0714079227
    24
 Energy=    -304.980965634199
   O          0.2034526523       -2.1703648187       -1.1151836474
   H          0.8608437356       -1.8944918074       -0.4764639239
   H          0.5902473199       -2.9343129251       -1.5429745027
   O         -0.1430449056       -0.3785201886        2.4305497290
   H         -0.8020819031       -0.7307582729        1.8323604546
   H         -0.4278304546       -0.6664414997        3.2978618698
   O         -0.1414919036        2.0359475402        1.0639508100
   H         -0.1251338117        1.3118132661        1.6897253747
   H          0.6636277969        1.9329292286        0.5566034582
   O          0.0859439610        0.3287286376       -2.2794519964
   H         -0.7198526298        0.6941197910       -1.9141945539
   H          0.0779719387       -0.5890824186       -2.0078067277
   O          1.9481637502        1.3093634225       -0.6043263180
   H          1.3452534925        1.0125487916       -1.2859656186
   H          2.6264377072        1.7915822541       -1.0772335792
   O          1.8947855496       -1.1276658016        0.6935348229
   H          2.0741370495       -0.2784882734        0.2898487999
   H          1.3210865096       -0.9256488415        1.4326494279
   O         -2.0092447649        1.2432349112       -0.7033679797
   H         -2.6922333039        1.9071752250       -0.7979288350
   H         -1.4021125533        1.6130852600       -0.0624053933
   O         -1.8423363908       -1.2464811792        0.5198937914
   H         -1.2589620548       -1.7111250693       -0.0801164415
   H         -2.0710460129       -0.4407850839        0.0564528020
    24
 Energy=    -304.848049863650
   O          0.1946956787       -2.1752931047       -1.1174978856
   H          0.8517382408       -1.8975641511       -0.4792240103
   H          0.5893280865       -2.9293728035       -1.5555171895
   O         -0.1476488016       -0.3782884838        2.4221388189
   H         -0.8099697223       -0.7284025086        1.8263343144
   H         -0.4328696525       -0.6611447854        3.2909732213
   O         -0.1382352378        2.0372489670        1.0596957824
   H         -0.1214951497        1.3165096888        1.6893675241
   H          0.6669780839        1.9319670565        0.5529620594
   O          0.0831179644        0.3213955677       -2.2797330460
   H         -0.7226486681        0.6898909882       -1.9175409712
   H          0.0739516424       -0.5946837122       -2.0023405957
   O          1.9562473950        1.3095173274       -0.6044009220
   H          1.3514487892        1.0104795267       -1.2833905245
   H          2.6342160562        1.7885681231       -1.0809517268
   O          1.8975663617       -1.1266957744        0.7035581954
   H          2.0805894000       -0.2784343693        0.2995940930
   H          1.3264645080       -0.9217253990        1.4438700607
   O         -2.0107802628        1.2455200059       -0.7066539183
   H         -2.6931397638        1.9099557551       -0.8022702690
   H         -1.4017597684        1.6170765492       -0.0684755635
   O         -1.8394804372       -1.2404187208        0.5286360091
   H         -1.2538823640       -1.7056182327       -0.0687718506
   H         -2.0666722855       -0.4352742737        0.0634928878
    24
 Energy=    -304.714709874303
   O          0.1859719137       -2.1827616511       -1.0808113670
   H          0.8407674975       -1.9066304581       -0.4395421975
   H          0.6049030252       -2.8986601886       -1.5585328840
   O         -0.1489254423       -0.3709971975        2.4297210497
   H         -0.8175275930       -0.7121466625        1.8357344786
   H         -0.4404257458       -0.6420290397        3.3002388000
   O         -0.1223223586        2.0347252949        1.0315069171
   H         -0.1037742704        1.3210380714        1.6691105208
   H          0.6836963236        1.9265278074        0.5266712729
   O          0.0905130593        0.2980417373       -2.2709260562
   H         -0.7202041068        0.6631185315       -1.9164003859
   H          0.0859790205       -0.6162873690       -1.9877060570
   O          1.9741829169        1.3099298268       -0.6274019458
   H          1.3615900815        0.9957106584       -1.2924043310
   H          2.6475879856        1.7762805520       -1.1226538561
   O          1.8868970513       -1.1254374140        0.7078535862
   H          2.0980459622       -0.2804695821        0.3107675245
   H          1.3039161343       -0.9095717684        1.4357046105
   O         -2.0044012238        1.2466555465       -0.7207016338
   H         -2.6889499502        1.9081232717       -0.8211273764
   H         -1.3935341052        1.6273539100       -0.0897167216
   O         -1.8674752164       -1.2195658245        0.5391240255
   H         -1.2941373915       -1.6943183838       -0.0626446891
   H         -2.0789840669       -0.4074844439        0.0786680803
    24
 Energy=    -304.627153528470
   O          0.1828364868       -2.1834548820       -1.0774056039
   H          0.8376611089       -1.9065290786       -0.4365088463
   H          0.6053915261       -2.8933760904       -1.5608215288
   O         -0.1499292977       -0.3707949333        2.4307118324
   H         -0.8192903376       -0.7101292643        1.8365402662
   H         -0.4426599178       -0.6406108328        3.3011944597
   O         -0.1197826560        2.0329508230        1.0281145369
   H         -0.0998961128        1.3212239741        1.6678654711
   H          0.6856459725        1.9237748228        0.5225483540
   O          0.0913780003        0.2936039531       -2.2716672105
   H         -0.7203245334        0.6568244066       -1.9174896576
   H          0.0892632544       -0.6204922340       -1.9876680406
   O          1.9774014142        1.3102078195       -0.6312367963
   H          1.3633451263        0.9925128675       -1.2932312318
   H          2.6496452962        1.7740579838       -1.1303991228
   O          1.8864771905       -1.1238910525        0.7121767900
   H          2.1030481661       -0.2797026696        0.3163550791
   H          1.3012307362       -0.9057615721        1.4375304675
   O         -2.0031795677        1.2460037636       -0.7240099222
   H         -2.6883096048        1.9067194455       -0.8254173188
   H         -1.3920710380        1.6286442888       -0.0944351185
   O         -1.8709968007       -1.2144525468        0.5421458820
   H         -1.3008160551       -1.6900647343       -0.0619392150
   H         -2.0791399031       -0.3998584291        0.0846038485
    24
 Energy=    -304.491751836088
   O          0.1708232378       -2.1953837849       -1.0707505446
   H          0.8278036157       -1.9135925876       -0.4341954847
   H          0.6013897701       -2.8906171249       -1.5682391416
   O         -0.1512586486       -0.3626373371        2.4271476814
   H         -0.8233709547       -0.7018925050        1.8360446285
   H         -0.4446980419       -0.6246155805        3.2997830935
   O         -0.1097682894        2.0356227383        1.0210282539
   H         -0.0914500820        1.3210060164        1.6575965724
   H          0.6986104429        1.9308287253        0.5192575093
   O          0.1036477875        0.2885715556       -2.2541785481
   H         -0.7083477568        0.6519761733       -1.9008625990
   H          0.1010945967       -0.6254861893       -1.9700592770
   O          1.9851911322        1.3089382153       -0.6402211127
   H          1.3677750032        0.9879264005       -1.2974734070
   H          2.6546533310        1.7706266522       -1.1450933654
   O          1.8880545061       -1.1177689823        0.7155123510
   H          2.1123026248       -0.2749181306        0.3211177985
   H          1.2991215452       -0.8961119226        1.4368014438
   O         -2.0056041153        1.2436677528       -0.7311597433
   H         -2.6894429176        1.9061401628       -0.8297834648
   H         -1.3919926888        1.6238957273       -0.1025584828
   O         -1.8874078605       -1.2114609139        0.5425247797
   H         -1.3215746863       -1.6975127216       -0.0573237839
   H         -2.0907177999       -0.4004409954        0.0765380843
    24
 Energy=    -304.183992071635
   O          0.1570382568       -2.2224946158       -1.0449063605
   H          0.8202426216       -1.9268110706       -0.4212373364
   H          0.6009779699       -2.8888859994       -1.5693793292
   O         -0.1692146657       -0.3430229872        2.3977413262
   H         -0.8507816018       -0.6861586154        1.8198518106
   H         -0.4591336952       -0.5808907603        3.2784215853
   O         -0.0974203680        2.0402043046        0.9996929270
   H         -0.0843375029        1.3122550595        1.6211030776
   H          0.7199223498        1.9519218020        0.5093981978
   O          0.1142116943        0.2753466009       -2.2178177829
   H         -0.6967326877        0.6432511477       -1.8667518437
   H          0.1041981876       -0.6395335873       -1.9365246779
   O          2.0274336892        1.3185238508       -0.6385240384
   H          1.3998779195        0.9953876899       -1.2850444305
   H          2.6887056872        1.7789444050       -1.1552097242
   O          1.8804669131       -1.1119488371        0.7017997874
   H          2.1109501825       -0.2717629310        0.3053190870
   H          1.2904187850       -0.8844170739        1.4203429964
   O         -2.0027191276        1.2485384031       -0.7324889516
   H         -2.6818297324        1.9172961708       -0.8208273603
   H         -1.3839453002        1.6167083204       -0.1017737207
   O         -1.9166461110       -1.2160487129        0.5463892911
   H         -1.3533328232       -1.7345360526       -0.0281373475
   H         -2.1156048593       -0.4283366072        0.0402698437
    24
 Energy=    -303.973711677532
   O          0.1523843558       -2.2327675961       -1.0339733886
   H          0.8192602550       -1.9320271319       -0.4166699395
   H          0.5972692156       -2.8934380398       -1.5648442453
   O         -0.1625860362       -0.3349192089        2.3891890645
   H         -0.8461882386       -0.6835373955        1.8170131922
   H         -0.4503384663       -0.5627004305        3.2732400212
   O         -0.0988855072        2.0473203622        0.9917636360
   H         -0.0903696165        1.3136854053        1.6065311283
   H          0.7242274541        1.9662475115        0.5099503051
   O          0.1200187060        0.2687529656       -2.1998153535
   H         -0.6908442077        0.6447377143       -1.8572242796
   H          0.0957350782       -0.6471236206       -1.9226651696
   O          2.0406321625        1.3285607091       -0.6298159005
   H          1.4112016784        1.0031875135       -1.2733851580
   H          2.6970761209        1.7925338014       -1.1494716896
   O          1.8801043581       -1.1160447098        0.6869419128
   H          2.1073773601       -0.2751841926        0.2900383815
   H          1.2893063288       -0.8903949113        1.4054624045
   O         -2.0058361630        1.2482760848       -0.7320428176
   H         -2.6852534924        1.9170048551       -0.8182156927
   H         -1.3864622941        1.6153215345       -0.1012611689
   O         -1.9315072315       -1.2207425091        0.5405405543
   H         -1.3713873814       -1.7461036856       -0.0308553048
   H         -2.1298041063       -0.4371864901        0.0277538982
    24
 Energy=    -303.764693606216
   O          0.1287894252       -2.2604423651       -1.0336628927
   H          0.8009317296       -1.9581536879       -0.4228616824
   H          0.5748095275       -2.9071897824       -1.5804861608
   O         -0.1616936816       -0.3231665492        2.3640371898
   H         -0.8456638923       -0.6877993908        1.8023793921
   H         -0.4460322807       -0.5308499697        3.2541220160
   O         -0.1086563896        2.0639060830        0.9819352089
   H         -0.1042352281        1.3299905199        1.5964107898
   H          0.7224693594        1.9892982627        0.5130050407
   O          0.1380974437        0.2568261704       -2.1671937364
   H         -0.6726486348        0.6519705933       -1.8465950446
   H          0.0819102609       -0.6595396354       -1.8963643611
   O          2.0511682475        1.3339017875       -0.6143285927
   H          1.4240248368        1.0009504937       -1.2562525899
   H          2.7004180793        1.8060427804       -1.1356628221
   O          1.8880456752       -1.1171276994        0.6714633505
   H          2.1152108277       -0.2752313671        0.2766996247
   H          1.3016450869       -0.8929448937        1.3940339419
   O         -2.0078009432        1.2507046258       -0.7384491696
   H         -2.6911537674        1.9149952727       -0.8277727061
   H         -1.3888028161        1.6258811560       -0.1120980461
   O         -1.9318415744       -1.2188201579        0.5504333816
   H         -1.3814576867       -1.7472531492       -0.0275527687
   H         -2.1291566496       -0.4326775256        0.0412395455
    24
 Energy=    -303.577492564896
   O          0.1223558504       -2.2665683164       -1.0297994377
   H          0.7981261719       -1.9609363472       -0.4246916687
   H          0.5668672192       -2.9113269973       -1.5801881425
   O         -0.1538901679       -0.3182423561        2.3543896477
   H         -0.8375866070       -0.6898605713        1.7969930911
   H         -0.4367367458       -0.5181493769        3.2467274966
   O         -0.1152185464        2.0693609982        0.9808583998
   H         -0.1119466190        1.3358855550        1.5958664556
   H          0.7195667567        1.9981252412        0.5179428518
   O          0.1479073919        0.2507916507       -2.1537405578
   H         -0.6629211497        0.6546412369       -1.8443953978
   H          0.0761260770       -0.6658987681       -1.8877368758
   O          2.0548685275        1.3391943399       -0.6047369721
   H          1.4295093553        0.9985236473       -1.2443471853
   H          2.6982968794        1.8162757624       -1.1287838328
   O          1.8901167339       -1.1218282868        0.6596019039
   H          2.1147888162       -0.2789564094        0.2654936781
   H          1.3040072267       -0.8998504931        1.3830888385
   O         -2.0130738833        1.2512067732       -0.7422886887
   H         -2.6994614424        1.9121063391       -0.8334792729
   H         -1.3944177200        1.6321317577       -0.1190772095
   O         -1.9356185784       -1.2194813761        0.5508370567
   H         -1.3922868327       -1.7461349675       -0.0353868330
   H         -2.1310886280       -0.4275104350        0.0500323761
    24
 Energy=    -303.268370011554
   O          0.1149845034       -2.2737120610       -1.0344416722
   H          0.7918773086       -1.9757271989       -0.4267797660
   H          0.5615559115       -2.9021966674       -1.6017272413
   O         -0.1539723305       -0.3069439248        2.3599875802
   H         -0.8299156998       -0.6903991665        1.8011544396
   H         -0.4405798379       -0.5027033578        3.2520448772
   O         -0.1116241070        2.0857546553        0.9772071380
   H         -0.1096307989        1.3610860829        1.6025736920
   H          0.7232590572        2.0067985717        0.5157227081
   O          0.1569099971        0.2381974080       -2.1548611901
   H         -0.6531806765        0.6517205341       -1.8565600592
   H          0.0719780133       -0.6768531130       -1.8870908740
   O          2.0531823948        1.3352509293       -0.5926656671
   H          1.4326809827        0.9841738052       -1.2313789757
   H          2.6940029826        1.8137762449       -1.1185880346
   O          1.8739793910       -1.1344809498        0.6545719931
   H          2.1094023383       -0.2929064029        0.2639824926
   H          1.2944693115       -0.9077641190        1.3818954331
   O         -2.0160371659        1.2459413012       -0.7543406616
   H         -2.7051779400        1.9026344226       -0.8546949234
   H         -1.4005943292        1.6367722221       -0.1340881758
   O         -1.9199990905       -1.2071095888        0.5606585099
   H         -1.3852832014       -1.7286257094       -0.0379496206
   H         -2.1136409019       -0.4061504590        0.0736275447
    24
 Energy=    -302.831535505431
   O          0.0944903642       -2.2886552050       -1.0588668833
   H          0.7705573679       -2.0056865269       -0.4431608058
   H          0.5488178518       -2.8798475478       -1.6591251508
   O         -0.1483033003       -0.2712003304        2.4003283640
   H         -0.8059543401       -0.6697681453        1.8303541131
   H         -0.4466957270       -0.4712690472        3.2875522975
   O         -0.1170894038        2.1020817482        0.9565030300
   H         -0.1204290015        1.3943360831        1.6009537733
   H          0.7138311391        2.0001221133        0.4923832996
   O          0.1664020141        0.2227848580       -2.1679151116
   H         -0.6424519946        0.6459001809       -1.8798865432
   H          0.0733771552       -0.6880437488       -1.8886849831
   O          2.0453942973        1.3172956902       -0.5896736912
   H          1.4326273109        0.9585647139       -1.2315931153
   H          2.6910067528        1.7918635783       -1.1133164289
   O          1.8440888610       -1.1539892675        0.6712289637
   H          2.1061365757       -0.3169768510        0.2878583208
   H          1.2779414070       -0.9150453346        1.4051327022
   O         -1.9912608214        1.2456551039       -0.7569245872
   H         -2.6843684826        1.8947824478       -0.8772046830
   H         -1.3844452513        1.6541008576       -0.1395278183
   O         -1.8978966960       -1.1927635391        0.5632236377
   H         -1.3696355078       -1.7075376320       -0.0468415968
   H         -2.0935202972       -0.3848400755        0.0886470647
    24
 Energy=    -302.180066320767
   O          0.0903316654       -2.2915515255       -1.0731082818
   H          0.7634641610       -2.0270700680       -0.4460723642
   H          0.5535084661       -2.8420653747       -1.7044826502
   O         -0.1561502804       -0.2353714215        2.4347035481
   H         -0.7959455318       -0.6436328783        1.8514227760
   H         -0.4667643378       -0.4444964519        3.3156220851
   O         -0.1093213120        2.1158491448        0.9533352858
   H         -0.1149472502        1.4264537857        1.6173640711
   H          0.7138438762        1.9881754746        0.4818160955
   O          0.1680260806        0.2051985780       -2.1923566275
   H         -0.6392725499        0.6324485179       -1.9060731141
   H          0.0767904467       -0.7013804845       -1.8990610383
   O          2.0412537090        1.2905074797       -0.5905472707
   H          1.4344080671        0.9303506097       -1.2372753711
   H          2.6957532278        1.7577738837       -1.1097045953
   O          1.7998215008       -1.1692588242        0.6836348116
   H          2.0899795333       -0.3388125588        0.3062766841
   H          1.2490386586       -0.9167156926        1.4246422795
   O         -1.9760980674        1.2481930613       -0.7730522984
   H         -2.6685680828        1.8950208015       -0.9084442931
   H         -1.3723407686        1.6677129085       -0.1600987423
   O         -1.8651802645       -1.1832870060        0.5764896609
   H         -1.3420594079       -1.6965175165       -0.0392788446
   H         -2.0598170117       -0.3717167413        0.1077657741
    24
 Energy=    -301.626396511234
   O          0.0934722140       -2.2964029397       -1.0861317102
   H          0.7633063791       -2.0403636843       -0.4520986425
   H          0.5659263263       -2.8129331027       -1.7389835637
   O         -0.1686088335       -0.2080676969        2.4662290737
   H         -0.7979637403       -0.6186090101        1.8732703302
   H         -0.4875338958       -0.4249416442        3.3422909069
   O         -0.0963564997        2.1245849252        0.9433258446
   H         -0.1080854449        1.4448949110        1.6172069591
   H          0.7197576538        1.9751936807        0.4659666668
   O          0.1602840301        0.1962224694       -2.2187285604
   H         -0.6448599388        0.6236085141       -1.9266391936
   H          0.0780730782       -0.7064363358       -1.9110269502
   O          2.0395445224        1.2680710912       -0.5929245315
   H          1.4324872839        0.9167923188       -1.2443203967
   H          2.7050158791        1.7253200853       -1.1070286754
   O          1.7665447466       -1.1770424568        0.7022494394
   H          2.0763299456       -0.3534121151        0.3255558894
   H          1.2295107983       -0.9123823401        1.4490970819
   O         -1.9595141470        1.2469956478       -0.7748210541
   H         -2.6474250502        1.8966906094       -0.9194131911
   H         -1.3592643324        1.6662049185       -0.1582210319
   O         -1.8454221063       -1.1743951775        0.5802558435
   H         -1.3231989969       -1.6923858496       -0.0322803005
   H         -2.0411787695       -0.3666947565        0.1053545920
    24
 Energy=    -301.017693968083
   O          0.0958910172       -2.3029529284       -1.1043812743
   H          0.7580497010       -2.0485267667       -0.4616954680
   H          0.5848010102       -2.7743062746       -1.7789365958
   O         -0.1945761727       -0.1758990993        2.4882072052
   H         -0.8179159682       -0.5849210843        1.8878903262
   H         -0.5206527308       -0.3975129006        3.3604418303
   O         -0.0697069702        2.1321038946        0.9462501149
   H         -0.0907365998        1.4624001359        1.6298336652
   H          0.7373073852        1.9560498222        0.4625512067
   O          0.1556322184        0.1941242035       -2.2355239489
   H         -0.6436321869        0.6223584968       -1.9288912037
   H          0.0881754694       -0.7027508304       -1.9079623508
   O          2.0308242660        1.2301546598       -0.6185457846
   H          1.4219710967        0.8986042282       -1.2785487918
   H          2.7130872899        1.6735925417       -1.1226408660
   O          1.7370463874       -1.1844054349        0.7390753367
   H          2.0627927513       -0.3689211356        0.3581468605
   H          1.2134109183       -0.9059662568        1.4904137156
   O         -1.9460062166        1.2499080733       -0.7806827014
   H         -2.6236104426        1.9094054748       -0.9295031650
   H         -1.3428530962        1.6610301721       -0.1614761339
   O         -1.8227094342       -1.1642035270        0.5846880952
   H         -1.3031295008       -1.6954053729       -0.0187132071
   H         -2.0193866205       -0.3664077187        0.0936974918
    24
 Energy=    -299.506582599116
   O          0.1219927197       -2.3061127639       -1.1107111491
   H          0.7528227237       -2.0459545065       -0.4394414364
   H          0.6567154445       -2.6836737243       -1.8091029939
   O         -0.2434849462       -0.1385916773        2.5073102978
   H         -0.8684570270       -0.5338990141        1.8995489567
   H         -0.5792736896       -0.3614513819        3.3755333751
   O         -0.0014833132        2.1345960769        0.9379534588
   H         -0.0490287744        1.4702489905        1.6254228893
   H          0.7896700890        1.9147301814        0.4460519217
   O          0.1050140926        0.1849907083       -2.2691616001
   H         -0.6740706366        0.6215752713       -1.9247015238
   H          0.0634113374       -0.7004433943       -1.9079033813
   O          2.0388234419        1.1557171588       -0.6516989584
   H          1.4138338746        0.8643951070       -1.3155900210
   H          2.7430642923        1.5699151727       -1.1504139771
   O          1.6984652498       -1.1949672066        0.7944699499
   H          2.0231404753       -0.3905012944        0.3899301694
   H          1.1693606666       -0.8952458794        1.5336906924
   O         -1.9191841695        1.2911676393       -0.7735933337
   H         -2.5712414709        1.9769569287       -0.9176286292
   H         -1.3019313017        1.6740292812       -0.1501771803
   O         -1.8154966388       -1.1501901578        0.5836282652
   H         -1.3063655488       -1.7216159504        0.0087457236
   H         -2.0159934342       -0.3848222330        0.0448845275
    24
 Energy=    -298.613222563218
   O          0.1377122024       -2.3035056451       -1.1041728905
   H          0.7476320414       -2.0368528261       -0.4163314086
   H          0.6976947700       -2.6346243622       -1.8063208515
   O         -0.2511002859       -0.1290139671        2.5083138885
   H         -0.8804974126       -0.5153644289        1.8993603455
   H         -0.5903592975       -0.3491775793        3.3758754984
   O          0.0324070112        2.1330758952        0.9348464964
   H         -0.0306847860        1.4674798760        1.6198524850
   H          0.8179929569        1.8963587386        0.4418439105
   O          0.0814331178        0.1790196432       -2.2705495421
   H         -0.6851654730        0.6235043609       -1.9086216812
   H          0.0457729184       -0.7022115211       -1.8985390245
   O          2.0408178174        1.1161716706       -0.6788479879
   H          1.4068066918        0.8440338943       -1.3423257669
   H          2.7522326795        1.5182023246       -1.1773377945
   O          1.6884858524       -1.1983025494        0.8233947861
   H          2.0007718971       -0.3971019081        0.4029345637
   H          1.1451880800       -0.8921636969        1.5495754617
   O         -1.9111969650        1.3175980323       -0.7646094331
   H         -2.5498258598        2.0172111118       -0.9021830997
   H         -1.2829410439        1.6850005273       -0.1428846192
   O         -1.8326894375       -1.1402564236        0.5696299835
   H         -1.3357594784       -1.7323833315        0.0051141018
   H         -2.0327676886       -0.3884976754        0.0119030630
    24
 Energy=    -297.694091243409
   O          0.1544484705       -2.3034780266       -1.0921254536
   H          0.7401369713       -2.0293320128       -0.3864025738
   H          0.7404622537       -2.5887535511       -1.7931515309
   O         -0.2702220830       -0.1286074013        2.4941622594
   H         -0.9083379979       -0.5054690525        1.8883444526
   H         -0.6101906212       -0.3407922358        3.3634325448
   O          0.0629585328        2.1263393024        0.9294801688
   H         -0.0103472667        1.4599438967        1.6126896997
   H          0.8432411398        1.8773477503        0.4341074807
   O          0.0493264333        0.1709245730       -2.2730022692
   H         -0.7048606985        0.6259001496       -1.8982612455
   H          0.0115738671       -0.7077441906       -1.8951824873
   O          2.0478312036        1.0785539680       -0.6970347355
   H          1.4032697316        0.8192021484       -1.3554487257
   H          2.7610711781        1.4706308605       -1.2008167212
   O          1.6954398057       -1.2019461693        0.8453419805
   H          1.9902368642       -0.4051536015        0.4043792403
   H          1.1361761565       -0.8896816289        1.5566414023
   O         -1.9037326515        1.3518039363       -0.7558085311
   H         -2.5306506120        2.0631274261       -0.8870510686
   H         -1.2633943435        1.7069638181       -0.1393183449
   O         -1.8475700708       -1.1217204696        0.5671697462
   H         -1.3696635518       -1.7306623130        0.0041182117
   H         -2.0443973210       -0.3754428693        0.0009890181
    24
 Energy=    -296.694094506081
   O          0.1714270203       -2.3073770111       -1.0789232929
   H          0.7305962126       -2.0248772119       -0.3552137394
   H          0.7829510938       -2.5482152458       -1.7748163108
   O         -0.2728340189       -0.1310440099        2.4908447165
   H         -0.9169854723       -0.4981530579        1.8854261076
   H         -0.6153136927       -0.3382715622        3.3603251674
   O          0.0917311582        2.1218281434        0.9167783938
   H          0.0081895930        1.4518014312        1.5952449382
   H          0.8685548034        1.8648375771        0.4200564262
   O          0.0241671901        0.1634208295       -2.2677038716
   H         -0.7183281629        0.6315543095       -1.8858877698
   H         -0.0244553322       -0.7139680947       -1.8881562909
   O          2.0447098238        1.0357472219       -0.7153968649
   H          1.3907913121        0.7840160897       -1.3675117758
   H          2.7568618903        1.4209694421       -1.2259603921
   O          1.7131601906       -1.2029760776        0.8598675984
   H          1.9884215570       -0.4115987580        0.3970663904
   H          1.1320355244       -0.8866134056        1.5515616219
   O         -1.9001837475        1.3874006446       -0.7437688492
   H         -2.5172385131        2.1081875297       -0.8700285907
   H         -1.2486460660        1.7333198841       -0.1337931371
   O         -1.8797762540       -1.0985611173        0.5577169742
   H         -1.4223871126       -1.7173718087       -0.0115811389
   H         -2.0734694392       -0.3506350935       -0.0073683759
    24
 Energy=    -293.803218947638
   O          0.2008618405       -2.3135849805       -1.0273304014
   H          0.7019915966       -2.0245162417       -0.2647426544
   H          0.8608566287       -2.4716854936       -1.7023436955
   O         -0.2519093685       -0.1568555010        2.4452273980
   H         -0.9097233345       -0.5062869737        1.8440533201
   H         -0.5972459123       -0.3491785969        3.3169993511
   O          0.1198928497        2.1185227119        0.9010650519
   H          0.0335567109        1.4468747944        1.5775759432
   H          0.8897627488        1.8542522724        0.3973852793
   O         -0.0276159879        0.1382832119       -2.2557797380
   H         -0.7531397662        0.6396478760       -1.8836499747
   H         -0.1294777078       -0.7398143568       -1.8886276036
   O          2.0453929599        0.9695843175       -0.7494124358
   H          1.3699807736        0.7217134645       -1.3807683250
   H          2.7455513546        1.3462421655       -1.2824592705
   O          1.7509272380       -1.2140226061        0.8863404501
   H          1.9863340310       -0.4426046888        0.3708505097
   H          1.1378609322       -0.8853360425        1.5438712003
   O         -1.9009950079        1.4494433555       -0.7195510173
   H         -2.5044120474        2.1822820199       -0.8422995752
   H         -1.2301464076        1.7877015646       -0.1264444674
   O         -1.9340763341       -1.0326205004        0.5427347730
   H         -1.5298541794       -1.6471172908       -0.0698254154
   H         -2.1115464584       -0.2521746151        0.0177200922
    24
 Energy=    -292.447342739883
   O          0.2160508446       -2.3118542124       -1.0008725656
   H          0.7070771789       -2.0108435432       -0.2363350870
   H          0.8825330412       -2.4560326294       -1.6726209603
   O         -0.2479113790       -0.1607739494        2.4377128068
   H         -0.9091637440       -0.5058022411        1.8377689530
   H         -0.5936193497       -0.3494275520        3.3101391115
   O          0.1253530190        2.1179329273        0.8961399566
   H          0.0399201415        1.4461141605        1.5725958738
   H          0.8938604094        1.8531555282        0.3906489479
   O         -0.0388295972        0.1382186767       -2.2550233032
   H         -0.7611457612        0.6479631247       -1.8880739919
   H         -0.1562942543       -0.7398518101       -1.8924959049
   O          2.0413142264        0.9560277161       -0.7525606874
   H          1.3601719378        0.7092520252       -1.3781634216
   H          2.7379236829        1.3307061823       -1.2916183393
   O          1.7574357892       -1.2240986710        0.8806740813
   H          1.9851843069       -0.4600789876        0.3509228416
   H          1.1399186562       -0.8896893260        1.5311161007
   O         -1.9026337390        1.4621677673       -0.7149716296
   H         -2.5037399142        2.1968599991       -0.8379778517
   H         -1.2286072101        1.7997321246       -0.1250814848
   O         -1.9457269964       -1.0220143480        0.5338139205
   H         -1.5606289203       -1.6328587546       -0.0945175388
   H         -2.1142248833       -0.2288928062        0.0250914795
    24
 Energy=    -291.325539968605
   O          0.2149974397       -2.3198891147       -1.0103016143
   H          0.7042111964       -1.9712801767       -0.2650677258
   H          0.8771978999       -2.4622633608       -1.6866535674
   O         -0.2541726516       -0.1648296008        2.4232735901
   H         -0.9206117772       -0.5049165021        1.8262546360
   H         -0.5990232487       -0.3478342434        3.2972410989
   O          0.1448561948        2.1208781884        0.9040741198
   H          0.0619281091        1.4498999432        1.5816750105
   H          0.9121021191        1.8560346500        0.3967049921
   O         -0.0415725280        0.1429819339       -2.2475681358
   H         -0.7588501096        0.6629322221       -1.8850817102
   H         -0.1744850671       -0.7336383954       -1.8868703464
   O          2.0282363111        0.9436222723       -0.7598147594
   H          1.3415934257        0.6978169525       -1.3797608318
   H          2.7212828872        1.3164601968       -1.3047093963
   O          1.7868089196       -1.2287403798        0.9157202817
   H          2.0069367049       -0.4757949190        0.3672234893
   H          1.1696287054       -0.8834804653        1.5607908318
   O         -1.9218393680        1.4716291366       -0.7235516557
   H         -2.5184464810        2.2103025988       -0.8446025088
   H         -1.2422102525        1.8055189871       -0.1380145747
   O         -1.9501795342       -1.0152607663        0.5259441581
   H         -1.5936701110       -1.6213631120       -0.1234962300
   H         -2.1017405323       -0.2046610913        0.0399510811
    24
 Energy=    -287.872369891525
   O          0.1502707444       -2.3630930130       -1.0561949328
   H          0.6092238061       -2.0476943331       -0.2776593845
   H          0.8377602523       -2.4685332158       -1.7138212554
   O         -0.2316572689       -0.1605630376        2.4206824712
   H         -0.9072111250       -0.4915580941        1.8288200715
   H         -0.5738839326       -0.3355952444        3.2973103725
   O          0.1416338123        2.1179757437        0.8892160313
   H          0.0658663991        1.4468913140        1.5675498925
   H          0.9058752457        1.8554020652        0.3761644404
   O         -0.0674474957        0.1312310897       -2.2457806719
   H         -0.7794384069        0.6627072754       -1.8896432738
   H         -0.2177433285       -0.7431318010       -1.8864305113
   O          2.0373987210        0.9473397751       -0.7646159970
   H          1.3415817858        0.6896147949       -1.3693047329
   H          2.7183453553        1.3177519689       -1.3261659307
   O          1.8606828641       -1.2104334421        0.9873849938
   H          2.0706064001       -0.4677923940        0.4211269054
   H          1.2487546384       -0.8552240175        1.6320569656
   O         -1.9178564244        1.4897945358       -0.7174409581
   H         -2.5124588184        2.2296418800       -0.8411573285
   H         -1.2358394098        1.8247719417       -0.1353114456
   O         -1.9637473799       -1.0048062369        0.5129913345
   H         -1.6154708171       -1.5973469565       -0.1532149184
   H         -2.1044092119       -0.1790318156        0.0498037978
    24
 Energy=    -283.304889404223
   O          0.0869670150       -2.4000276639       -1.0799079342
   H          0.5013200791       -2.1623747912       -0.2504114059
   H          0.8116669930       -2.4564031641       -1.7026948840
   O         -0.2197184332       -0.1541982485        2.4183856231
   H         -0.9055813301       -0.4767296647        1.8337511969
   H         -0.5572275854       -0.3198701109        3.2986539039
   O          0.1534541352        2.1220707609        0.8857687843
   H          0.0875768854        1.4512738828        1.5654183825
   H          0.9151863681        1.8638883592        0.3667912388
   O         -0.0749475880        0.1182714951       -2.2347249882
   H         -0.7814928913        0.6588455671       -1.8814471272
   H         -0.2383752526       -0.7542700402       -1.8766823822
   O          2.0312451409        0.9487480035       -0.7811946470
   H          1.3309306783        0.6784080784       -1.3750867401
   H          2.7029630279        1.3179393495       -1.3545398051
   O          1.9279918427       -1.1988399114        1.0236835434
   H          2.1316280431       -0.4620693680        0.4475470107
   H          1.3225908544       -0.8371745122        1.6709235471
   O         -1.9316844523        1.5000823739       -0.7256695650
   H         -2.5215084526        2.2437953643       -0.8490813818
   H         -1.2450470943        1.8317718762       -0.1470997311
   O         -1.9636880471       -0.9895718427        0.5152484766
   H         -1.6106865723       -1.5682144133       -0.1606173194
   H         -2.0978575622       -0.1533758838        0.0691468070
    24
 Energy=    -280.074377504545
   O          0.0468884283       -2.4275386623       -1.0783974184
   H          0.4143200962       -2.2774908612       -0.2073569677
   H          0.8067993066       -2.4415320682       -1.6602663742
   O         -0.1954650226       -0.1502154271        2.4173798284
   H         -0.8885518687       -0.4662782981        1.8377534614
   H         -0.5293958532       -0.3099662437        3.3001038605
   O          0.1535360416        2.1222393629        0.8734671156
   H          0.0930396436        1.4506833232        1.5528672270
   H          0.9134656867        1.8667840456        0.3505126668
   O         -0.0867131064        0.1103567327       -2.2319810136
   H         -0.7898353671        0.6560736322       -1.8797822173
   H         -0.2574790153       -0.7611303206       -1.8747959631
   O          2.0330903913        0.9629995614       -0.7933319686
   H          1.3283945582        0.6859547027       -1.3788930406
   H          2.6986728114        1.3295546503       -1.3754567395
   O          1.9558190844       -1.1975138326        1.0384647700
   H          2.1544873226       -0.4624942788        0.4583707891
   H          1.3612404429       -0.8322394703        1.6936614727
   O         -1.9304398852        1.5082767798       -0.7293635073
   H         -2.5183379490        2.2533774721       -0.8535917846
   H         -1.2425160017        1.8390548356       -0.1518010013
   O         -1.9668676078       -0.9810976868        0.5202699925
   H         -1.5984106445       -1.5488464155       -0.1565850047
   H         -2.1034663471       -0.1416139523        0.0811348379
    24
 Energy=    -278.935247229941
   O          0.0211735854       -2.4233725517       -1.0268673807
   H          0.3234825154       -2.4027191330       -0.1188945908
   H          0.8236766321       -2.3932385648       -1.5477441827
   O         -0.1737947699       -0.1516021324        2.4112004616
   H         -0.8694857489       -0.4663979291        1.8340094117
   H         -0.5059548638       -0.3084846455        3.2951062197
   O          0.1562572902        2.1240368783        0.8685589295
   H          0.0997744826        1.4523629632        1.5481880079
   H          0.9152420565        1.8706616367        0.3432257481
   O         -0.0860408094        0.0985853496       -2.2311416539
   H         -0.7916545091        0.6413983295       -1.8794383478
   H         -0.2602774718       -0.7761752579       -1.8837696558
   O          2.0328162323        0.9695478482       -0.8061625829
   H          1.3298790717        0.6825030424       -1.3890145948
   H          2.6950923480        1.3367821192       -1.3916206743
   O          1.9494648098       -1.2052183659        0.9922089783
   H          2.1444593675       -0.4649390547        0.4175825746
   H          1.3501805942       -0.8486816091        1.6479313357
   O         -1.9269151635        1.5058760172       -0.7348833393
   H         -2.5134337908        2.2520573313       -0.8591459096
   H         -1.2377014406        1.8357715178       -0.1583547253
   O         -1.9620264216       -0.9648411625        0.5382556663
   H         -1.5683953129       -1.5278255202       -0.1283289144
   H         -2.1098399828       -0.1312653204        0.0915630353
    24
 Energy=    -274.983426942054
   O         -0.0308818581       -2.4178321021       -0.9283365934
   H          0.1303051015       -2.6328610636       -0.0096347104
   H          0.8420909782       -2.3242622906       -1.3096435007
   O         -0.1351311605       -0.1517242471        2.4065006953
   H         -0.8342218034       -0.4644896887        1.8323213753
   H         -0.4651183955       -0.3050103524        3.2918501374
   O          0.1565947497        2.1263941006        0.8559429596
   H          0.1062123306        1.4538176418        1.5351589481
   H          0.9140232420        1.8766656391        0.3266324509
   O         -0.0848575533        0.0733688158       -2.2325700254
   H         -0.7960353559        0.6100621756       -1.8826868870
   H         -0.2655836242       -0.8076890734       -1.9049926708
   O          2.0337201520        0.9798095101       -0.8275179995
   H          1.3342250282        0.6754715484       -1.4057193629
   H          2.6903447744        1.3482791563       -1.4185392048
   O          1.9486322347       -1.2140727264        0.9030819088
   H          2.1375863180       -0.4630841419        0.3404591753
   H          1.3353027935       -0.8765738156        1.5558861076
   O         -1.9170358329        1.5039378170       -0.7401840456
   H         -2.5019005883        2.2512722877       -0.8653089701
   H         -1.2264910163        1.8332910013       -0.1649395964
   O         -1.9559812654       -0.9357125768        0.5664591433
   H         -1.5183551250       -1.4883242076       -0.0811021177
   H         -2.1233361197       -0.1132622750        0.1062421359
    24
 Energy=    -274.473193515006
   O         -0.0469948686       -2.4230294997       -0.9112948765
   H          0.0809245989       -2.6869371172       -0.0001301169
   H          0.8392413814       -2.3188271433       -1.2576458807
   O         -0.1271189629       -0.1513715876        2.4046562030
   H         -0.8273975333       -0.4632321029        1.8314330502
   H         -0.4564039018       -0.3035421420        3.2904594494
   O          0.1574247136        2.1268379191        0.8537500656
   H          0.1085330260        1.4541343831        1.5329491495
   H          0.9144551362        1.8779184778        0.3234898550
   O         -0.0855962051        0.0682131748       -2.2332837039
   H         -0.7975243400        0.6042367254       -1.8839000695
   H         -0.2682858799       -0.8139089115       -1.9096837229
   O          2.0336074997        0.9829255828       -0.8327487971
   H          1.3343380620        0.6758862892       -1.4097938262
   H          2.6891562950        1.3512603254       -1.4250469775
   O          1.9559835664       -1.2120020842        0.8913418751
   H          2.1436735190       -0.4589442446        0.3310667534
   H          1.3405698253       -0.8780703141        1.5440189317
   O         -1.9162944642        1.5042740431       -0.7423332328
   H         -2.5005897042        2.2520461465       -0.8675042917
   H         -1.2253068528        1.8332382623       -0.1673980162
   O         -1.9548259382       -0.9294813319        0.5717962599
   H         -1.5087622363       -1.4787295391       -0.0728628909
   H         -2.1255868472       -0.1083885581        0.1104079108
    24
 Energy=    -274.344506341514
   O         -0.0554514194       -2.4261850924       -0.9031115494
   H          0.0557473035       -2.7139727995        0.0030037411
   H          0.8370118825       -2.3172428167       -1.2315513083
   O         -0.1231987339       -0.1511753064        2.4036765261
   H         -0.8240602554       -0.4625493492        1.8309015501
   H         -0.4521582760       -0.3028145270        3.2896917667
   O          0.1578426497        2.1270463870        0.8526637637
   H          0.1096876208        1.4542749367        1.5318482076
   H          0.9146700251        1.8785258056        0.3219268379
   O         -0.0860529526        0.0655661573       -2.2336289259
   H         -0.7983107177        0.6013367174       -1.8845291937
   H         -0.2698264901       -0.8170581392       -1.9120181702
   O          2.0335420367        0.9845401495       -0.8353906237
   H          1.3343377272        0.6761945275       -1.4118176798
   H          2.6885325377        1.3527874209       -1.4283604633
   O          1.9604021743       -1.2105512126        0.8861420204
   H          2.1474338468       -0.4564906217        0.3269965843
   H          1.3438683889       -0.8784078869        1.5386745811
   O         -1.9160517594        1.5046328417       -0.7434388917
   H         -2.5000463163        2.2526385010       -0.8686176881
   H         -1.2248273763        1.8333804834       -0.1686644313
   O         -1.9542370280       -0.9264277542        0.5742808262
   H         -1.5041792639       -1.4738805682       -0.0691282703
   H         -2.1266001140       -0.1058604025        0.1125536038
    24
 Energy=    -274.304349441242
   O         -0.0617911240       -2.4285543245       -0.8969742012
   H          0.0368412255       -2.7340163662        0.0047998507
   H          0.8351595237       -2.3163006989       -1.2117924014
   O         -0.1202799881       -0.1510367799        2.4029209805
   H         -0.8215690658       -0.4620451733        1.8304707655
   H         -0.4490048441       -0.3022883149        3.2890895774
   O          0.1581539692        2.1272024315        0.8518495171
   H          0.1105489131        1.4543790540        1.5310212931
   H          0.9148284885        1.8789798292        0.3207553149
   O         -0.0863830177        0.0635506022       -2.2338703909
   H         -0.7988838891        0.5991408064       -1.8849900656
   H         -0.2709836785       -0.8194461310       -1.9137591521
   O          2.0334881776        0.9857539662       -0.8373762896
   H          1.3343313250        0.6764174049       -1.4133297836
   H          2.6880500572        1.3539375306       -1.4308587650
   O          1.9637479456       -1.2094430009        0.8822821981
   H          2.1502711600       -0.4546381258        0.3239717729
   H          1.3463453135       -0.8786499676        1.5346791624
   O         -1.9158918750        1.5049483452       -0.7442687189
   H         -2.4996583245        2.2531316434       -0.8694498861
   H         -1.2244864095        1.8335297622       -0.1696170203
   O         -1.9537757986       -0.9241647289        0.5761358947
   H         -1.5007619002       -1.4702590355       -0.0663524368
   H         -2.1273205197       -0.1039763881        0.1141779361
    24
 Energy=    -274.301627918331
   O         -0.0638984667       -2.4293072335       -0.8948811911
   H          0.0304888502       -2.7406914618        0.0053203067
   H          0.8345306178       -2.3159730242       -1.2050623916
   O         -0.1192949102       -0.1509923019        2.4026645252
   H         -0.8207290300       -0.4618789042        1.8303258701
   H         -0.4479387511       -0.3021114241        3.2888857598
   O          0.1582594269        2.1272554776        0.8515751991
   H          0.1108407067        1.4544151873        1.5307432553
   H          0.9148824529        1.8791336575        0.3203605542
   O         -0.0864800243        0.0628663920       -2.2339503009
   H         -0.7990653786        0.5983909210       -1.8851417121
   H         -0.2713524874       -0.8202568327       -1.9143452597
   O          2.0334680590        0.9861603309       -0.8380466201
   H          1.3343302701        0.6764867280       -1.4138421149
   H          2.6878862493        1.3543233523       -1.4317002749
   O          1.9648257800       -1.2090986556        0.8809407442
   H          2.1511778428       -0.4540419553        0.3229137485
   H          1.3471361171       -0.8787604345        1.5332964601
   O         -1.9158376877        1.5050550625       -0.7445486267
   H         -2.4995277550        2.2532977332       -0.8697310982
   H         -1.2243716968        1.8335811512       -0.1699381216
   O         -1.9536132803       -0.9234082931        0.5767816401
   H         -1.4995952353       -1.4690507548       -0.0653817028
   H         -2.1275551191       -0.1033564036        0.1147308040
    24
 Energy=    -274.304344676410
   O         -0.0660046651       -2.4300601456       -0.8927862994
   H          0.0241350878       -2.7473453499        0.0057885523
   H          0.8338847929       -2.3156665233       -1.1983102798
   O         -0.1183098368       -0.1509478249        2.4024080716
   H         -0.8198889559       -0.4617125710        1.8301809731
   H         -0.4468726294       -0.3019345814        3.2886819179
   O          0.1583648867        2.1273085222        0.8513008833
   H          0.1111324996        1.4544513277        1.5304651767
   H          0.9149363871        1.8792874863        0.3199658002
   O         -0.0865770397        0.0621821640       -2.2340301917
   H         -0.7992469438        0.5976410442       -1.8852935642
   H         -0.2717210770       -0.8210672575       -1.9149314845
   O          2.0334479360        0.9865666968       -0.8387169568
   H          1.3343293158        0.6765560968       -1.4143543623
   H          2.6877224197        1.3547091153       -1.4325417624
   O          1.9659036103       -1.2087542951        0.8795992920
   H          2.1520843096       -0.4534458832        0.3218558113
   H          1.3479271892       -0.8788710313        1.5319136451
   O         -1.9157835002        1.5051617820       -0.7448285338
   H         -2.4993971775        2.2534638176       -0.8700123154
   H         -1.2242569922        1.8336325330       -0.1702592217
   O         -1.9534507601       -0.9226519028        0.5774273485
   H         -1.4984292363       -1.4678415573       -0.0644102427
   H         -2.1277890878       -0.1027366110        0.1152835378
    24
 Energy=    -274.343877651627
   O         -0.0721250841       -2.4321431289       -0.8865390527
   H          0.0054745712       -2.7667145862        0.0069216758
   H          0.8319647975       -2.3147311518       -1.1782028208
   O         -0.1154021696       -0.1508233264        2.4016466506
   H         -0.8174116407       -0.4612330387        1.8297547438
   H         -0.4437202715       -0.3014146105        3.2880784467
   O          0.1586772694        2.1274663109        0.8504923606
   H          0.1119970719        1.4545609894        1.5296471496
   H          0.9150969147        1.8797434246        0.3188021013
   O         -0.0868204457        0.0601509027       -2.2342614669
   H         -0.7997470552        0.5954017104       -1.8857301738
   H         -0.2727440555       -0.8234733860       -1.9166573615
   O          2.0333831896        0.9877569372       -0.8406961699
   H          1.3343301037        0.6767434414       -1.4158719940
   H          2.6872360449        1.3558413856       -1.4350210999
   O          1.9689320504       -1.2078274346        0.8755254598
   H          2.1546081430       -0.4517745864        0.3186230272
   H          1.3501283894       -0.8792836380        1.5277315950
   O         -1.9156229154        1.5054779313       -0.7456544631
   H         -2.4990128155        2.2539535460       -0.8708435946
   H         -1.2239194830        1.8337875458       -0.1712060332
   O         -1.9529516871       -0.9204417685        0.5793921022
   H         -1.4949498370       -1.4643150380       -0.0614417390
   H         -2.1284541976       -0.1009547879        0.1169293497
    24
 Energy=    -274.469966020046
   O         -0.0803522082       -2.4349514860       -0.8781321582
   H         -0.0195969640       -2.7924154733        0.0077347269
   H          0.8291175785       -2.3138172376       -1.1509380250
   O         -0.1115240556       -0.1506672936        2.4005949172
   H         -0.8140971747       -0.4605995428        1.8291363857
   H         -0.4395273156       -0.3007435972        3.2872305833
   O          0.1590935858        2.1276779585        0.8494067247
   H          0.1131515734        1.4547064949        1.5285463131
   H          0.9153085003        1.8803540186        0.3172397285
   O         -0.0871306403        0.0573811842       -2.2345539900
   H         -0.8003974591        0.5923641175       -1.8863076028
   H         -0.2741215690       -0.8267419301       -1.9189711145
   O          2.0332902738        0.9893610827       -0.8433620580
   H          1.3343234177        0.6769858710       -1.4179043986
   H          2.6865636181        1.3573701514       -1.4383705478
   O          1.9730434016       -1.2065536787        0.8700986585
   H          2.1580211878       -0.4495088334        0.3143125838
   H          1.3530848430       -0.8798261334        1.5221203889
   O         -1.9154377892        1.5059682527       -0.7467659044
   H         -2.4985234488        2.2546805035       -0.8719574339
   H         -1.2234919832        1.8340560070       -0.1724826406
   O         -1.9522472691       -0.9175091698        0.5820221640
   H         -1.4902884107       -1.4595954519       -0.0574841423
   H         -2.1292911768       -0.0985785668        0.1191615346
    24
 Energy=    -274.968478351377
   O         -0.0979718977       -2.4419204318       -0.8614739739
   H         -0.0712816144       -2.8445557104        0.0065146788
   H          0.8214443611       -2.3145313865       -1.0953064231
   O         -0.1038914057       -0.1502965036        2.3983425672
   H         -0.8075517120       -0.4592073707        1.8276692021
   H         -0.4313339936       -0.2994183924        3.2853464307
   O          0.1599355021        2.1280725200        0.8472455507
   H          0.1154591445        1.4549563662        1.5263393124
   H          0.9157315429        1.8815415655        0.3141164171
   O         -0.0879306325        0.0516456188       -2.2352305946
   H         -0.8018097994        0.5862344135       -1.8876342835
   H         -0.2772945560       -0.8334388280       -1.9237845052
   O          2.0330838003        0.9926978163       -0.8487985682
   H          1.3341904260        0.6777052462       -1.4219997302
   H          2.6851643996        1.3605117090       -1.4452343756
   O          1.9829369385       -1.2030381524        0.8602630090
   H          2.1664584450       -0.4439931858        0.3067267090
   H          1.3603611246       -0.8801020915        1.5116795398
   O         -1.9153400831        1.5073897688       -0.7490772999
   H         -2.4977810509        2.2566078175       -0.8742438873
   H         -1.2228784396        1.8349855449       -0.1751350382
   O         -1.9506424858       -0.9116684436        0.5869443949
   H         -1.4810415317       -1.4498493890       -0.0502902981
   H         -2.1307125240       -0.0935613879        0.1237948870
    24
 Energy=    -276.819723733290
   O         -0.1436476568       -2.4671799168       -0.8280917853
   H         -0.1892700919       -2.9611764493       -0.0094845172
   H          0.7925029114       -2.3318938743       -0.9748965549
   O         -0.0893800551       -0.1485975197        2.3929636157
   H         -0.7955487540       -0.4548546729        1.8239608348
   H         -0.4156298487       -0.2956877567        3.2807458944
   O          0.1623359890        2.1286102645        0.8433964217
   H          0.1209788513        1.4552232050        1.5224187301
   H          0.9172165623        1.8837239829        0.3082162005
   O         -0.0907810097        0.0395982682       -2.2382762524
   H         -0.8054787346        0.5741086366       -1.8922449413
   H         -0.2859957944       -0.8472157983       -1.9354828587
   O          2.0322868392        1.0001263143       -0.8604088808
   H          1.3327007888        0.6816596866       -1.4308387233
   H          2.6822931897        1.3669792645       -1.4596938691
   O          2.0160735771       -1.1885007607        0.8464618521
   H          2.1969022259       -0.4249173375        0.2983074982
   H          1.3872590934       -0.8740998369        1.4960588380
   O         -1.9171245523        1.5120700671       -0.7547592785
   H         -2.4980350329        2.2625009128       -0.8797728756
   H         -1.2235097557        1.8383889430       -0.1814824298
   O         -1.9461391688       -0.8989515489        0.5949472339
   H         -1.4618134025       -1.4267493503       -0.0399463579
   H         -2.1325556101       -0.0807922436        0.1344083087
    24
 Energy=    -278.719077651473
   O         -0.2031475611       -2.5081050088       -0.7927190732
   H         -0.3235220829       -3.0911576337       -0.0431915880
   H          0.7430997860       -2.3722161245       -0.8415249062
   O         -0.0777796077       -0.1453198083        2.3860807148
   H         -0.7872938025       -0.4481518991        1.8194113473
   H         -0.4022968610       -0.2897057506        3.2749412731
   O          0.1671702531        2.1288411803        0.8415103854
   H          0.1294711511        1.4554251590        1.5207168929
   H          0.9210459574        1.8857338595        0.3041072842
   O         -0.0943742057        0.0278185112       -2.2439246890
   H         -0.8092809261        0.5630615327       -1.8994611509
   H         -0.2962418290       -0.8603733843       -1.9496519253
   O          2.0299948548        1.0074224454       -0.8722530743
   H          1.3284735713        0.6890236319       -1.4403392688
   H          2.6789531938        1.3723819934       -1.4738255492
   O          2.0673361347       -1.1636377657        0.8379493873
   H          2.2464545952       -0.3945874770        0.2969225205
   H          1.4317041224       -0.8587746365        1.4854540262
   O         -1.9225143281        1.5175630290       -0.7624313210
   H         -2.5015228897        2.2695153646       -0.8871253894
   H         -1.2275890543        1.8421340548       -0.1897496004
   O         -1.9390703738       -0.8834662398        0.6002752719
   H         -1.4402717171       -1.3969699386       -0.0351345891
   H         -2.1330258769       -0.0632002452        0.1466489930
    24
 Energy=    -279.892462624723
   O         -0.2609358124       -2.5468259676       -0.7612932031
   H         -0.4519456085       -3.2090008147       -0.0970104547
   H          0.6860378532       -2.4183758647       -0.7067653411
   O         -0.0610943292       -0.1425162103        2.3807828542
   H         -0.7734970426       -0.4417736042        1.8158410643
   H         -0.3843556083       -0.2848433449        3.2704327697
   O          0.1684465674        2.1289963063        0.8364132019
   H          0.1338380289        1.4551141093        1.5153217920
   H          0.9212658941        1.8875601607        0.2967804667
   O         -0.0996441740        0.0150763646       -2.2496134627
   H         -0.8152180234        0.5507333438       -1.9071846284
   H         -0.3084238912       -0.8746499035       -1.9649557076
   O          2.0302722202        1.0176724254       -0.8858623873
   H          1.3272339817        0.6967223300       -1.4506279240
   H          2.6770296322        1.3810745825       -1.4907388724
   O          2.1159130305       -1.1413965416        0.8339110939
   H          2.2918362133       -0.3674010873        0.2989214579
   H          1.4737931970       -0.8460570736        1.4794252750
   O         -1.9244818229        1.5255243898       -0.7685635447
   H         -2.5019073174        2.2786970631       -0.8932333586
   H         -1.2284467298        1.8488360568       -0.1965176066
   O         -1.9364379464       -0.8711921963        0.6078170487
   H         -1.4241105133       -1.3726510583       -0.0264474475
   H         -2.1357337995       -0.0494020215        0.1592929006
    24
 Energy=    -282.396394789068
   O         -0.2942006805       -2.5567527644       -0.7440945158
   H         -0.5505074274       -3.2910196518       -0.1860704754
   H          0.6407615530       -2.4413718331       -0.5744929160
   O         -0.0391656208       -0.1464201310        2.3720222264
   H         -0.7566301991       -0.4429250834        1.8120568416
   H         -0.3586065695       -0.2831276071        3.2639305099
   O          0.1747877211        2.1326043651        0.8294006578
   H          0.1462976374        1.4587144380        1.5085858470
   H          0.9259391961        1.8941768695        0.2861183822
   O         -0.0984391005        0.0027934349       -2.2463302378
   H         -0.8162700462        0.5364044874       -1.9054346265
   H         -0.3126067653       -0.8895959547       -1.9742912173
   O          2.0273871770        1.0280647222       -0.9035223084
   H          1.3272006434        0.6908531492       -1.4623237161
   H          2.6676752958        1.3924842493       -1.5146371692
   O          2.1341564886       -1.1359707348        0.8272390963
   H          2.3024480139       -0.3608320337        0.2914501485
   H          1.4920070255       -0.8452806809        1.4748309428
   O         -1.9252853894        1.5257140879       -0.7771543470
   H         -2.4999300151        2.2811178789       -0.9011725175
   H         -1.2266201965        1.8467036012       -0.2070100489
   O         -1.9432574492       -0.8589310396        0.6359569770
   H         -1.4217152179       -1.3643234647        0.0124154486
   H         -2.1351732702       -0.0396094082        0.1797637920
    24
 Energy=    -285.525533308435
   O         -0.3173517271       -2.5352172933       -0.7205820655
   H         -0.6167559409       -3.3299463281       -0.2790000029
   H          0.5914716909       -2.4318116410       -0.4384843767
   O         -0.0110684902       -0.1416187529        2.3764150733
   H         -0.7383170250       -0.4339562001        1.8269787935
   H         -0.3219581529       -0.2674092896        3.2729395841
   O          0.1702186027        2.1295657975        0.8153208723
   H          0.1497089823        1.4557026268        1.4948204107
   H          0.9185812203        1.8945166674        0.2667434949
   O         -0.0973869804       -0.0156373408       -2.2437842384
   H         -0.8179333177        0.5143487290       -1.9029623176
   H         -0.3128475014       -0.9106453800       -1.9815453898
   O          2.0308831949        1.0318106700       -0.9091794196
   H          1.3319649544        0.6782901823       -1.4594233636
   H          2.6634206997        1.3954451184       -1.5287745559
   O          2.1289728545       -1.1375519495        0.8040034257
   H          2.2912529882       -0.3643863855        0.2635295514
   H          1.4927167124       -0.8449686242        1.4565407499
   O         -1.9117209836        1.5200721553       -0.7721176044
   H         -2.4867911161        2.2746806588       -0.8989725967
   H         -1.2119454912        1.8442497927       -0.2051476231
   O         -1.9532045142       -0.8554741611        0.6438985225
   H         -1.4257472373       -1.3691126903        0.0321828022
   H         -2.1362927724       -0.0401832380        0.1769817842
    24
 Energy=    -289.578262182671
   O         -0.3107062065       -2.4947510496       -0.7082247719
   H         -0.6282339766       -3.3353657796       -0.3784144763
   H          0.5607793065       -2.3998628488       -0.3238537663
   O          0.0059408067       -0.1432914264        2.3699168704
   H         -0.7327970658       -0.4321171749        1.8341203766
   H         -0.2936504728       -0.2552983203        3.2720983161
   O          0.1769658143        2.1313334082        0.8093146434
   H          0.1658969611        1.4586423315        1.4901935135
   H          0.9225182634        1.8998973159        0.2554006421
   O         -0.0861514910       -0.0312858203       -2.2330105069
   H         -0.8089851864        0.4939794461       -1.8897326476
   H         -0.2989368759       -0.9287388123       -1.9770176413
   O          2.0296069774        1.0328778849       -0.9199539195
   H          1.3347455895        0.6603396275       -1.4627381661
   H          2.6550617971        1.3962655791       -1.5468410642
   O          2.0933010337       -1.1573584469        0.7750943204
   H          2.2496771512       -0.3888240552        0.2263382373
   H          1.4706832456       -0.8568652153        1.4371235854
   O         -1.9067556826        1.5069511224       -0.7754602079
   H         -2.4809485450        2.2619044115       -0.9042232770
   H         -1.2050731891        1.8325122329       -0.2116486422
   O         -1.9615878080       -0.8442920545        0.6763929648
   H         -1.4303761134       -1.3736305305        0.0815427707
   H         -2.1301759923       -0.0357760906        0.1925419545
    24
 Energy=    -294.405106150734
   O         -0.2691894542       -2.4384696928       -0.6908005985
   H         -0.5679889068       -3.3124195316       -0.4394792775
   H          0.5668073268       -2.3309922029       -0.2371599794
   O          0.0296241647       -0.1400334949        2.3813611967
   H         -0.7190585596       -0.4241036455        1.8569470780
   H         -0.2600907745       -0.2415364421        3.2880001799
   O          0.1759543988        2.1340035697        0.7942546236
   H          0.1667293617        1.4597673001        1.4736309491
   H          0.9206666600        1.9044554809        0.2384280653
   O         -0.0746131094       -0.0357092670       -2.2264336341
   H         -0.7986419315        0.4840981354       -1.8774144811
   H         -0.2753154656       -0.9338760339       -1.9632856469
   O          2.0332481309        1.0334459224       -0.9317450940
   H          1.3420599679        0.6500671685       -1.4716631381
   H          2.6573595259        1.3942580984       -1.5614524707
   O          2.0155058281       -1.2063905792        0.7347993423
   H          2.1732701432       -0.4438709478        0.1781072617
   H          1.4165972554       -0.8899702979        1.4111266057
   O         -1.8888907747        1.4978315655       -0.7723009913
   H         -2.4658670376        2.2497098765       -0.9064994911
   H         -1.1893558052        1.8295818434       -0.2094294078
   O         -1.9828339801       -0.8426883421        0.7040404509
   H         -1.4441276227       -1.3836494574        0.1266425186
   H         -2.1439274048       -0.0433542480        0.2026965026
    24
 Energy=    -298.285665454758
   O         -0.2212599551       -2.3685497930       -0.6693631170
   H         -0.4808395742       -3.2678213194       -0.4689610633
   H          0.5829717322       -2.2335531380       -0.1681454634
   O          0.0338892327       -0.1360683109        2.3846369403
   H         -0.7270226712       -0.4155689266        1.8755943877
   H         -0.2423435312       -0.2236688613        3.2969161978
   O          0.1869568013        2.1364541070        0.7917115957
   H          0.1832328908        1.4636606519        1.4725690986
   H          0.9301154761        1.9085187336        0.2331487168
   O         -0.0616494097       -0.0359955233       -2.2249856238
   H         -0.7856847880        0.4782016537       -1.8677659797
   H         -0.2455672487       -0.9337626604       -1.9485435212
   O          2.0362671362        1.0252269378       -0.9340358252
   H          1.3472094897        0.6374937411       -1.4735674442
   H          2.6621440437        1.3822320746       -1.5641606296
   O          1.9268239691       -1.2579343427        0.6880413032
   H          2.0907380131       -0.5023384614        0.1237374043
   H          1.3609034317       -0.9205974603        1.3824256442
   O         -1.8820284836        1.4815414326       -0.7741322614
   H         -2.4605062059        2.2313759747       -0.9132132605
   H         -1.1833153804        1.8182683257       -0.2131983625
   O         -1.9848285312       -0.8430527110        0.7289977041
   H         -1.4407317293       -1.3957204130        0.1679728193
   H         -2.1380361054       -0.0526686573        0.2112600034
    24
 Energy=    -300.214872255209
   O         -0.1803788262       -2.3151253189       -0.6975157414
   H         -0.3658741267       -3.2270815389       -0.4735532751
   H          0.6141139926       -2.1043738022       -0.2070090655
   O          0.0348503577       -0.1319108569        2.3913560610
   H         -0.7361036996       -0.4085182581        1.8960278596
   H         -0.2289786678       -0.2081232289        3.3083172160
   O          0.1885017187        2.1356971530        0.7861650095
   H          0.1862799597        1.4649443719        1.4690395298
   H          0.9311585542        1.9067827730        0.2273350969
   O         -0.0455359818       -0.0166891686       -2.2368518724
   H         -0.7686920445        0.4909088278       -1.8685837324
   H         -0.2015972531       -0.9112350767       -1.9340906827
   O          2.0391315089        1.0082196728       -0.9348740349
   H          1.3505596711        0.6318611369       -1.4830117154
   H          2.6762210282        1.3592048765       -1.5570943907
   O          1.8474981374       -1.3073220860        0.6804965313
   H          2.0257248534       -0.5605907074        0.1087804077
   H          1.3286892275       -0.9423069280        1.3973180497
   O         -1.8637327513        1.4636706381       -0.7630919540
   H         -2.4458940966        2.2092152829       -0.9096634064
   H         -1.1680824013        1.8087781545       -0.2034463226
   O         -1.9958732845       -0.8392038135        0.7610277470
   H         -1.4447163182       -1.4047343839        0.2200720996
   H         -2.1441827399       -0.0621110201        0.2221743941
    24
 Energy=    -301.751008097870
   O         -0.2116972201       -2.3169601998       -0.7323231859
   H         -0.3601548631       -3.2357757263       -0.5087830406
   H          0.5719076017       -2.0736309586       -0.2393868782
   O          0.0236909520       -0.1237257538        2.3945347419
   H         -0.7545984262       -0.3982676450        1.9096386357
   H         -0.2306629367       -0.1913834011        3.3148381604
   O          0.2091499540        2.1388562773        0.7987115058
   H          0.2092559726        1.4706266501        1.4840588586
   H          0.9510913306        1.9090130918        0.2393127716
   O         -0.0416983997       -0.0097626811       -2.2532098549
   H         -0.7639384204        0.4947609482       -1.8789678209
   H         -0.1838212832       -0.9023335939       -1.9380113595
   O          2.0405625706        0.9947623124       -0.9284405066
   H          1.3504805458        0.6330330522       -1.4844716040
   H          2.6872968683        1.3411008262       -1.5432707451
   O          1.8657288794       -1.2949988606        0.6994171720
   H          2.0548541657       -0.5507285399        0.1279933750
   H          1.3642237895       -0.9202769038        1.4235082850
   O         -1.8760271135        1.4477621342       -0.7711473820
   H         -2.4574169412        2.1934589263       -0.9199895883
   H         -1.1801811205        1.7937758825       -0.2123051145
   O         -1.9899443736       -0.8409325094        0.7770292719
   H         -1.4472638251       -1.4179648553        0.2396622335
   H         -2.1273164425       -0.0654192609        0.2330256359
    24
 Energy=    -302.491925220025
   O         -0.2130338752       -2.3162641705       -0.7285882169
   H         -0.3405735908       -3.2416376335       -0.5196637928
   H          0.5624308072       -2.0619656624       -0.2283696294
   O          0.0224153534       -0.1128025108        2.4058701243
   H         -0.7595136505       -0.3858483513        1.9260109348
   H         -0.2271500635       -0.1769229896        3.3277364416
   O          0.2132375233        2.1371510583        0.7994588723
   H          0.2124986126        1.4699901329        1.4858462218
   H          0.9550724792        1.9056756408        0.2405922788
   O         -0.0460149144       -0.0055073368       -2.2709535810
   H         -0.7686132684        0.4969463145       -1.8946242211
   H         -0.1797145962       -0.8966892391       -1.9482291598
   O          2.0452986295        0.9845398735       -0.9221455018
   H          1.3532589801        0.6373692306       -1.4849825194
   H          2.7005342944        1.3263352419       -1.5304825709
   O          1.8596369805       -1.2891428919        0.6923536428
   H          2.0596948087       -0.5445720477        0.1250592189
   H          1.3658610635       -0.9107245436        1.4198264859
   O         -1.8730821121        1.4412531751       -0.7683562466
   H         -2.4560335513        2.1850178663       -0.9207161615
   H         -1.1787915965        1.7909742623       -0.2098871954
   O         -1.9909027034       -0.8453520994        0.7762751178
   H         -1.4558984071       -1.4272395202        0.2364517462
   H         -2.1239404297       -0.0687102619        0.2328045486
    24
 Energy=    -303.570774964937
   O         -0.2077576553       -2.3158845310       -0.7277978282
   H         -0.2728359190       -3.2565260877       -0.5629035547
   H          0.5532113143       -2.0352132667       -0.2194852190
   O          0.0183061440       -0.0906998597        2.4280790291
   H         -0.7675356638       -0.3647172983        1.9552165370
   H         -0.2239895018       -0.1520115133        3.3520733695
   O          0.2176926950        2.1329471778        0.7983694869
   H          0.2090425323        1.4699773084        1.4887519657
   H          0.9602084713        1.8926283042        0.2441592372
   O         -0.0470106272        0.0067264978       -2.3091985485
   H         -0.7713224721        0.5028970253       -1.9278601174
   H         -0.1560220257       -0.8798217548       -1.9651338008
   O          2.0463110631        0.9491601891       -0.9252373998
   H          1.3531935753        0.6489192492       -1.5131790347
   H          2.7309816467        1.2762750923       -1.5087216516
   O          1.8295763928       -1.2687703200        0.6912149060
   H          2.0657266430       -0.5209197970        0.1424121230
   H          1.3522802265       -0.8852836233        1.4269853614
   O         -1.8579330370        1.4287054123       -0.7582702768
   H         -2.4452904713        2.1670644956       -0.9197290902
   H         -1.1668126374        1.7888937585       -0.2025286205
   O         -1.9885605421       -0.8507898105        0.7858730253
   H         -1.4760413323       -1.4434999162        0.2360997720
   H         -2.1147853182       -0.0709780701        0.2453244193
    24
 Energy=    -304.015978347500
   O         -0.2068261838       -2.3082146782       -0.7380343820
   H         -0.2306605169       -3.2573763160       -0.6165603109
   H          0.5507775970       -2.0200579250       -0.2288840732
   O          0.0145831952       -0.0787478633        2.4483941366
   H         -0.7637515024       -0.3610411997        1.9680427957
   H         -0.2332319238       -0.1502570978        3.3701890901
   O          0.2305612240        2.1348094412        0.7953480561
   H          0.2125724474        1.4758666909        1.4893961061
   H          0.9722449101        1.8834412757        0.2449380316
   O         -0.0630323537       -0.0007051207       -2.3347452189
   H         -0.7872292212        0.4920115467       -1.9487387128
   H         -0.1565621009       -0.8839622839       -1.9778967775
   O          2.0671954234        0.9502479088       -0.9231297818
   H          1.3732957699        0.6617970845       -1.5160304756
   H          2.7613094734        1.2660379807       -1.5016746427
   O          1.8020531802       -1.2750403689        0.7029703386
   H          2.0600958643       -0.5232886279        0.1695707388
   H          1.3218255337       -0.8941208849        1.4381666350
   O         -1.8565946552        1.4221553172       -0.7634435839
   H         -2.4426283141        2.1614211522       -0.9255621080
   H         -1.1622298136        1.7827795811       -0.2120458627
   O         -1.9808177478       -0.8516407616        0.7969532046
   H         -1.4798184695       -1.4477416168        0.2402707696
   H         -2.1099630521       -0.0713313528        0.2578144868
    24
 Energy=    -304.436161436881
   O         -0.2112970299       -2.3059718447       -0.7476517107
   H         -0.2132435293       -3.2595864914       -0.6649041618
   H          0.5476928505       -2.0224067771       -0.2379880433
   O          0.0097807807       -0.0707889618        2.4608914771
   H         -0.7603020415       -0.3611721325        1.9721360156
   H         -0.2444633447       -0.1525842074        3.3800766067
   O          0.2359261132        2.1328976091        0.7878676129
   H          0.2125802041        1.4784196360        1.4859688887
   H          0.9770628588        1.8735340210        0.2404384453
   O         -0.0583883997       -0.0003488069       -2.3359841524
   H         -0.7825357647        0.4910677501       -1.9482313946
   H         -0.1451048837       -0.8818689368       -1.9731696656
   O          2.0636125849        0.9436702821       -0.9296320940
   H          1.3719665315        0.6541224622       -1.5246275871
   H          2.7617787244        1.2541037691       -1.5061968620
   O          1.7898221003       -1.2755895434        0.7116254432
   H          2.0617548747       -0.5211501498        0.1890303729
   H          1.3034700012       -0.8973430621        1.4441710563
   O         -1.8508824369        1.4227438198       -0.7622974568
   H         -2.4360069527        2.1628030460       -0.9240796647
   H         -1.1533690054        1.7834793820       -0.2149614476
   O         -1.9732288142       -0.8516470194        0.8014118037
   H         -1.4777575615       -1.4483473849        0.2404405463
   H         -2.1090413358       -0.0725194808        0.2622021252
    24
 Energy=    -304.879919572714
   O         -0.2136039668       -2.2982923600       -0.7688764711
   H         -0.1755170661       -3.2546080702       -0.7844164380
   H          0.5493058102       -2.0360711208       -0.2536672575
   O         -0.0089424061       -0.0537513839        2.4676924401
   H         -0.7623111917       -0.3619160256        1.9640041768
   H         -0.2738533910       -0.1549737942        3.3819178137
   O          0.2479255899        2.1306867620        0.7809809431
   H          0.2211001853        1.4917386374        1.4932010859
   H          0.9849929501        1.8529773007        0.2370682650
   O         -0.0476815524       -0.0012438563       -2.3308290802
   H         -0.7711613123        0.4913137960       -1.9432780045
   H         -0.1304850517       -0.8802236193       -1.9610048022
   O          2.0601723302        0.9264705953       -0.9328003507
   H          1.3701270184        0.6219468521       -1.5221513477
   H          2.7577038669        1.2273204069       -1.5151842329
   O          1.7622093865       -1.2744386663        0.7258546579
   H          2.0570674144       -0.5190934065        0.2171856870
   H          1.2748649449       -0.8956398109        1.4574547279
   O         -1.8464541623        1.4220990984       -0.7627777655
   H         -2.4266195020        2.1666163834       -0.9219444422
   H         -1.1410658308        1.7786589124       -0.2228479175
   O         -1.9513655098       -0.8515497180        0.8119780410
   H         -1.4698876945       -1.4518917839        0.2427677482
   H         -2.1004164938       -0.0758421980        0.2713363041
    24
 Energy=    -305.009590606825
   O         -0.2214738153       -2.2991901778       -0.7842489687
   H         -0.1636458715       -3.2523982797       -0.8496865996
   H          0.5405575232       -2.0477938166       -0.2623869671
   O         -0.0025457112       -0.0392068200        2.4834291148
   H         -0.7465078877       -0.3556202442        1.9709501738
   H         -0.2735936889       -0.1515997905        3.3945452731
   O          0.2455543298        2.1336316457        0.7682184274
   H          0.2154947948        1.5004931801        1.4854798496
   H          0.9806463762        1.8473697610        0.2260693181
   O         -0.0438186694       -0.0028643889       -2.3229877723
   H         -0.7665441629        0.4937512909       -1.9392266911
   H         -0.1335930630       -0.8814058636       -1.9537489938
   O          2.0628298743        0.9250441080       -0.9299067065
   H          1.3704195388        0.6118570146       -1.5118977819
   H          2.7560620626        1.2216366813       -1.5195623845
   O          1.7603033342       -1.2806623534        0.7328628652
   H          2.0604222990       -0.5269901960        0.2247893212
   H          1.2728977136       -0.8991524564        1.4630120278
   O         -1.8417531488        1.4236413947       -0.7565095204
   H         -2.4192409093        2.1703515864       -0.9151399593
   H         -1.1352651994        1.7772009988       -0.2160446985
   O         -1.9569009110       -0.8579838097        0.8035188788
   H         -1.4796893886       -1.4604027766        0.2329118412
   H         -2.1135446585       -0.0858506647        0.2599151787
    24
 Energy=    -305.129109279001
   O         -0.2202898317       -2.3012474989       -0.7837042501
   H         -0.1613083575       -3.2543934714       -0.8490171956
   H          0.5393492535       -2.0492094029       -0.2586736812
   O         -0.0050879652       -0.0401984734        2.4774037525
   H         -0.7511121158       -0.3561766079        1.9676610477
   H         -0.2739964799       -0.1497240861        3.3895025360
   O          0.2469147791        2.1370977057        0.7706879291
   H          0.2182778654        1.5040423820        1.4880809346
   H          0.9819626243        1.8517347850        0.2280052330
   O         -0.0442766285       -0.0019191993       -2.3210721188
   H         -0.7665409557        0.4965234052       -1.9388142847
   H         -0.1382314509       -0.8807580394       -1.9535852150
   O          2.0648992313        0.9265442769       -0.9278627458
   H          1.3712732498        0.6150736310       -1.5093271681
   H          2.7574356077        1.2236560784       -1.5180743898
   O          1.7617830071       -1.2833757198        0.7314540172
   H          2.0589084415       -0.5311836126        0.2194429333
   H          1.2780463099       -0.8997696070        1.4629435919
   O         -1.8466303170        1.4229876813       -0.7589367713
   H         -2.4236448196        2.1700401980       -0.9176775700
   H         -1.1410710765        1.7756780760       -0.2166937597
   O         -1.9549077247       -0.8579122073        0.8062593612
   H         -1.4778818949       -1.4612831816        0.2365035671
   H         -2.1099390060       -0.0858755909        0.2620566372
    24
 Energy=    -305.242107334035
   O         -0.2188314001       -2.3054565940       -0.7862028159
   H         -0.1479393842       -3.2562456301       -0.8710931626
   H          0.5356027742       -2.0552175811       -0.2528723808
   O         -0.0073302360       -0.0363397919        2.4695810857
   H         -0.7541875723       -0.3546629862        1.9625245769
   H         -0.2737856719       -0.1439268461        3.3826300255
   O          0.2464624548        2.1435192549        0.7696157167
   H          0.2191756677        1.5126015826        1.4889419028
   H          0.9811127315        1.8571234066        0.2269388064
   O         -0.0428267548        0.0010611749       -2.3135076801
   H         -0.7640361506        0.5045518778       -1.9359021193
   H         -0.1477375812       -0.8781538637       -1.9499055977
   O          2.0687867724        0.9257603872       -0.9227521420
   H          1.3726160640        0.6156489416       -1.5018972672
   H          2.7593759185        1.2227840676       -1.5152851828
   O          1.7602131330       -1.2902894945        0.7295432350
   H          2.0536739653       -0.5416548490        0.2102564669
   H          1.2832822550       -0.9015635637        1.4627968940
   O         -1.8515967760        1.4236602930       -0.7596572295
   H         -2.4277284308        2.1712369663       -0.9191353594
   H         -1.1476692675        1.7751627871       -0.2145298137
   O         -1.9521895057       -0.8601329956        0.8086632090
   H         -1.4780182065       -1.4665952969        0.2398074311
   H         -2.1067401127       -0.0896047577        0.2621907171
    24
 Energy=    -305.309144411230
   O         -0.2202770653       -2.3100054459       -0.7906542891
   H         -0.1312257896       -3.2569567541       -0.8982876032
   H          0.5294886452       -2.0581934216       -0.2515124490
   O         -0.0055249272       -0.0300601553        2.4655559531
   H         -0.7521093853       -0.3517088765        1.9601990625
   H         -0.2701569398       -0.1371022065        3.3791990657
   O          0.2466178671        2.1483459229        0.7668342214
   H          0.2185384692        1.5188341740        1.4873606578
   H          0.9818059272        1.8608362938        0.2254761427
   O         -0.0404564825        0.0044578009       -2.3062763117
   H         -0.7605941482        0.5121508351       -1.9322691386
   H         -0.1538963389       -0.8748032682       -1.9453563602
   O          2.0717036086        0.9206885329       -0.9173660047
   H          1.3743751478        0.6136413669       -1.4967509335
   H          2.7624788821        1.2177075390       -1.5096843917
   O          1.7561245032       -1.2944122302        0.7295740162
   H          2.0482600773       -0.5485232710        0.2056099841
   H          1.2824567970       -0.9017647014        1.4628534051
   O         -1.8544022344        1.4249452902       -0.7592527134
   H         -2.4308619807        2.1720014496       -0.9199794866
   H         -1.1513118080        1.7773711612       -0.2136414069
   O         -1.9512731948       -0.8625527046        0.8083042080
   H         -1.4814429721       -1.4724607735        0.2395304838
   H         -2.1059977780       -0.0935417219        0.2597476913
    24
 Energy=    -305.324658592427
   O         -0.2201937576       -2.3105474777       -0.7909997287
   H         -0.1270490835       -3.2566879525       -0.9022387133
   H          0.5288139291       -2.0574586717       -0.2514023033
   O         -0.0055958535       -0.0291232078        2.4650804132
   H         -0.7525579631       -0.3512588370        1.9605924718
   H         -0.2694264843       -0.1355604722        3.3790258968
   O          0.2461071168        2.1490815768        0.7655179852
   H          0.2174577812        1.5193127052        1.4857972533
   H          0.9817625352        1.8618019608        0.2246729357
   O         -0.0410059810        0.0043143971       -2.3059392383
   H         -0.7610338443        0.5124221802       -1.9322840539
   H         -0.1555242690       -0.8750488235       -1.9456092119
   O          2.0736222881        0.9200477296       -0.9157694060
   H          1.3761599576        0.6144735294       -1.4957716005
   H          2.7648449046        1.2172272967       -1.5074850805
   O          1.7547090603       -1.2956166803        0.7292525339
   H          2.0465707213       -0.5501052166        0.2045990594
   H          1.2809328220       -0.9024637281        1.4621909162
   O         -1.8540191781        1.4254080200       -0.7584675252
   H         -2.4310199539        2.1719557356       -0.9196148278
   H         -1.1510979619        1.7786878416       -0.2131905575
   O         -1.9511700189       -0.8623542686        0.8083132467
   H         -1.4825411521       -1.4731405605        0.2394908396
   H         -2.1055507601       -0.0935184134        0.2594144814
    24
 Energy=    -305.379925477204
   O         -0.2234446706       -2.3164810076       -0.7961331070
   H         -0.1002306349       -3.2554076680       -0.9356568248
   H          0.5200927997       -2.0549584065       -0.2530034730
   O         -0.0033763729       -0.0205598179        2.4619723970
   H         -0.7515895123       -0.3467857153        1.9619867954
   H         -0.2627964417       -0.1245225731        3.3774639663
   O          0.2464969752        2.1543500530        0.7594189310
   H          0.2137422338        1.5236741577        1.4787289351
   H          0.9853068634        1.8678256339        0.2224873279
   O         -0.0383009878        0.0073516722       -2.2991130475
   H         -0.7571882428        0.5186648237       -1.9276405507
   H         -0.1599721328       -0.8723852657       -1.9420543794
   O          2.0797431168        0.9109629213       -0.9083669678
   H          1.3823851910        0.6141208549       -1.4930109201
   H          2.7743764436        1.2093094227       -1.4954834353
   O          1.7467424756       -1.3005419680        0.7298284200
   H          2.0380043509       -0.5575310610        0.2013086455
   H          1.2720362536       -0.9039996157        1.4603350973
   O         -1.8546735044        1.4274658414       -0.7560977135
   H         -2.4345590413        2.1713033901       -0.9194081707
   H         -1.1519756791        1.7855447750       -0.2136706828
   O         -1.9514547983       -0.8625742026        0.8074480534
   H         -1.4912473269       -1.4793094799        0.2381691052
   H         -2.1041008603       -0.0951191429        0.2561371147
    24
 Energy=    -305.388999892376
   O         -0.2248586290       -2.3176604318       -0.7949164911
   H         -0.0930242958       -3.2537001116       -0.9455195010
   H          0.5189086194       -2.0547190782       -0.2527873878
   O         -0.0046596349       -0.0179119759        2.4593177463
   H         -0.7544555945       -0.3446101028        1.9620188494
   H         -0.2614118899       -0.1204502600        3.3757215982
   O          0.2508349821        2.1547368048        0.7600980931
   H          0.2156289553        1.5230373995        1.4783934620
   H          0.9920684549        1.8695393188        0.2258068122
   O         -0.0379699834        0.0074055064       -2.3001328490
   H         -0.7568728247        0.5170695560       -1.9264309607
   H         -0.1575600649       -0.8730406830       -1.9441208266
   O          2.0838165674        0.9081235751       -0.9065402943
   H          1.3869023195        0.6135408475       -1.4928536812
   H          2.7793659234        1.2076279967       -1.4919803295
   O          1.7430363975       -1.2996220574        0.7309129547
   H          2.0352819821       -0.5563837639        0.2032566296
   H          1.2653845917       -0.9034753324        1.4597122170
   O         -1.8551830520        1.4258255923       -0.7583866007
   H         -2.4364763931        2.1687170984       -0.9209968765
   H         -1.1509662889        1.7856791915       -0.2191130359
   O         -1.9538432051       -0.8611655103        0.8091456167
   H         -1.4980296634       -1.4809844270        0.2396806347
   H         -2.1035189121       -0.0935516991        0.2572415855
    24
 Energy=    -305.398772983417
   O         -0.2267948306       -2.3170531694       -0.7943566252
   H         -0.0946403203       -3.2528352745       -0.9462739616
   H          0.5178695956       -2.0542287454       -0.2534037117
   O         -0.0049413161       -0.0179917551        2.4607480026
   H         -0.7551742395       -0.3441997683        1.9637865024
   H         -0.2612111910       -0.1206815821        3.3772699012
   O          0.2503419036        2.1535701376        0.7579727567
   H          0.2139752906        1.5211976192        1.4756177297
   H          0.9925386268        1.8689682074        0.2247020886
   O         -0.0362113879        0.0069632103       -2.3003742176
   H         -0.7554219073        0.5150236400       -1.9250841051
   H         -0.1531693113       -0.8737957276       -1.9442613457
   O          2.0833654353        0.9079192193       -0.9084927390
   H          1.3866232158        0.6133619980       -1.4950233545
   H          2.7789446623        1.2077814351       -1.4937140907
   O          1.7440484378       -1.2985777496        0.7317541220
   H          2.0372610025       -0.5547631570        0.2054480477
   H          1.2643855223       -0.9032626551        1.4596835853
   O         -1.8520354784        1.4254134556       -0.7569641998
   H         -2.4340104093        2.1678661253       -0.9191401939
   H         -1.1475329290        1.7858658145       -0.2184643438
   O         -1.9567547521       -0.8604056615        0.8091970090
   H         -1.5010600128       -1.4807649905        0.2402256146
   H         -2.1056657815       -0.0929359335        0.2568858993
    24
 Energy=    -305.400913115679
   O         -0.2270211940       -2.3161857534       -0.7937717637
   H         -0.0951655861       -3.2519472094       -0.9460755267
   H          0.5179256941       -2.0537439066       -0.2530220516
   O         -0.0060174208       -0.0185732631        2.4607548906
   H         -0.7563889538       -0.3445195259        1.9638309163
   H         -0.2621599276       -0.1214470973        3.3772917587
   O          0.2505222862        2.1534654421        0.7575040961
   H          0.2141441655        1.5211654049        1.4752123483
   H          0.9928160203        1.8688935283        0.2243524495
   O         -0.0358809570        0.0064205103       -2.3005016723
   H         -0.7551367849        0.5140622022       -1.9247320531
   H         -0.1520174901       -0.8743767522       -1.9442148104
   O          2.0837652758        0.9086831432       -0.9091808632
   H          1.3867411244        0.6137586704       -1.4951917230
   H          2.7789213389        1.2085101897       -1.4949228115
   O          1.7443663474       -1.2987542430        0.7315479438
   H          2.0379457130       -0.5548620350        0.2055561387
   H          1.2644806935       -0.9035317540        1.4593808803
   O         -1.8514976027        1.4249342211       -0.7568610130
   H         -2.4334293577        2.1674904019       -0.9187177113
   H         -1.1469743738        1.7851138926       -0.2182057762
   O         -1.9572737283       -0.8600759819        0.8099286245
   H         -1.5012216795       -1.4805000664        0.2413142349
   H         -2.1058886996       -0.0926911474        0.2574198499
    24
 Energy=    -305.403973813809
   O         -0.2278172534       -2.3148933318       -0.7925012782
   H         -0.0946050991       -3.2498971129       -0.9482391712
   H          0.5173716884       -2.0531069941       -0.2517673378
   O         -0.0073326424       -0.0189290051        2.4603427860
   H         -0.7579665335       -0.3444590392        1.9635422240
   H         -0.2630288453       -0.1224828997        3.3769276881
   O          0.2513583694        2.1533850805        0.7567235349
   H          0.2149667883        1.5214937286        1.4747909497
   H          0.9939169449        1.8687516151        0.2239736946
   O         -0.0350109577        0.0058559903       -2.3001427566
   H         -0.7542574341        0.5129989756       -1.9236824816
   H         -0.1499949626       -0.8749384515       -1.9434753064
   O          2.0852875870        0.9097449858       -0.9102683275
   H          1.3874733272        0.6141053806       -1.4949770777
   H          2.7793448113        1.2095745386       -1.4973106162
   O          1.7446697360       -1.2988272041        0.7311211261
   H          2.0392522031       -0.5550474829        0.2055312324
   H          1.2645934961       -0.9033876950        1.4587104598
   O         -1.8507314480        1.4237009887       -0.7569933661
   H         -2.4326547890        2.1664145895       -0.9181565515
   H         -1.1461763673        1.7833816224       -0.2180464114
   O         -1.9596595446       -0.8600099136        0.8111391654
   H         -1.5030339337       -1.4808951726        0.2434892851
   H         -2.1074228353       -0.0929470530        0.2579552738
    24
 Energy=    -305.406160984500
   O         -0.2288672194       -2.3142577756       -0.7908498124
   H         -0.0932549749       -3.2480189230       -0.9518817310
   H          0.5166145945       -2.0532239798       -0.2501557561
   O         -0.0087756502       -0.0195223895        2.4584514789
   H         -0.7599272366       -0.3444592645        1.9620452326
   H         -0.2635961346       -0.1239850505        3.3751771266
   O          0.2523577632        2.1526943726        0.7558341251
   H          0.2163723118        1.5215537255        1.4745819049
   H          0.9950977750        1.8679631495        0.2233895313
   O         -0.0340041246        0.0056800983       -2.2990967193
   H         -0.7532796957        0.5128806450       -1.9227696033
   H         -0.1485888514       -0.8748818620       -1.9417274221
   O          2.0869219947        0.9103086859       -0.9113695311
   H          1.3883098166        0.6138306082       -1.4946992956
   H          2.7797117556        1.2103789954       -1.4997843478
   O          1.7452637736       -1.2974072984        0.7310167628
   H          2.0413976396       -0.5540015963        0.2057696443
   H          1.2655951771       -0.9013227748        1.4585241015
   O         -1.8499967977        1.4228566935       -0.7569142096
   H         -2.4321590253        2.1655092379       -0.9174949651
   H         -1.1455166527        1.7823590121       -0.2177503679
   O         -1.9624500789       -0.8603145109        0.8124433604
   H         -1.5049948749       -1.4816659058        0.2459726900
   H         -2.1089761947       -0.0935220307        0.2585559803
    24
 Energy=    -305.407665077316
   O         -0.2289789415       -2.3134050569       -0.7889557111
   H         -0.0905728075       -3.2459151915       -0.9547882497
   H          0.5166240984       -2.0525376202       -0.2483485271
   O         -0.0087639265       -0.0195471744        2.4581952565
   H         -0.7601877531       -0.3439693696        1.9618644070
   H         -0.2629308238       -0.1253117199        3.3749530703
   O          0.2531284409        2.1525646270        0.7547522048
   H          0.2172711414        1.5218257520        1.4738589879
   H          0.9958773335        1.8676347055        0.2224263061
   O         -0.0335649175        0.0051584522       -2.2977548408
   H         -0.7527913254        0.5130983252       -1.9223320130
   H         -0.1487539410       -0.8749718071       -1.9395174118
   O          2.0889858687        0.9112454420       -0.9120902315
   H          1.3896321860        0.6140806927       -1.4941807556
   H          2.7806087589        1.2115941298       -1.5017344323
   O          1.7452649331       -1.2971744551        0.7300532654
   H          2.0427673418       -0.5541728038        0.2050078359
   H          1.2656796009       -0.9004352075        1.4572586824
   O         -1.8502212979        1.4222058576       -0.7567491776
   H         -2.4324509037        2.1649116656       -0.9168385558
   H         -1.1457179961        1.7814397790       -0.2174367195
   O         -1.9656472857       -0.8610637693        0.8122455917
   H         -1.5073342443       -1.4826608408        0.2467386714
   H         -2.1109666437       -0.0943532597        0.2579269842
    24
 Energy=    -305.408797070105
   O         -0.2292394827       -2.3139376493       -0.7890804137
   H         -0.0898754878       -3.2462063947       -0.9554670216
   H          0.5163040842       -2.0525353010       -0.2486496205
   O         -0.0086910688       -0.0196254179        2.4578517201
   H         -0.7601996454       -0.3439981227        1.9616168485
   H         -0.2626248200       -0.1256597531        3.3746429776
   O          0.2531864673        2.1525900668        0.7547012019
   H          0.2173415359        1.5217933261        1.4737578428
   H          0.9958570162        1.8676370901        0.2222783466
   O         -0.0334115295        0.0052604003       -2.2970368195
   H         -0.7526063708        0.5137832917       -1.9223434926
   H         -0.1493279224       -0.8746298527       -1.9384446103
   O          2.0890502575        0.9110858705       -0.9121826616
   H          1.3897846552        0.6138945190       -1.4943654147
   H          2.7806555294        1.2116562599       -1.5017345498
   O          1.7456484107       -1.2969527308        0.7302120028
   H          2.0433320906       -0.5540281358        0.2051602788
   H          1.2660189444       -0.9000969749        1.4573247341
   O         -1.8507861256        1.4224858829       -0.7567338286
   H         -2.4330337000        2.1651792285       -0.9168156715
   H         -1.1461470999        1.7817948096       -0.2176486973
   O         -1.9656113410       -0.8610247212        0.8120369393
   H         -1.5070659009       -1.4824895712        0.2465730947
   H         -2.1107423141       -0.0942016395        0.2578247037
    24
 Energy=    -305.411271336472
   O         -0.2301072800       -2.3149428196       -0.7846979591
   H         -0.0874273988       -3.2457745018       -0.9562399972
   H          0.5168299008       -2.0528428612       -0.2465341368
   O         -0.0096681808       -0.0215594894        2.4549557268
   H         -0.7627551920       -0.3441933961        1.9599818327
   H         -0.2591835934       -0.1342886105        3.3721612894
   O          0.2530549606        2.1528084154        0.7543685733
   H          0.2161633661        1.5211264808        1.4725947102
   H          0.9958743103        1.8679151943        0.2221213505
   O         -0.0318683928        0.0020737215       -2.2947820888
   H         -0.7515399450        0.5129087551       -1.9241714234
   H         -0.1500626605       -0.8763486353       -1.9333459006
   O          2.0898565661        0.9118667113       -0.9114744539
   H          1.3912438974        0.6130355444       -1.4936016848
   H          2.7801192068        1.2154181084       -1.5010725170
   O          1.7477447310       -1.2967362812        0.7301104488
   H          2.0452875080       -0.5535331774        0.2053731028
   H          1.2653921280       -0.9004075502        1.4557076810
   O         -1.8501291008        1.4247415570       -0.7588350216
   H         -2.4335042317        2.1670296065       -0.9166759168
   H         -1.1453158596        1.7838118520       -0.2198186413
   O         -1.9688981968       -0.8583774850        0.8104414308
   H         -1.5096142939       -1.4805122533        0.2463151448
   H         -2.1112688443       -0.0913338350        0.2558186061
    24
 Energy=    -305.411346487458
   O         -0.2300028506       -2.3150062518       -0.7850284461
   H         -0.0883386840       -3.2463206194       -0.9547831297
   H          0.5167713341       -2.0528883583       -0.2466471993
   O         -0.0097079596       -0.0213071320        2.4551735280
   H         -0.7627035077       -0.3440609256        1.9601386470
   H         -0.2586473321       -0.1355375109        3.3723498739
   O          0.2529135879        2.1530016293        0.7544189785
   H          0.2159348605        1.5214556498        1.4727601854
   H          0.9957954441        1.8680057308        0.2223139837
   O         -0.0317834116        0.0022178473       -2.2951066481
   H         -0.7515214303        0.5127824545       -1.9242524904
   H         -0.1497448131       -0.8763418996       -1.9339284112
   O          2.0897626365        0.9116438926       -0.9111653655
   H          1.3912560521        0.6131035727       -1.4935690648
   H          2.7803766697        1.2149268040       -1.5004900407
   O          1.7473883109       -1.2968018972        0.7303893054
   H          2.0449076017       -0.5537353343        0.2054453135
   H          1.2650470367       -0.9002854642        1.4558915132
   O         -1.8500518368        1.4246694987       -0.7589797181
   H         -2.4333906898        2.1669315313       -0.9170768323
   H         -1.1453238789        1.7838456920       -0.2199223857
   O         -1.9685184727       -0.8584175957        0.8102983717
   H         -1.5093210499       -1.4805027664        0.2460470028
   H         -2.1110976751       -0.0913784158        0.2557229417
