    24
 Energy=    -305.518926824096
   O         -1.6216633912        1.6250716305       -0.0262591326
   H         -0.9487901940        1.7963823167        0.6326233677
   H         -1.1415828003        1.5784112599       -0.8530464547
   O          0.0378097542        1.1144575100       -2.1864430710
   H          0.3013179691        1.6123383498       -2.9603357832
   H          0.8145144208        1.1115430652       -1.6270208629
   O          0.4901175392        1.6200108367        1.7774498862
   H          0.3339238069        0.6990572612        1.9864471823
   H          0.6661240912        2.0315981689        2.6235287251
   O         -2.2210935442       -0.9576433526        0.4167026967
   H         -2.1148105704       -0.0175911527        0.2709713314
   H         -3.1627314219       -1.0762576530        0.5411237362
   O          2.0502952441        0.9474848588       -0.4121909307
   H          2.1119815931        0.0046902700       -0.2586819810
   H          1.6438054839        1.2938828132        0.3821681645
   O          0.0160912301       -1.0106906162        2.0614521651
   H          0.6590403022       -1.3937637297        1.4647082331
   H         -0.8223114500       -1.1186605403        1.6123917222
   O          1.6931662473       -1.7768249957       -0.0077095114
   H          0.9663723368       -1.7930091713       -0.6303976550
   H          2.1952893549       -2.5676788711       -0.2043166643
   O         -0.4447230793       -1.5618658709       -1.6230021031
   H         -0.3408799434       -0.6824120473       -1.9863331027
   H         -1.1612629798       -1.4785303497       -0.9938299471
    24
 Energy=    -305.518447429009
   O         -1.6209530605        1.6247897462       -0.0273358969
   H         -0.9487241348        1.7963956124        0.6321271711
   H         -1.1400962713        1.5780084213       -0.8536651871
   O          0.0395239758        1.1141146085       -2.1866776246
   H          0.3020029584        1.6139468982       -2.9596616515
   H          0.8161684960        1.1119599155       -1.6271684767
   O          0.4897718944        1.6192246070        1.7778160187
   H          0.3334029870        0.6983535398        1.9870457543
   H          0.6693248317        2.0303125237        2.6233923355
   O         -2.2213024184       -0.9572803561        0.4169872165
   H         -2.1146879909       -0.0173328055        0.2708235893
   H         -3.1631474023       -1.0757132180        0.5400056040
   O          2.0511980825        0.9483635211       -0.4112341758
   H          2.1126440166        0.0053961218       -0.2586932930
   H          1.6435053453        1.2938707569        0.3828963060
   O          0.0157013684       -1.0115415618        2.0620779824
   H          0.6585178166       -1.3934577281        1.4644502590
   H         -0.8228373312       -1.1189083311        1.6131269092
   O          1.6919495984       -1.7759964390       -0.0081377170
   H          0.9652932167       -1.7922084657       -0.6309856223
   H          2.1918343583       -2.5689720922       -0.2018815693
   O         -0.4458773892       -1.5617662348       -1.6235540180
   H         -0.3413298120       -0.6823683767       -1.9868184551
   H         -1.1620639060       -1.4778090298       -0.9940622381
    24
 Energy=    -305.517309155607
   O         -1.6223933885        1.6248480549       -0.0280925535
   H         -0.9504894496        1.7968838113        0.6315896695
   H         -1.1411469187        1.5776651231       -0.8541721176
   O          0.0394554301        1.1151691020       -2.1861744395
   H          0.3006184060        1.6203470472       -2.9561231284
   H          0.8164481988        1.1107611823       -1.6271622325
   O          0.4890143175        1.6204368706        1.7761762388
   H          0.3321982405        0.6997401330        1.9858380506
   H          0.6713636461        2.0313220802        2.6212525117
   O         -2.2218053061       -0.9575516322        0.4147324215
   H         -2.1155322320       -0.0174463471        0.2693366628
   H         -3.1638460982       -1.0767315766        0.5355096000
   O          2.0515070436        0.9462470657       -0.4114692016
   H          2.1133232809        0.0035004753       -0.2577179122
   H          1.6431697900        1.2925423864        0.3819865805
   O          0.0142790692       -1.0096942404        2.0618307614
   H          0.6574782309       -1.3931655977        1.4656123479
   H         -0.8239306677       -1.1179303712        1.6124743139
   O          1.6927690959       -1.7781592785       -0.0045790409
   H          0.9671322612       -1.7941624609       -0.6286198426
   H          2.1909463227       -2.5729235000       -0.1953698240
   O         -0.4427483443       -1.5613295174       -1.6226237174
   H         -0.3389788128       -0.6822685962       -1.9869252698
   H         -1.1600008761       -1.4775965858       -0.9943169119
    24
 Energy=    -305.516165269878
   O         -1.6236300170        1.6251555255       -0.0270676951
   H         -0.9519974255        1.7975816777        0.6327888984
   H         -1.1420012044        1.5771481711       -0.8528768867
   O          0.0388790598        1.1152312146       -2.1838927537
   H          0.2994311665        1.6218105966       -2.9531272883
   H          0.8162962519        1.1098567097       -1.6254794084
   O          0.4893947774        1.6223551559        1.7752706420
   H          0.3322739802        0.7017333941        1.9850335242
   H          0.6727658003        2.0330973439        2.6201953505
   O         -2.2220511309       -0.9584509586        0.4127622935
   H         -2.1161266163       -0.0181608158        0.2683106251
   H         -3.1642779682       -1.0784000896        0.5313060958
   O          2.0522073152        0.9453036433       -0.4108521935
   H          2.1139252714        0.0026646143       -0.2564035128
   H          1.6437071506        1.2922005959        0.3822568531
   O          0.0135573957       -1.0077023654        2.0606540612
   H          0.6568368558       -1.3919409296        1.4650165019
   H         -0.8246964450       -1.1172840396        1.6117061854
   O          1.6932869062       -1.7789346350       -0.0039698285
   H          0.9680115713       -1.7950151297       -0.6284287512
   H          2.1909179107       -2.5743196114       -0.1935956778
   O         -0.4415554334       -1.5628351330       -1.6232014766
   H         -0.3374538513       -0.6835376779       -1.9868368519
   H         -1.1590344179       -1.4793939672       -0.9951144456
    24
 Energy=    -305.514426044919
   O         -1.6221123480        1.6259011327       -0.0277799006
   H         -0.9497874952        1.7974157822        0.6316091024
   H         -1.1409957243        1.5762176867       -0.8537884899
   O          0.0387383192        1.1133467974       -2.1841929912
   H          0.2963798701        1.6242505912       -2.9515455730
   H          0.8169135817        1.1084262881       -1.6268323454
   O          0.4912226656        1.6230451995        1.7748110136
   H          0.3331986765        0.7026285425        1.9847953855
   H          0.6720792776        2.0343906700        2.6199841495
   O         -2.2229681132       -0.9572040029        0.4110279346
   H         -2.1165381445       -0.0168889390        0.2671110060
   H         -3.1653245930       -1.0767995521        0.5288965468
   O          2.0526525766        0.9431249793       -0.4116182116
   H          2.1146287004        0.0007270525       -0.2558075969
   H          1.6447636389        1.2911550855        0.3813089601
   O          0.0106003007       -1.0061322897        2.0606808077
   H          0.6546330248       -1.3906268529        1.4660232414
   H         -0.8269795146       -1.1151402058        1.6103374196
   O          1.6929158997       -1.7790086835       -0.0011923911
   H          0.9679535893       -1.7945991427       -0.6260271102
   H          2.1907280264       -2.5741666021       -0.1912944980
   O         -0.4407906446       -1.5632819314       -1.6219120710
   H         -0.3367452188       -0.6846354140       -1.9871334927
   H         -1.1590461906       -1.4790142140       -0.9948237499
    24
 Energy=    -305.510867837289
   O         -1.6187828911        1.6275577359       -0.0298926821
   H         -0.9465248362        1.7989699156        0.6295910647
   H         -1.1373918925        1.5764671528       -0.8556555408
   O          0.0384487994        1.1131274742       -2.1881426007
   H          0.2931016136        1.6306885730       -2.9520236734
   H          0.8167938483        1.1085968460       -1.6310157764
   O          0.4930047503        1.6227743083        1.7747169767
   H          0.3327596156        0.7028195785        1.9850420393
   H          0.6708809797        2.0347915863        2.6201953323
   O         -2.2236476794       -0.9549112656        0.4100583427
   H         -2.1158027514       -0.0149033561        0.2651913635
   H         -3.1661290740       -1.0728982766        0.5285476922
   O          2.0506481411        0.9411413435       -0.4131019075
   H          2.1136569038       -0.0008827849       -0.2554558564
   H          1.6447234478        1.2906021122        0.3802039317
   O          0.0069554069       -1.0057839149        2.0628017311
   H          0.6517724645       -1.3905793411        1.4691896675
   H         -0.8299158743       -1.1142021166        1.6110011199
   O          1.6924732268       -1.7806946252        0.0035876358
   H          0.9687363343       -1.7942084388       -0.6227143099
   H          2.1901646468       -2.5756687536       -0.1875961127
   O         -0.4387108203       -1.5641091574       -1.6201754441
   H         -0.3354316445       -0.6865201967       -1.9881467310
   H         -1.1576167208       -1.4787028813       -0.9939870425
    24
 Energy=    -305.506291787588
   O         -1.6166553000        1.6285608038       -0.0326210446
   H         -0.9441649508        1.7992048004        0.6268250841
   H         -1.1353867973        1.5770640491       -0.8584300737
   O          0.0386755790        1.1135769767       -2.1927005067
   H          0.2922022917        1.6361943693       -2.9535073855
   H          0.8164809710        1.1088459243       -1.6348221783
   O          0.4927055889        1.6209343838        1.7745748024
   H          0.3313698333        0.7012270772        1.9851480297
   H          0.6691765444        2.0333492608        2.6201537822
   O         -2.2238416331       -0.9526595601        0.4102847350
   H         -2.1152227504       -0.0128265458        0.2648623034
   H         -3.1662371287       -1.0695622647        0.5305192040
   O          2.0485412860        0.9403243279       -0.4151400935
   H          2.1132588354       -0.0014679654       -0.2568026213
   H          1.6440321200        1.2899254131        0.3788266916
   O          0.0051726029       -1.0069994605        2.0655653938
   H          0.6507442625       -1.3927920440        1.4734225438
   H         -0.8308617369       -1.1143191345        1.6119566303
   O          1.6925296495       -1.7822379043        0.0077562469
   H          0.9690954062       -1.7941712217       -0.6189273508
   H          2.1895283828       -2.5774418976       -0.1842716368
   O         -0.4366856350       -1.5627763875       -1.6179200891
   H         -0.3346690588       -0.6863227951       -1.9889370141
   H         -1.1564204356       -1.4764779026       -0.9928071167
    24
 Energy=    -305.503659615342
   O         -1.6164651146        1.6288457988       -0.0335183870
   H         -0.9440104741        1.7993923645        0.6259893577
   H         -1.1351749667        1.5776591794       -0.8593340829
   O          0.0385325950        1.1144784543       -2.1949148948
   H          0.2925402038        1.6382211107       -2.9547869922
   H          0.8158540742        1.1092539616       -1.6363668999
   O          0.4917480941        1.6198656518        1.7745671947
   H          0.3300995590        0.7002270591        1.9852006437
   H          0.6690607625        2.0321347008        2.6200411971
   O         -2.2235125370       -0.9520955227        0.4106396640
   H         -2.1149889891       -0.0122774874        0.2650493483
   H         -3.1658085035       -1.0689594467        0.5316891369
   O          2.0472714387        0.9406496652       -0.4162211817
   H          2.1130344484       -0.0010389407       -0.2576978834
   H          1.6433395202        1.2900979308        0.3781066819
   O          0.0052447107       -1.0080695923        2.0669688524
   H          0.6511081591       -1.3943648110        1.4754722336
   H         -0.8304525075       -1.1149768706        1.6126420611
   O          1.6929538231       -1.7832553530        0.0093685156
   H          0.9696381694       -1.7942871159       -0.6174684691
   H          2.1891947425       -2.5789034009       -0.1827797965
   O         -0.4353734546       -1.5617323570       -1.6171381715
   H         -0.3343291822       -0.6856592516       -1.9893179790
   H         -1.1554979017       -1.4755069052       -0.9924640228
    24
 Energy=    -305.498483340431
   O         -1.6174845549        1.6282564408       -0.0338521777
   H         -0.9454117968        1.7994039161        0.6258891272
   H         -1.1359803343        1.5784552847       -0.8596277951
   O          0.0378211602        1.1159866209       -2.1969949798
   H          0.2937247796        1.6390392955       -2.9567061600
   H          0.8143585217        1.1097163609       -1.6373680951
   O          0.4896114624        1.6192030668        1.7758069858
   H          0.3281604900        0.6994581486        1.9861274768
   H          0.6697582893        2.0306337316        2.6210902335
   O         -2.2226997222       -0.9523600957        0.4110580652
   H         -2.1140246458       -0.0125279856        0.2656717776
   H         -3.1649293435       -1.0689898115        0.5328475972
   O          2.0461335299        0.9421755373       -0.4181934360
   H          2.1132723792        0.0006405128       -0.2593349691
   H          1.6424867890        1.2914323139        0.3763635807
   O          0.0067994508       -1.0094010711        2.0678955029
   H          0.6525862053       -1.3963491904        1.4767420027
   H         -0.8288532998       -1.1160863173        1.6134347471
   O          1.6933681665       -1.7852781654        0.0108471269
   H          0.9702005064       -1.7951318429       -0.6161802094
   H          2.1882191016       -2.5818633780       -0.1810027913
   O         -0.4332869451       -1.5597916033       -1.6169379876
   H         -0.3341447798       -0.6837341042       -1.9896656754
   H         -1.1536236240       -1.4747486180       -0.9923464413
    24
 Energy=    -305.493697468651
   O         -1.6122398405        1.6283582659       -0.0391823669
   H         -0.9403315925        1.7958546898        0.6216626180
   H         -1.1295784345        1.5752680445       -0.8640770484
   O          0.0417705748        1.1134063751       -2.1973861669
   H          0.2957636275        1.6468250656       -2.9505022733
   H          0.8171279474        1.1059685453       -1.6361398186
   O          0.4895175752        1.6198484187        1.7751665886
   H          0.3317018273        0.6996702757        1.9863494827
   H          0.6596532845        2.0344290312        2.6209848883
   O         -2.2226606599       -0.9486212404        0.4118582236
   H         -2.1114669544       -0.0098281701        0.2617403668
   H         -3.1646759566       -1.0614422583        0.5387851267
   O          2.0443542455        0.9383484751       -0.4133662735
   H          2.1107700644       -0.0032712485       -0.2547060232
   H          1.6427622003        1.2880070243        0.3820547271
   O          0.0052197433       -1.0071912355        2.0683999311
   H          0.6499962991       -1.3947493730        1.4765437634
   H         -0.8308674856       -1.1119737876        1.6142957553
   O          1.6910011671       -1.7823239392        0.0111913734
   H          0.9672128850       -1.7944423833       -0.6150797389
   H          2.1879969540       -2.5774887692       -0.1810062358
   O         -0.4365480958       -1.5636144032       -1.6175662087
   H         -0.3347022734       -0.6886252337       -1.9920701762
   H         -1.1579977459       -1.4755729149       -0.9946770222
    24
 Energy=    -305.478863286121
   O         -1.6062197083        1.6310916667       -0.0418952490
   H         -0.9348023100        1.7968420206        0.6198882030
   H         -1.1219794478        1.5717450796       -0.8654371075
   O          0.0480529691        1.1053833172       -2.1969766428
   H          0.2972176388        1.6514753808       -2.9425852972
   H          0.8232355107        1.0976619991       -1.6354926729
   O          0.4885256445        1.6241646829        1.7783475601
   H          0.3295151648        0.7044746179        1.9907568154
   H          0.6445804379        2.0425060070        2.6250288921
   O         -2.2229993131       -0.9445484548        0.4126063612
   H         -2.1107656553       -0.0064248270        0.2591153029
   H         -3.1646825287       -1.0552989924        0.5437508612
   O          2.0482441859        0.9382175454       -0.4105178944
   H          2.1093894971       -0.0037002828       -0.2515087882
   H          1.6490208423        1.2904690635        0.3849514199
   O          0.0037622074       -1.0026855215        2.0698230849
   H          0.6469076195       -1.3912590139        1.4768589545
   H         -0.8330575691       -1.1047005801        1.6164386680
   O          1.6845266092       -1.7831682745        0.0087824211
   H          0.9612561570       -1.8007161546       -0.6179581670
   H          2.1873589585       -2.5748027707       -0.1828064432
   O         -0.4427572664       -1.5710294138       -1.6218823260
   H         -0.3376331802       -0.6958003931       -1.9949170802
   H         -1.1637263895       -1.4812799139       -0.9986806005
    24
 Energy=    -305.463291559406
   O         -1.6022215053        1.6330056243       -0.0419989054
   H         -0.9312767315        1.7991643719        0.6201613630
   H         -1.1168866111        1.5685194923       -0.8645093425
   O          0.0507574056        1.0990845057       -2.1937089552
   H          0.2942932447        1.6524417623       -2.9358126418
   H          0.8270142957        1.0933595236       -1.6336872546
   O          0.4923368793        1.6271051005        1.7800436750
   H          0.3319949191        0.7078011111        1.9931222310
   H          0.6367423598        2.0482062694        2.6274235796
   O         -2.2245554854       -0.9406336534        0.4109800304
   H         -2.1103828779       -0.0028427628        0.2568868728
   H         -3.1664229855       -1.0493010739        0.5425431107
   O          2.0533894046        0.9359319741       -0.4093357339
   H          2.1100462211       -0.0062763279       -0.2503849209
   H          1.6540586756        1.2897914917        0.3853656255
   O         -0.0001849902       -0.9986689171        2.0688059241
   H          0.6426785918       -1.3870863555        1.4754340774
   H         -0.8372402539       -1.1007023369        1.6158605557
   O          1.6800828044       -1.7818655504        0.0071312597
   H          0.9569174838       -1.8034309271       -0.6196052827
   H          2.1877415699       -2.5702866673       -0.1849795421
   O         -0.4479238344       -1.5772446100       -1.6239816013
   H         -0.3391447641       -0.7019363064       -1.9957803742
   H         -1.1670239931       -1.4848528431       -0.9990091515
    24
 Energy=    -305.450732368333
   O         -1.6007706716        1.6366950662       -0.0426108841
   H         -0.9292401727        1.8003084672        0.6195894511
   H         -1.1154062556        1.5681487869       -0.8647754852
   O          0.0528433950        1.0930493664       -2.1913143857
   H          0.2906182740        1.6509768434       -2.9318627483
   H          0.8307836102        1.0900293551       -1.6336121883
   O          0.4951150488        1.6288799346        1.7772664664
   H          0.3324050464        0.7100292142        1.9905049450
   H          0.6307898741        2.0516519037        2.6252570582
   O         -2.2279653020       -0.9377789752        0.4104869361
   H         -2.1115566596        0.0000413857        0.2582573774
   H         -3.1703689227       -1.0448002411        0.5395361679
   O          2.0587181819        0.9365898011       -0.4079319554
   H          2.1103804905       -0.0060746941       -0.2499873597
   H          1.6573144549        1.2912006529        0.3853889329
   O         -0.0015980524       -0.9977467562        2.0668905113
   H          0.6419256841       -1.3852599327        1.4736430263
   H         -0.8381661898       -1.0992078797        1.6129177897
   O          1.6789595520       -1.7817674213        0.0058227695
   H          0.9549710382       -1.8063542073       -0.6198512365
   H          2.1903426154       -2.5673835985       -0.1878946139
   O         -0.4530534487       -1.5817386368       -1.6204445325
   H         -0.3401670443       -0.7074291005       -1.9933672248
   H         -1.1706050906       -1.4847950158       -0.9943827020
    24
 Energy=    -305.438767709299
   O         -1.6006192935        1.6411454885       -0.0415638725
   H         -0.9288141448        1.8061033289        0.6200240604
   H         -1.1154193009        1.5691868329       -0.8635339200
   O          0.0517024988        1.0901262142       -2.1891327010
   H          0.2852936030        1.6492685869       -2.9300961570
   H          0.8314132110        1.0893344226       -1.6339008410
   O          0.4974082846        1.6272418425        1.7753015283
   H          0.3319993592        0.7090019284        1.9890939220
   H          0.6284814992        2.0512603175        2.6233934958
   O         -2.2283272674       -0.9341717241        0.4095811415
   H         -2.1149068648        0.0044058422        0.2597819281
   H         -3.1705385485       -1.0447158036        0.5370556423
   O          2.0625770435        0.9355357354       -0.4097951413
   H          2.1114832479       -0.0073738993       -0.2524374467
   H          1.6586052938        1.2903665422        0.3821226347
   O         -0.0035526512       -0.9985120815        2.0673783463
   H          0.6414377499       -1.3856033225        1.4754496398
   H         -0.8389873327       -1.0996004356        1.6112403434
   O          1.6784594520       -1.7809458130        0.0060200534
   H          0.9537000190       -1.8073906740       -0.6186848959
   H          2.1916825055       -2.5651660177       -0.1884860078
   O         -0.4548688099       -1.5844151809       -1.6194544458
   H         -0.3396867352       -0.7106879353       -1.9930392823
   H         -1.1702116706       -1.4844614106       -0.9913416571
    24
 Energy=    -305.431514518854
   O         -1.6014804046        1.6436539499       -0.0418568550
   H         -0.9299333649        1.8076616324        0.6202291618
   H         -1.1157428302        1.5707012121       -0.8634216710
   O          0.0505468707        1.0892311198       -2.1886510232
   H          0.2827165886        1.6482249300       -2.9301730945
   H          0.8310477600        1.0891749514       -1.6345299184
   O          0.4972961337        1.6249438764        1.7732717492
   H          0.3316025777        0.7066828431        1.9867528026
   H          0.6269400884        2.0489364041        2.6215963460
   O         -2.2280525546       -0.9307328788        0.4097542077
   H         -2.1136441894        0.0080924951        0.2622771475
   H         -3.1707112155       -1.0410056581        0.5341182020
   O          2.0632529537        0.9356661935       -0.4110132778
   H          2.1115598356       -0.0073371092       -0.2540322085
   H          1.6578379774        1.2902256954        0.3802882429
   O         -0.0031229690       -1.0006030949        2.0682218597
   H          0.6429181152       -1.3869870802        1.4769772627
   H         -0.8378293717       -1.1017058045        1.6107556824
   O          1.6795667534       -1.7805415819        0.0065909507
   H          0.9543149066       -1.8080965148       -0.6174942394
   H          2.1937491190       -2.5640462752       -0.1882647149
   O         -0.4552494826       -1.5856261082       -1.6177884269
   H         -0.3394644810       -0.7126044115       -1.9928334783
   H         -1.1694783279       -1.4837809241       -0.9887124736
    24
 Energy=    -305.406752788963
   O         -1.5991736909        1.6442295412       -0.0417691645
   H         -0.9285693327        1.8101605476        0.6207929351
   H         -1.1125158032        1.5713813694       -0.8627984479
   O          0.0503508840        1.0866392189       -2.1866097957
   H          0.2807464144        1.6455905775       -2.9287170105
   H          0.8319058715        1.0872304052       -1.6339767421
   O          0.4947285864        1.6228083971        1.7677508521
   H          0.3312213012        0.7037366429        1.9794211578
   H          0.6207168974        2.0459400243        2.6170555157
   O         -2.2284266359       -0.9271256183        0.4105218588
   H         -2.1149001738        0.0116789260        0.2622329179
   H         -3.1710021559       -1.0382023480        0.5348005346
   O          2.0629715713        0.9372678297       -0.4096025093
   H          2.1078382710       -0.0058708076       -0.2524136734
   H          1.6562256495        1.2931530497        0.3804198355
   O          0.0000773480       -1.0028570661        2.0684956038
   H          0.6461598518       -1.3919265507        1.4790601328
   H         -0.8344966720       -1.1053664850        1.6111009558
   O          1.6783888999       -1.7807803011        0.0082516502
   H          0.9522466839       -1.8081582515       -0.6148051449
   H          2.1919262604       -2.5645798942       -0.1871182994
   O         -0.4556900259       -1.5840664810       -1.6183792663
   H         -0.3403438078       -0.7118150857       -1.9953468955
   H         -1.1687902476       -1.4808004454       -0.9882554375
    24
 Energy=    -305.378473544108
   O         -1.5985081727        1.6333138814       -0.0387419761
   H         -0.9260114122        1.8083239328        0.6195523572
   H         -1.1152166607        1.5588097384       -0.8616090900
   O          0.0606603337        1.0865566052       -2.1855196885
   H          0.2846439514        1.6488480945       -2.9270663560
   H          0.8430033079        1.0936598850       -1.6340481532
   O          0.5045155268        1.6350031691        1.7700063632
   H          0.3375559936        0.7152015904        1.9757280443
   H          0.6202828541        2.0544243463        2.6225998432
   O         -2.2377879914       -0.9418578991        0.4096318717
   H         -2.1193647059       -0.0032620050        0.2638734648
   H         -3.1806684567       -1.0480348614        0.5358646758
   O          2.0765100668        0.9357377012       -0.4089689559
   H          2.1132329270       -0.0079855449       -0.2531815808
   H          1.6667694466        1.2932457659        0.3787698637
   O         -0.0065966368       -0.9865361409        2.0628611216
   H          0.6358909511       -1.3877715126        1.4776673795
   H         -0.8435074729       -1.0954913326        1.6112630054
   O          1.6711009556       -1.7802429899        0.0043979367
   H          0.9428482447       -1.8013465128       -0.6164357531
   H          2.1807289842       -2.5651406975       -0.1967157155
   O         -0.4645533638       -1.5861767262       -1.6149265136
   H         -0.3445576660       -0.7126696154       -1.9875096586
   H         -1.1810817789       -1.4835728869       -0.9885948743
    24
 Energy=    -305.323894087375
   O         -1.5941382485        1.6194090581       -0.0329761943
   H         -0.9249237494        1.8054547136        0.6256365966
   H         -1.1086744290        1.5478377998       -0.8548242794
   O          0.0668544790        1.0828915420       -2.1802971047
   H          0.2877446430        1.6478042208       -2.9207787323
   H          0.8487365338        1.0941521993       -1.6282414101
   O          0.5136025447        1.6458991781        1.7693895036
   H          0.3409639852        0.7264509700        1.9719796325
   H          0.6252105783        2.0630146853        2.6236670583
   O         -2.2455381392       -0.9506746945        0.4064293278
   H         -2.1193003506       -0.0126665416        0.2634728100
   H         -3.1881501554       -1.0481465226        0.5413873575
   O          2.0835844039        0.9361918107       -0.4038421791
   H          2.1151028316       -0.0077031298       -0.2479551366
   H          1.6778654182        1.2962624633        0.3848105136
   O         -0.0123291196       -0.9732278144        2.0580098134
   H          0.6259368073       -1.3830050790        1.4741168096
   H         -0.8525329578       -1.0891272984        1.6143244970
   O          1.6623800310       -1.7815402950        0.0024076938
   H          0.9354855279       -1.7979926573       -0.6201559907
   H          2.1704537908       -2.5668352054       -0.2010739967
   O         -0.4681453358       -1.5840763570       -1.6215630651
   H         -0.3467317707       -0.7087222037       -1.9893207197
   H         -1.1875165495       -1.4847372633       -0.9979697351
    24
 Energy=    -305.278101031085
   O         -1.5927187037        1.6167481968       -0.0334967642
   H         -0.9226614197        1.7967924093        0.6259265883
   H         -1.1076689258        1.5473315191       -0.8557740154
   O          0.0752550315        1.0810798034       -2.1768602759
   H          0.2948084198        1.6487796149       -2.9156058841
   H          0.8557988837        1.0953262295       -1.6229828759
   O          0.5141417758        1.6483185233        1.7680731857
   H          0.3395003927        0.7297502405        1.9729256620
   H          0.6243296161        2.0677521452        2.6213995691
   O         -2.2547167474       -0.9527314190        0.4129722498
   H         -2.1249217544       -0.0157793270        0.2663234272
   H         -3.1973954435       -1.0457817705        0.5505598510
   O          2.0925066158        0.9371411414       -0.4004419671
   H          2.1230719198       -0.0070679488       -0.2462771328
   H          1.6861429831        1.2960727771        0.3883980159
   O         -0.0185253591       -0.9716498803        2.0474114718
   H          0.6215859312       -1.3809165479        1.4651828476
   H         -0.8590938144       -1.0995597994        1.6077348128
   O          1.6636082980       -1.7842832358       -0.0014422174
   H          0.9351248519       -1.7965261108       -0.6222431685
   H          2.1698086086       -2.5694747269       -0.2099306054
   O         -0.4728929741       -1.5796946678       -1.6189639598
   H         -0.3501954224       -0.7032594387       -1.9837083086
   H         -1.1947618162       -1.4822946575       -0.9979563489
    24
 Energy=    -305.212677639049
   O         -1.5946690229        1.6154207827       -0.0312006064
   H         -0.9219471542        1.7844428624        0.6284270643
   H         -1.1117260406        1.5490144395       -0.8549652047
   O          0.0757071007        1.0817345578       -2.1712402016
   H          0.2900218426        1.6470045702       -2.9133795716
   H          0.8579870893        1.1024508404       -1.6200227354
   O          0.5238829051        1.6407730752        1.7626678079
   H          0.3464005831        0.7226505980        1.9670766686
   H          0.6341038627        2.0597046436        2.6162365055
   O         -2.2765974450       -0.9468220361        0.4095308717
   H         -2.1449764181       -0.0105358686        0.2602795474
   H         -3.2199784055       -1.0382175422        0.5433630982
   O          2.1048664460        0.9391531930       -0.4059888688
   H          2.1320223350       -0.0052182591       -0.2521806830
   H          1.6990089697        1.2991688183        0.3826176861
   O         -0.0182989644       -0.9710558578        2.0463325984
   H          0.6207970603       -1.3795352931        1.4624382055
   H         -0.8597918728       -1.0995565665        1.6086008392
   O          1.6662719601       -1.7803432573        0.0011359568
   H          0.9372359999       -1.7923899698       -0.6190198989
   H          2.1746174942       -2.5632127922       -0.2108356198
   O         -0.4735996150       -1.5837134887       -1.6128910978
   H         -0.3529109420       -0.7053931479       -1.9737504378
   H         -1.2018782356       -1.4927288326       -0.9984288262
    24
 Energy=    -305.057956544437
   O         -1.5993841952        1.6073774010       -0.0334149835
   H         -0.9290626568        1.7700989870        0.6302284153
   H         -1.1131562851        1.5460357779       -0.8556384718
   O          0.0778374178        1.0921437672       -2.1607250228
   H          0.2910243954        1.6566865188       -2.9037422731
   H          0.8610382797        1.1132178739       -1.6108303676
   O          0.5128371444        1.6454913329        1.7463854775
   H          0.3385062464        0.7285252106        1.9585498210
   H          0.6273854854        2.0708566159        2.5961942169
   O         -2.2799852930       -0.9475933735        0.4197468084
   H         -2.1625795494       -0.0088851373        0.2738887310
   H         -3.2137653405       -1.0466702618        0.6054089565
   O          2.1178823435        0.9349791409       -0.4075964372
   H          2.1447319197       -0.0094078188       -0.2538296962
   H          1.7040758679        1.2942416999        0.3772133833
   O         -0.0214014118       -0.9723857217        2.0370049076
   H          0.6215403322       -1.3805701171        1.4571400499
   H         -0.8586060244       -1.0910328363        1.5884035937
   O          1.6692196388       -1.7838347904        0.0002210936
   H          0.9419543293       -1.7878141332       -0.6221141652
   H          2.1701847931       -2.5716346500       -0.2110539298
   O         -0.4690147290       -1.5814909948       -1.6063866977
   H         -0.3492520071       -0.6990901626       -1.9574671753
   H         -1.2018744352       -1.4995457529       -0.9961134242
    24
 Energy=    -304.789798875544
   O         -1.5898271532        1.6009021343       -0.0172841901
   H         -0.9231097935        1.7831492632        0.6449135042
   H         -1.1016942995        1.5376170563       -0.8382306902
   O          0.0695131396        1.0763146782       -2.1548605367
   H          0.2815424957        1.6432796411       -2.8963631483
   H          0.8498177240        1.1035270322       -1.6011312857
   O          0.5563431996        1.6547118610        1.7622965844
   H          0.3450439371        0.7458417916        1.9756968152
   H          0.6797185995        2.0782361234        2.6117891093
   O         -2.2796047399       -0.9755205524        0.4044197803
   H         -2.1446836383       -0.0391262555        0.2588386794
   H         -3.2192629674       -1.0603414996        0.5659117691
   O          2.1091855438        0.9300184541       -0.4062758217
   H          2.1380112805       -0.0143726281       -0.2528926387
   H          1.7180617147        1.2905680649        0.3894992524
   O         -0.0484160495       -0.9397883402        2.0408271616
   H          0.5896395652       -1.3411118807        1.4508642066
   H         -0.8916810160       -1.0706805599        1.6072337309
   O          1.6509988252       -1.7836787441       -0.0014840653
   H          0.9267491108       -1.7901234230       -0.6273056512
   H          2.1590730181       -2.5664835718       -0.2143433058
   O         -0.4610478983       -1.5706862688       -1.6335447001
   H         -0.3293585734       -0.6804524727       -1.9596942824
   H         -1.1921850329       -1.4958982354       -1.0202934624
    24
 Energy=    -304.170364308131
   O         -1.5247062480        1.5644018714       -0.0055447965
   H         -0.8534377673        1.7753394540        0.6434049728
   H         -1.0481004175        1.5062192113       -0.8336109172
   O          0.0936501978        1.0577806006       -2.1733079555
   H          0.3068057007        1.6348281728       -2.9066650794
   H          0.8670448087        1.0896356663       -1.6102112759
   O          0.5816772310        1.6901197669        1.8113513382
   H          0.3547758061        0.7857162112        2.0276885564
   H          0.7144867067        2.1136569602        2.6594136761
   O         -2.3353608127       -0.9721087304        0.3590822778
   H         -2.1590205895       -0.0369530757        0.2560295383
   H         -3.2837550421       -1.0259321588        0.4769095421
   O          2.0909364235        0.9419159180       -0.3822046876
   H          2.1357825724       -0.0016569914       -0.2276381081
   H          1.7226267748        1.3001592800        0.4254100327
   O         -0.0607025228       -0.9168773381        2.0154418055
   H          0.5934405014       -1.3065701892        1.4353829933
   H         -0.8982574661       -1.0991942034        1.5894205411
   O          1.6487595906       -1.7872880845       -0.0121217415
   H          0.9153033748       -1.8108431227       -0.6267102052
   H          2.1710686693       -2.5586687489       -0.2321147797
   O         -0.4917568300       -1.5881591282       -1.6191393009
   H         -0.3468563779       -0.7035621501       -1.9548830801
   H         -1.2318597228       -1.4987323273       -1.0187374394
    24
 Energy=    -302.971833886735
   O         -1.4772950367        1.5437986055        0.0033831467
   H         -0.8146629175        1.8089007496        0.6412478406
   H         -1.0015633146        1.4809853986       -0.8248472981
   O          0.1051548258        1.0408886346       -2.1978210422
   H          0.3260250844        1.6287417520       -2.9202315081
   H          0.8711132659        1.0670507478       -1.6243621929
   O          0.6119511086        1.7243494535        1.8640264468
   H          0.3658115294        0.8221229711        2.0680718387
   H          0.7404746261        2.1370454931        2.7180730055
   O         -2.3260205324       -0.9968567693        0.3436033945
   H         -2.1215593206       -0.0642503533        0.2752460562
   H         -3.2817316996       -1.0306165523        0.3849347618
   O          2.0454048847        0.9440781286       -0.3578183933
   H          2.0924429738        0.0008784720       -0.2016336757
   H          1.7099695396        1.3066674512        0.4620864502
   O         -0.0707937734       -0.8787352970        2.0113461095
   H          0.5834184339       -1.2785708872        1.4383105708
   H         -0.9101997124       -1.0982152078        1.6070466186
   O          1.6130592424       -1.7827539125       -0.0237210835
   H          0.8823532240       -1.8173041895       -0.6410595912
   H          2.1470041214       -2.5469480500       -0.2408432295
   O         -0.5018371033       -1.6062501656       -1.6504890088
   H         -0.3508841961       -0.7215659024       -1.9833235237
   H         -1.2319894871       -1.5112207382       -1.0388692377
    24
 Energy=    -301.075192277782
   O         -1.4301516548        1.5252857643        0.0301263570
   H         -0.7774983310        1.8262187860        0.6623563748
   H         -0.9511030811        1.4583185565       -0.7958637744
   O          0.1269965805        1.0129970518       -2.2258984244
   H          0.3544631365        1.6133396432       -2.9358840431
   H          0.8840879922        1.0356486323       -1.6406366537
   O          0.6223173553        1.7531628729        1.9099551975
   H          0.3694718046        0.8500492347        2.1014929851
   H          0.7470021634        2.1549642392        2.7697465679
   O         -2.3432444479       -0.9883155077        0.2985196271
   H         -2.0857802342       -0.0676713810        0.2499561576
   H         -3.2993317392       -0.9727468636        0.2550852079
   O          2.0089263939        0.9524123905       -0.3441210207
   H          2.0585556248        0.0091880798       -0.1888899699
   H          1.6998999368        1.3162396046        0.4855561738
   O         -0.0721694565       -0.8669321656        2.0055285162
   H          0.5817431537       -1.2686579507        1.4334738581
   H         -0.9128093889       -1.1318223892        1.6321794657
   O          1.6074750083       -1.7744515223       -0.0336328772
   H          0.8707343630       -1.8259260321       -0.6425626240
   H          2.1551213087       -2.5275586281       -0.2553197212
   O         -0.5249735229       -1.6271847887       -1.6462505422
   H         -0.3662359251       -0.7536983938       -2.0040992995
   H         -1.2511408790       -1.5074706616       -1.0342200375
    24
 Energy=    -298.361784511211
   O         -1.3919386210        1.5071209789        0.0467566271
   H         -0.7495425317        1.8594427479        0.6627342854
   H         -0.9185241948        1.4419581241       -0.7826192970
   O          0.1545721344        0.9993547245       -2.2581599586
   H          0.3912370996        1.6116150846       -2.9548369179
   H          0.9042040598        1.0115391225       -1.6630672290
   O          0.6322601699        1.7959789931        1.9588266900
   H          0.3886196597        0.8866786106        2.1321586146
   H          0.7406432330        2.1849967702        2.8266689111
   O         -2.3338620282       -1.0027572734        0.2846903091
   H         -2.0484015798       -0.0893134581        0.2655966289
   H         -3.2825147422       -0.9602927573        0.1643298791
   O          1.9702920678        0.9638999925       -0.3115224887
   H          2.0172049133        0.0209468021       -0.1538192691
   H          1.6886722944        1.3334630745        0.5253438517
   O         -0.0705825288       -0.8399695009        1.9957307687
   H          0.5716555299       -1.2645032101        1.4269309395
   H         -0.9184108001       -1.1266270263        1.6562509820
   O          1.5782803788       -1.7727068319       -0.0458559821
   H          0.8384767487       -1.8348134736       -0.6500622332
   H          2.1315878675       -2.5220857328       -0.2661147525
   O         -0.5450204718       -1.6647654082       -1.6748821753
   H         -0.3951490259       -0.8020220943       -2.0614625217
   H         -1.2637761499       -1.5294733768       -1.0573725144
    24
 Energy=    -294.902294743639
   O         -1.3540313946        1.4912572326        0.0880891935
   H         -0.7192862055        1.8821762888        0.6885162718
   H         -0.8869268225        1.4243133470       -0.7447155105
   O          0.1620775030        0.9914833857       -2.2755550176
   H          0.4053303969        1.6131856021       -2.9615187365
   H          0.9040089477        0.9989450232       -1.6708121835
   O          0.6373023699        1.8307747419        1.9897437151
   H          0.4020384345        0.9152573580        2.1404442145
   H          0.7326531104        2.2015933211        2.8670313861
   O         -2.3354040023       -1.0020141942        0.2521235029
   H         -2.0080387357       -0.1025512906        0.2576287066
   H         -3.2660730669       -0.9174152370        0.0449280671
   O          1.9545006064        0.9795973984       -0.3089435620
   H          1.9962845458        0.0364865431       -0.1507416119
   H          1.6986781572        1.3532932539        0.5343464961
   O         -0.0749818560       -0.8294195684        1.9904084009
   H          0.5328822114       -1.2785751760        1.4030479020
   H         -0.9424203677       -1.1078174322        1.6966791074
   O          1.5608000367       -1.7569931371       -0.0479564084
   H          0.8164765641       -1.8338524067       -0.6448710261
   H          2.1241068034       -2.4983290460       -0.2700788902
   O         -0.5566312973       -1.7205378994       -1.6866832490
   H         -0.4038261921       -0.8816664167       -2.1216281598
   H         -1.2839992340       -1.5514110821       -1.0878812413
    24
 Energy=    -293.612464516713
   O         -1.3427392311        1.4571820019        0.1212475732
   H         -0.7143589547        1.8793358422        0.7070429329
   H         -0.8850794060        1.3952122479       -0.7171670463
   O          0.1427583594        0.9832265803       -2.2681286406
   H          0.3804907800        1.5971068043       -2.9630143915
   H          0.8905072938        0.9957368101       -1.6706783371
   O          0.6732189025        1.8511580625        1.9872485352
   H          0.4432930298        0.9330173646        2.1300196520
   H          0.7765443797        2.2123792543        2.8676319382
   O         -2.3991340701       -1.0194927077        0.1800061676
   H         -2.0721047507       -0.1202751563        0.2063017848
   H         -3.3395154548       -0.9284596694        0.0262931970
   O          1.9625717803        0.9894077305       -0.3236201879
   H          1.9944146151        0.0476245156       -0.1555063874
   H          1.7181490330        1.3752205220        0.5175919439
   O         -0.0495012085       -0.7956683976        2.0137679999
   H          0.5418112471       -1.2673169748        1.4271428730
   H         -0.9259691738       -1.0102404789        1.6944021160
   O          1.5587524628       -1.7407253858       -0.0279861709
   H          0.8166764402       -1.8303371840       -0.6259198983
   H          2.1261253155       -2.4828478903       -0.2367302109
   O         -0.5490410923       -1.7441679591       -1.6804435076
   H         -0.4013167520       -0.9124308690       -2.1305799005
   H         -1.2998420882       -1.5784439402       -1.1102985663
    24
 Energy=    -292.638075238074
   O         -1.3339222030        1.4483403859        0.1329059174
   H         -0.6921212769        1.8471145721        0.7205304231
   H         -0.8839359359        1.3900202176       -0.7099125431
   O          0.1258965172        0.9594367856       -2.2694354027
   H          0.3512984826        1.5642214948       -2.9763026105
   H          0.8795030153        0.9877390377       -1.6799372530
   O          0.6987180545        1.8302794514        1.9849513507
   H          0.4691091937        0.9086430390        2.1036860728
   H          0.8019457722        2.1684069935        2.8744712457
   O         -2.4840319245       -0.9806831847        0.1350800574
   H         -2.1213906502       -0.0966016114        0.1909631304
   H         -3.4073282432       -0.8482045938       -0.0798738232
   O          1.9776594652        1.0011346999       -0.3562686019
   H          2.0003774672        0.0607112348       -0.1792956135
   H          1.7370009703        1.3971986536        0.4812567251
   O         -0.0211588391       -0.8034840722        2.0296894703
   H          0.5545259255       -1.2756142756        1.4280982778
   H         -0.9048331479       -0.9914367277        1.7134216169
   O          1.5876875018       -1.7115971932       -0.0097309344
   H          0.8392195809       -1.8277253606       -0.5950016924
   H          2.1739455835       -2.4376043142       -0.2229138648
   O         -0.5542571356       -1.7624619548       -1.6386886580
   H         -0.4146833748       -0.9393361670       -2.1068926123
   H         -1.3280963450       -1.6029708793       -1.0983486587
    24
 Energy=    -291.577423163240
   O         -1.3374303295        1.4224704763        0.1547256640
   H         -0.6935507689        1.8270051865        0.7361055912
   H         -0.8956773233        1.3695125722       -0.6927892810
   O          0.1046716748        0.9498289209       -2.2543305599
   H          0.3189766825        1.5415752585       -2.9755389040
   H          0.8674021426        0.9886750119       -1.6772993176
   O          0.7284024992        1.8315219360        1.9682000788
   H          0.4993951099        0.9095715512        2.0856519566
   H          0.8471284605        2.1645147159        2.8577234313
   O         -2.5531658697       -0.9802477026        0.0749027426
   H         -2.1882298859       -0.0981738076        0.1456078450
   H         -3.4901596441       -0.8419267298       -0.0634512071
   O          1.9984695586        1.0066959264       -0.3810717247
   H          2.0165366482        0.0677888847       -0.1957099501
   H          1.7566731663        1.4111903484        0.4520852876
   O         -0.0037174003       -0.7852558773        2.0439319416
   H          0.5713718270       -1.2632691967        1.4464309063
   H         -0.8822748169       -0.9155135906        1.6869982871
   O          1.6074721195       -1.6981066846        0.0119276904
   H          0.8586186671       -1.8271962077       -0.5701257796
   H          2.1974228757       -2.4239368697       -0.1914450896
   O         -0.5466290317       -1.7682295356       -1.6096711520
   H         -0.4101475496       -0.9476312621       -2.0831931879
   H         -1.3426571243       -1.6210252166       -1.0988854785
    24
 Energy=    -290.532029694315
   O         -1.3430396511        1.3999311860        0.1710537068
   H         -0.6931294430        1.7992730394        0.7493050756
   H         -0.9100105304        1.3542862907       -0.6813746856
   O          0.0838640043        0.9375654571       -2.2395018792
   H          0.2849004093        1.5148313330       -2.9761023900
   H          0.8562534565        0.9890641783       -1.6764794499
   O          0.7557219132        1.8250459788        1.9488528100
   H          0.5255089217        0.9029083973        2.0624138040
   H          0.8906974110        2.1500829387        2.8390013536
   O         -2.6253310194       -0.9696964474        0.0238411440
   H         -2.2522246786       -0.0926476478        0.1122091333
   H         -3.5690215507       -0.8235382939       -0.0418689402
   O          2.0223489602        1.0117991970       -0.4099155788
   H          2.0357796480        0.0745867514       -0.2157911641
   H          1.7761642638        1.4248124331        0.4177588754
   O          0.0093451206       -0.7734299859        2.0510574836
   H          0.5860998307       -1.2532609617        1.4566265970
   H         -0.8590080381       -0.8481960001        1.6553243981
   O          1.6352334949       -1.6821264434        0.0354286612
   H          0.8847337818       -1.8265569617       -0.5408714743
   H          2.2307217805       -2.4055735848       -0.1601468368
   O         -0.5395332806       -1.7719636531       -1.5720292597
   H         -0.4086834790       -0.9529376441       -2.0498436232
   H         -1.3565344560       -1.6411388932       -1.0907540769
    24
 Energy=    -289.726927219143
   O         -1.3511528691        1.3772503433        0.1853600999
   H         -0.6992102435        1.7791463856        0.7595397096
   H         -0.9257659029        1.3395004878       -0.6712919400
   O          0.0665255994        0.9321950736       -2.2227869231
   H          0.2570581347        1.4965249334       -2.9720939379
   H          0.8475375327        0.9919454774       -1.6726214122
   O          0.7772794771        1.8253066825        1.9290393973
   H          0.5452966611        0.9040571684        2.0461510783
   H          0.9308455240        2.1488336083        2.8167215687
   O         -2.6761871581       -0.9715501694       -0.0161666341
   H         -2.3059208708       -0.0943257843        0.0818746566
   H         -3.6231828582       -0.8382613204        0.0246385972
   O          2.0439150748        1.0128923523       -0.4316607146
   H          2.0544000373        0.0771824132       -0.2302436960
   H          1.7913440824        1.4325820643        0.3907140658
   O          0.0117917834       -0.7570789777        2.0512043380
   H          0.5945084417       -1.2397772521        1.4649658951
   H         -0.8392632762       -0.7770510132        1.6135535144
   O          1.6557759883       -1.6728115223        0.0566769373
   H          0.9062742400       -1.8250346488       -0.5189158780
   H          2.2513371225       -2.3991482303       -0.1276427901
   O         -0.5292231462       -1.7705658537       -1.5453257240
   H         -0.4039285205       -0.9496663408       -2.0214108913
   H         -1.3609260969       -1.6567148058       -1.0853909669
    24
 Energy=    -289.075261125023
   O         -1.3598338589        1.3556787316        0.1969273799
   H         -0.7076630728        1.7629206382        0.7670669552
   H         -0.9414489918        1.3261702338       -0.6634883287
   O          0.0516768315        0.9305965585       -2.2061448983
   H          0.2332702624        1.4831313723       -2.9663823253
   H          0.8405212931        0.9961102053       -1.6679402742
   O          0.7948965032        1.8282696151        1.9099271929
   H          0.5610158078        0.9084447189        2.0342405902
   H          0.9675495043        2.1535173584        2.7934636588
   O         -2.7143733957       -0.9795222684       -0.0475417351
   H         -2.3523042527       -0.0996755926        0.0573753885
   H         -3.6523579597       -0.8735382811        0.1111535456
   O          2.0635729974        1.0117894260       -0.4489796263
   H          2.0716687701        0.0774467584       -0.2412055231
   H          1.8035978025        1.4371101539        0.3681782632
   O          0.0079517273       -0.7393146662        2.0472338951
   H          0.5978756721       -1.2251051374        1.4708406288
   H         -0.8209656315       -0.7064403770        1.5696910872
   O          1.6713817871       -1.6666591590        0.0765922803
   H          0.9242273740       -1.8224884292       -0.5010835471
   H          2.2641979734       -2.3983107808       -0.0951246774
   O         -0.5172401634       -1.7663483597       -1.5254787350
   H         -0.3982454968       -0.9415076245       -1.9963395116
   H         -1.3594579122       -1.6696232641       -1.0810179836
    24
 Energy=    -288.590692473765
   O         -1.3687580173        1.3353946170        0.2068049404
   H         -0.7190184845        1.7524139701        0.7726363981
   H         -0.9562715719        1.3134833463       -0.6566802469
   O          0.0392880926        0.9331847641       -2.1899734340
   H          0.2140323939        1.4755681442       -2.9590745575
   H          0.8349307295        1.0016379165       -1.6622435786
   O          0.8089989163        1.8347271737        1.8924553962
   H          0.5732319534        0.9169286611        2.0277020952
   H          1.0005847717        2.1651395038        2.7701537453
   O         -2.7387374204       -0.9947999229       -0.0716604168
   H         -2.3903084531       -0.1099381614        0.0371915835
   H         -3.6512633399       -0.9297242511        0.2099304976
   O          2.0801841852        1.0087046257       -0.4611909573
   H          2.0864062449        0.0755298476       -0.2481699265
   H          1.8127948843        1.4385366697        0.3512000912
   O         -0.0007715688       -0.7199042770        2.0414782063
   H          0.5962129163       -1.2092882411        1.4754881885
   H         -0.8042390195       -0.6366794489        1.5279165998
   O          1.6801755139       -1.6639305928        0.0943721048
   H          0.9369394396       -1.8190430511       -0.4885276321
   H          2.2673243214       -2.4032398662       -0.0634566506
   O         -0.5039611323       -1.7598102710       -1.5145867881
   H         -0.3909897266       -0.9294100338       -1.9770851639
   H         -1.3530641685       -1.6789728746       -1.0801662669
    24
 Energy=    -288.234224088141
   O         -1.3775831054        1.3170801632        0.2143163564
   H         -0.7310055922        1.7446535930        0.7758769689
   H         -0.9707267019        1.3023512177       -0.6519877271
   O          0.0288363501        0.9380653025       -2.1745494034
   H          0.1976303577        1.4711033975       -2.9514733458
   H          0.8307667322        1.0080555293       -1.6566296507
   O          0.8203302492        1.8420561888        1.8759120513
   H          0.5829002865        0.9267812370        2.0246756735
   H          1.0307974035        2.1799262958        2.7464171965
   O         -2.7548270535       -1.0140875535       -0.0897466049
   H         -2.4237011566       -0.1230176767        0.0224227096
   H         -3.6238186975       -0.9994532700        0.3113409174
   O          2.0952200327        1.0047066596       -0.4700385270
   H          2.0998354274        0.0725510229       -0.2525611557
   H          1.8200241808        1.4382440480        0.3377636864
   O         -0.0130853957       -0.7006876671        2.0344316748
   H          0.5909718731       -1.1930420972        1.4786135650
   H         -0.7883745958       -0.5691850955        1.4886610546
   O          1.6849129540       -1.6631178066        0.1108521749
   H          0.9461754082       -1.8150203805       -0.4785749084
   H          2.2644278121       -2.4112631035       -0.0329288529
   O         -0.4900065522       -1.7510927420       -1.5086563449
   H         -0.3827818154       -0.9142724694       -1.9608360959
   H         -1.3438805876       -1.6851729669       -1.0811220715
    24
 Energy=    -287.999958389541
   O         -1.3880582459        1.3029322638        0.2209099434
   H         -0.7456006112        1.7390002252        0.7806641400
   H         -0.9843447384        1.2953799353       -0.6469553723
   O          0.0177117961        0.9448861383       -2.1592480290
   H          0.1803530561        1.4685346102       -2.9438319560
   H          0.8256490836        1.0167553914       -1.6510118733
   O          0.8301376501        1.8464881968        1.8595082598
   H          0.5885510483        0.9350098633        2.0240530907
   H          1.0600675543        2.1931956157        2.7215744085
   O         -2.7631435424       -1.0323636516       -0.1037637934
   H         -2.4478595415       -0.1356622076        0.0091714053
   H         -3.5736473870       -1.0675475331        0.4042494470
   O          2.1099480543        0.9995482723       -0.4791795935
   H          2.1136068778        0.0680881970       -0.2587241989
   H          1.8271663412        1.4353360634        0.3247826841
   O         -0.0298717545       -0.6841320719        2.0285165991
   H          0.5821391200       -1.1767087813        1.4816686175
   H         -0.7764641042       -0.5093174701        1.4555667249
   O          1.6873617226       -1.6630070300        0.1274026462
   H          0.9539092435       -1.8104300372       -0.4697118805
   H          2.2590862630       -2.4194841390       -0.0033844840
   O         -0.4741271188       -1.7421582394       -1.5065890794
   H         -0.3710861851       -0.8980550622       -1.9460253458
   H         -1.3308630038       -1.6891967249       -1.0829966559
    24
 Energy=    -287.914506341496
   O         -1.3897551893        1.3016218814        0.2185474613
   H         -0.7420846897        1.7272067216        0.7803590913
   H         -0.9879664988        1.2972709094       -0.6502325782
   O          0.0154364250        0.9437163221       -2.1579726060
   H          0.1731961796        1.4628726667       -2.9465284948
   H          0.8260231354        1.0195663699       -1.6545564809
   O          0.8293486889        1.8401393457        1.8530601088
   H          0.5882352718        0.9289784644        2.0200391749
   H          1.0641581113        2.1877880030        2.7134302537
   O         -2.7735736669       -1.0262796225       -0.1045887261
   H         -2.4581346812       -0.1297171181        0.0090148042
   H         -3.5744676690       -1.0669413015        0.4180461992
   O          2.1178618764        0.9999939634       -0.4841681964
   H          2.1210349130        0.0687083980       -0.2629692641
   H          1.8304884522        1.4361965040        0.3179388404
   O         -0.0358079071       -0.6869444232        2.0259306474
   H          0.5818516975       -1.1752016274        1.4815655535
   H         -0.7754492824       -0.5055995276        1.4460371186
   O          1.6956960665       -1.6612200950        0.1326299114
   H          0.9600739184       -1.8102427324       -0.4614106166
   H          2.2674627300       -2.4175224525        0.0010188687
   O         -0.4703529002       -1.7386340474       -1.4960365891
   H         -0.3671682351       -0.8939362252       -1.9342949079
   H         -1.3289076460       -1.6877202441       -1.0758897421
    24
 Energy=    -287.850681818024
   O         -1.3958558511        1.2848399121        0.2229236862
   H         -0.7565994617        1.7306595667        0.7786465886
   H         -0.9982186029        1.2847487829       -0.6477751426
   O          0.0123516260        0.9563026836       -2.1469852096
   H          0.1690405441        1.4705411045       -2.9389695967
   H          0.8269620892        1.0276536397       -1.6494405641
   O          0.8314526961        1.8564885282        1.8429934740
   H          0.5921152144        0.9485366726        2.0289311992
   H          1.0815597748        2.2177174689        2.6934004011
   O         -2.7630512417       -1.0583211429       -0.1082160567
   H         -2.4767777457       -0.1521093314        0.0060620175
   H         -3.4835214631       -1.1625902618        0.5133001949
   O          2.1245909747        0.9934491259       -0.4798378591
   H          2.1276324228        0.0627731772       -0.2560860591
   H          1.8306959378        1.4313629752        0.3189668780
   O         -0.0533582423       -0.6663814242        2.0186053142
   H          0.5694860519       -1.1591268261        1.4842844424
   H         -0.7646829581       -0.4468436956        1.4168975991
   O          1.6854491633       -1.6687792322        0.1408795285
   H          0.9559494213       -1.8070787915       -0.4632191375
   H          2.2431271639       -2.4378780837        0.0237725501
   O         -0.4569357398       -1.7257884908       -1.5084248106
   H         -0.3556301973       -0.8737006632       -1.9325891196
   H         -1.3154323545       -1.6836250905       -1.0871913239
    24
 Energy=    -287.785549617487
   O         -1.4020846023        1.2686006271        0.2297841092
   H         -0.7773243981        1.7438253650        0.7775687164
   H         -1.0072236408        1.2712009366       -0.6421734009
   O          0.0094678542        0.9701435547       -2.1356137339
   H          0.1684693481        1.4822074787       -2.9285455737
   H          0.8264105161        1.0339651943       -1.6408781222
   O          0.8361093952        1.8775835026        1.8371733978
   H          0.5969764496        0.9733978909        2.0408782185
   H          1.0991561898        2.2515317834        2.6781257788
   O         -2.7446346959       -1.0966226282       -0.1118261327
   H         -2.4871756530       -0.1821868018        0.0054504660
   H         -3.3727063413       -1.2612017593        0.5915027788
   O          2.1258116590        0.9860625260       -0.4728935322
   H          2.1287372650        0.0559543978       -0.2467914520
   H          1.8290974333        1.4257933177        0.3238682510
   O         -0.0674063324       -0.6421715652        2.0134842676
   H          0.5551850032       -1.1423654751        1.4858310468
   H         -0.7530237670       -0.3856973672        1.3967334597
   O          1.6679756327       -1.6773717562        0.1469253599
   H          0.9473579788       -1.8038129887       -0.4702898793
   H          2.2103323444       -2.4596269492        0.0461391989
   O         -0.4449805221       -1.7153132188       -1.5302909587
   H         -0.3462683755       -0.8557572539       -1.9397433923
   H         -1.3021345700       -1.6818044418       -1.1055605267
    24
 Energy=    -287.706700404823
   O         -1.4088300407        1.2530263468        0.2369981372
   H         -0.8007537924        1.7586914064        0.7762364553
   H         -1.0167569575        1.2584404752       -0.6362035718
   O          0.0061190972        0.9842179819       -2.1238217157
   H          0.1679904353        1.4945230079       -2.9173066182
   H          0.8250211445        1.0400390758       -1.6313633090
   O          0.8415839589        1.8989108985        1.8320180731
   H          0.6021494837        0.9989326037        2.0532465541
   H          1.1172350487        2.2851668258        2.6633150570
   O         -2.7248345772       -1.1356665968       -0.1150372709
   H         -2.4942468701       -0.2147675836        0.0074623491
   H         -3.2486391295       -1.3564034321        0.6551158831
   O          2.1262418500        0.9785481140       -0.4657304721
   H          2.1290654850        0.0490046950       -0.2373165949
   H          1.8275727181        1.4201235787        0.3292787723
   O         -0.0810320499       -0.6175708148        2.0090596535
   H          0.5397346377       -1.1250248585        1.4862107718
   H         -0.7408512656       -0.3245012253        1.3805847866
   O          1.6492724276       -1.6861417886        0.1527905518
   H          0.9383185114       -1.8008240325       -0.4777840687
   H          2.1754031616       -2.4813241272        0.0685092419
   O         -0.4332246016       -1.7054934175       -1.5541387801
   H         -0.3371660806       -0.8386245230       -1.9485280807
   H         -1.2888135573       -1.6807434635       -1.1256684561
    24
 Energy=    -287.628225704052
   O         -1.4158634228        1.2376731194        0.2441979272
   H         -0.8253489065        1.7727279945        0.7745192700
   H         -1.0269969726        1.2460422150       -0.6304132333
   O          0.0025617628        0.9982935970       -2.1116024771
   H          0.1673777283        1.5069146676       -2.9055622645
   H          0.8232525161        1.0460996872       -1.6212830859
   O          0.8471380992        1.9200044360        1.8265980988
   H          0.6071805328        1.0247359413        2.0656515005
   H          1.1357453883        2.3184790694        2.6476679127
   O         -2.7057143227       -1.1743736141       -0.1177190568
   H         -2.5005906774       -0.2484408657        0.0119137924
   H         -3.1144508968       -1.4469300669        0.7037912798
   O          2.1270012269        0.9710300566       -0.4586212622
   H          2.1299867223        0.0420155504       -0.2280676371
   H          1.8262509475        1.4142122702        0.3347075694
   O         -0.0949330524       -0.5933317321        2.0045723364
   H          0.5234866252       -1.1070650811        1.4850851002
   H         -0.7281591407       -0.2636676551        1.3669375214
   O          1.6308736260       -1.6950165166        0.1584560041
   H          0.9294913426       -1.7981448258       -0.4847074933
   H          2.1396902702       -2.5029092724        0.0902888738
   O         -0.4213024776       -1.6956908185       -1.5776245711
   H         -0.3276915789       -0.8218164620       -1.9568506893
   H         -1.2754069307       -1.6796696105       -1.1457904084
    24
 Energy=    -287.588312127093
   O         -1.4207770399        1.2301797251        0.2494345967
   H         -0.8425632071        1.7835021664        0.7745392335
   H         -1.0330372180        1.2403056843       -0.6256580472
   O          0.0038399728        1.0074279300       -2.1025066427
   H          0.1718290366        1.5164942473       -2.8955154692
   H          0.8248380231        1.0491263508       -1.6121442429
   O          0.8465946970        1.9349980067        1.8219850432
   H          0.6063254434        1.0433512209        2.0739146666
   H          1.1437232744        2.3424393443        2.6355807690
   O         -2.6936906152       -1.1982874152       -0.1185357547
   H         -2.5011053665       -0.2701525358        0.0145371859
   H         -3.0286841916       -1.4974733284        0.7267446325
   O          2.1256046755        0.9658241610       -0.4523522938
   H          2.1308905408        0.0367609951       -0.2220361342
   H          1.8225095759        1.4079476023        0.3406748578
   O         -0.1012507835       -0.5793095263        1.9990114214
   H          0.5158826634       -1.0966569939        1.4815853431
   H         -0.7197253497       -0.2308488728        1.3569084516
   O          1.6215994571       -1.7023670805        0.1605301010
   H          0.9248473670       -1.7966705095       -0.4889891276
   H          2.1174414146       -2.5189527600        0.1008608363
   O         -0.4157468026       -1.6907645946       -1.5914821239
   H         -0.3231682979       -0.8126197854       -1.9609719811
   H         -1.2687806896       -1.6797721233       -1.1573805306
    24
 Energy=    -287.577294215513
   O         -1.4217476409        1.2274099493        0.2507972644
   H         -0.8472427183        1.7858282309        0.7745767568
   H         -1.0338400653        1.2376980802       -0.6242191395
   O          0.0032417303        1.0097614407       -2.0999451111
   H          0.1727188985        1.5195895133       -2.8921475258
   H          0.8238501943        1.0496067714       -1.6087771779
   O          0.8466546313        1.9394888569        1.8213575913
   H          0.6061479438        1.0487765649        2.0763477600
   H          1.1456461086        2.3490678287        2.6331956307
   O         -2.6907781069       -1.2033042355       -0.1196607671
   H         -2.5023785081       -0.2742659234        0.0130993397
   H         -3.0081374097       -1.5077042174        0.7305483625
   O          2.1253121958        0.9643717511       -0.4504371204
   H          2.1313984788        0.0352769878       -0.2202682305
   H          1.8218648197        1.4061107311        0.3426695580
   O         -0.1021519076       -0.5757185844        1.9987054166
   H          0.5141321984       -1.0940543177        1.4812560876
   H         -0.7179892135       -0.2233455765        1.3562028750
   O          1.6190076789       -1.7046571671        0.1598384309
   H          0.9234582275       -1.7966959486       -0.4912926337
   H          2.1115514776       -2.5233832298        0.1022182898
   O         -0.4140890537       -1.6899615551       -1.5950596903
   H         -0.3214824319       -0.8109455453       -1.9624650633
   H         -1.2668904350       -1.6798072453       -1.1604811197
    24
 Energy=    -287.561561367157
   O         -1.4250760150        1.2238148198        0.2535947996
   H         -0.8587820557        1.7937222896        0.7739297567
   H         -1.0368152485        1.2337059119       -0.6212695233
   O          0.0046658615        1.0130172508       -2.0971055114
   H          0.1789775660        1.5262589221       -2.8860480040
   H          0.8232677473        1.0481122106       -1.6022407457
   O          0.8487468741        1.9485247052        1.8227784483
   H          0.6079516852        1.0588804860        2.0812018997
   H          1.1487550282        2.3608438585        2.6328524346
   O         -2.6835824471       -1.2148454660       -0.1200139567
   H         -2.5006119420       -0.2850317908        0.0148940257
   H         -2.9773866895       -1.5281980035        0.7353930191
   O          2.1215220649        0.9629820214       -0.4448757972
   H          2.1288794199        0.0337170668       -0.2154322239
   H          1.8192046888        1.4038421067        0.3491509211
   O         -0.1005207745       -0.5675904943        1.9982501616
   H          0.5118975039       -1.0896060902        1.4799110738
   H         -0.7138528861       -0.2097358914        1.3563812933
   O          1.6111124453       -1.7080907792        0.1574534628
   H          0.9181763011       -1.7961902625       -0.4970003715
   H          2.0980214683       -2.5304369258        0.1036179855
   O         -0.4120587442       -1.6907473878       -1.6054416428
   H         -0.3213267998       -0.8110928423       -1.9717849721
   H         -1.2633040272       -1.6818257635       -1.1677959954
    24
 Energy=    -287.558330886836
   O         -1.4256522886        1.2231442519        0.2542942990
   H         -0.8604847392        1.7946621752        0.7740872814
   H         -1.0373708416        1.2329154854       -0.6205621926
   O          0.0047682049        1.0134840695       -2.0972471080
   H          0.1796757876        1.5271360626       -2.8857905801
   H          0.8231341016        1.0479627024       -1.6019488918
   O          0.8490567664        1.9496859114        1.8230798441
   H          0.6082467298        1.0601366364        2.0818161065
   H          1.1490996148        2.3622757134        2.6330031642
   O         -2.6827749938       -1.2161804184       -0.1201286501
   H         -2.5005984920       -0.2862089717        0.0147663846
   H         -2.9736424095       -1.5303937828        0.7359659406
   O          2.1210920221        0.9627129364       -0.4439914659
   H          2.1284746376        0.0334488464       -0.2145452019
   H          1.8190514756        1.4035929865        0.3501295133
   O         -0.0999710420       -0.5666949661        1.9981648192
   H          0.5118552701       -1.0893264011        1.4797472395
   H         -0.7130400262       -0.2082437686        1.3563774715
   O          1.6097966651       -1.7082686627        0.1573655057
   H          0.9171735129       -1.7959018286       -0.4974821387
   H          2.0959804635       -2.5310768890        0.1040384309
   O         -0.4115625206       -1.6908703914       -1.6070072836
   H         -0.3210061719       -0.8111094567       -1.9731385244
   H         -1.2625939292       -1.6820732007       -1.1689433717
    24
 Energy=    -287.540159613898
   O         -1.4257760666        1.2196531853        0.2546104429
   H         -0.8686135050        1.8012775342        0.7718288075
   H         -1.0372910303        1.2304399562       -0.6201437295
   O          0.0046383316        1.0165893757       -2.0960386735
   H          0.1839093596        1.5334580444       -2.8814942851
   H          0.8210940788        1.0468406344       -1.5973236104
   O          0.8499391744        1.9581856677        1.8264118937
   H          0.6105474414        1.0681048397        2.0846357458
   H          1.1482221653        2.3711477407        2.6367953977
   O         -2.6755012029       -1.2261659179       -0.1195912628
   H         -2.4955059329       -0.2958602709        0.0159260649
   H         -2.9512863179       -1.5449207721        0.7398095479
   O          2.1170880823        0.9615997757       -0.4399201027
   H          2.1238985104        0.0325750035       -0.2094891356
   H          1.8167394101        1.4036336146        0.3542011729
   O         -0.0968481927       -0.5600621483        2.0001854129
   H          0.5099305635       -1.0866349556        1.4798274019
   H         -0.7094801772       -0.1974493918        1.3603214582
   O          1.6026337587       -1.7114213983        0.1553608215
   H          0.9132860968       -1.7965914273       -0.5032572068
   H          2.0851659982       -2.5366117822        0.1058097541
   O         -0.4116087395       -1.6917669613       -1.6171480338
   H         -0.3224247530       -0.8117583683       -1.9830208706
   H         -1.2612342311       -1.6834356575       -1.1763544841
    24
 Energy=    -287.525158491172
   O         -1.4247223619        1.2161459700        0.2547800186
   H         -0.8728869934        1.8052795609        0.7692031696
   H         -1.0372249812        1.2274594596       -0.6204054617
   O          0.0035888998        1.0188543697       -2.0979751211
   H          0.1850946628        1.5371929136       -2.8819474753
   H          0.8192931509        1.0464276995       -1.5978770044
   O          0.8501387977        1.9638267636        1.8302008926
   H          0.6126194809        1.0725515395        2.0860228796
   H          1.1458220141        2.3757900238        2.6420441951
   O         -2.6701339495       -1.2333751704       -0.1184428693
   H         -2.4913582446       -0.3028899653        0.0174555135
   H         -2.9376184900       -1.5546240317        0.7426512195
   O          2.1142150227        0.9606072371       -0.4371273674
   H          2.1181645182        0.0321241349       -0.2044572778
   H          1.8163633659        1.4055751168        0.3562954811
   O         -0.0937208913       -0.5557368158        2.0025449885
   H          0.5088165616       -1.0860503033        1.4810585910
   H         -0.7059423009       -0.1902032385        1.3639512291
   O          1.5969124681       -1.7126296276        0.1550694432
   H          0.9103175978       -1.7968275571       -0.5065422501
   H          2.0775162876       -2.5391296064        0.1087057308
   O         -0.4116351156       -1.6913460152       -1.6254915732
   H         -0.3228736660       -0.8107616047       -1.9900794791
   H         -1.2603888861       -1.6834615259       -1.1830136507
    24
 Energy=    -287.511020636981
   O         -1.4231480123        1.2132707870        0.2536682404
   H         -0.8741518167        1.8059800962        0.7670206456
   H         -1.0365294017        1.2259257426       -0.6218874358
   O          0.0025534242        1.0199341495       -2.1005922854
   H          0.1852095916        1.5391072949       -2.8837447671
   H          0.8179607519        1.0458351962       -1.5999208704
   O          0.8483012538        1.9677654320        1.8328329275
   H          0.6125227002        1.0753476823        2.0862710335
   H          1.1420149172        2.3785081138        2.6460085379
   O         -2.6672553074       -1.2375494811       -0.1164050070
   H         -2.4877360952       -0.3072600614        0.0198531597
   H         -2.9302273712       -1.5599940182        0.7456315665
   O          2.1133036219        0.9598438675       -0.4349143344
   H          2.1151605111        0.0317764309       -0.2005658223
   H          1.8164372122        1.4069142163        0.3576954548
   O         -0.0911006500       -0.5530055069        2.0034408275
   H          0.5088135714       -1.0857672360        1.4814257828
   H         -0.7030024032       -0.1857895127        1.3655062713
   O          1.5946986428       -1.7135419666        0.1556599047
   H          0.9095017119       -1.7972036044       -0.5074673351
   H          2.0741171845       -2.5408275936        0.1110707441
   O         -0.4126834512       -1.6904888003       -1.6303223382
   H         -0.3238380195       -0.8094728578       -1.9938457052
   H         -1.2609653935       -1.6827355852       -1.1869382226
    24
 Energy=    -287.493435618660
   O         -1.4205939388        1.2113468706        0.2512358704
   H         -0.8721351392        1.8040039342        0.7652226310
   H         -1.0345944227        1.2260723828       -0.6245605517
   O          0.0020722009        1.0199519026       -2.1030845256
   H          0.1853693567        1.5398678238       -2.8855942237
   H          0.8172742182        1.0448440411       -1.6020277501
   O          0.8443114511        1.9703611988        1.8343823563
   H          0.6102606343        1.0769856805        2.0860413286
   H          1.1368989090        2.3801561189        2.6484416557
   O         -2.6683418275       -1.2392409938       -0.1140835369
   H         -2.4881835795       -0.3090567349        0.0220490831
   H         -2.9291661831       -1.5619233840        0.7485163532
   O          2.1140299140        0.9591812198       -0.4330222008
   H          2.1152464594        0.0313201126       -0.1978539081
   H          1.8161360746        1.4070436491        0.3587545006
   O         -0.0876800492       -0.5520483132        2.0022692127
   H          0.5109931056       -1.0860549051        1.4801013723
   H         -0.6994571181       -0.1841893108        1.3645855825
   O          1.5954685759       -1.7137814267        0.1570476718
   H          0.9098746354       -1.7969800877       -0.5057273817
   H          2.0739447641       -2.5416208019        0.1126140562
   O         -0.4145524319       -1.6895619943       -1.6314698104
   H         -0.3250827338       -0.8085832728       -1.9949302695
   H         -1.2628012908       -1.6812206672       -1.1880330779
    24
 Energy=    -287.475619272831
   O         -1.4151579409        1.2048956208        0.2547698932
   H         -0.8697359512        1.8020992769        0.7667215376
   H         -1.0309847831        1.2208254077       -0.6218081505
   O          0.0055088190        1.0214474462       -2.1046411825
   H          0.1885465617        1.5407209164       -2.8876380458
   H          0.8214570836        1.0452321707       -1.6047466373
   O          0.8433949518        1.9739456113        1.8350490200
   H          0.6111173367        1.0791168733        2.0831628631
   H          1.1333619248        2.3816590071        2.6510887136
   O         -2.6653273235       -1.2418720768       -0.1142027473
   H         -2.4880003724       -0.3111853063        0.0222125290
   H         -2.9214834661       -1.5664271591        0.7490931864
   O          2.1072810287        0.9584282313       -0.4324876584
   H          2.1052435625        0.0312213720       -0.1947585506
   H          1.8116783108        1.4095757015        0.3582821143
   O         -0.0885413892       -0.5462263626        2.0044877131
   H          0.5073730094       -1.0831553613        1.4821610721
   H         -0.7002683383       -0.1774505408        1.3672857255
   O          1.5900092940       -1.7160278829        0.1545708051
   H          0.9054913162       -1.7994895328       -0.5092824401
   H          2.0673994348       -2.5446187496        0.1125271497
   O         -0.4119678032       -1.6882685250       -1.6345390169
   H         -0.3256499940       -0.8054090023       -1.9941779178
   H         -1.2587398226       -1.6838680720       -1.1882323697
    24
 Energy=    -287.359753382905
   O         -1.4207418442        1.2015623983        0.2695834542
   H         -0.8922390627        1.8158803953        0.7790243719
   H         -1.0373570072        1.2248738754       -0.6071744838
   O         -0.0160517733        1.0249026180       -2.0985596187
   H          0.1597209218        1.5336433317       -2.8900889522
   H          0.8056984958        1.0520126885       -1.6084337376
   O          0.8759401600        1.9723475754        1.8402324843
   H          0.6213888068        1.0827383542        2.0852444885
   H          1.1685713344        2.3723703433        2.6591223554
   O         -2.6358224736       -1.2573939911       -0.1258491622
   H         -2.4624830013       -0.3267941466        0.0161691356
   H         -2.8916874878       -1.5879918243        0.7352373650
   O          2.0993943051        0.9519874194       -0.4457877255
   H          2.0954642133        0.0251840574       -0.2065139853
   H          1.8182920928        1.4061141300        0.3485562283
   O         -0.0990036955       -0.5225296419        2.0224746887
   H          0.4889249298       -1.0604863680        1.4922159477
   H         -0.7089347266       -0.1402169084        1.3915603118
   O          1.5610396998       -1.7120367520        0.1718540068
   H          0.8924771086       -1.7992608053       -0.5075927286
   H          2.0430919657       -2.5384437743        0.1417062632
   O         -0.3988368277       -1.6937276714       -1.6715767258
   H         -0.3139602846       -0.8020498829       -2.0091245504
   H         -1.2416491075       -1.6993647402       -1.2178504598
    24
 Energy=    -287.336198067624
   O         -1.4215285299        1.2013418071        0.2704940178
   H         -0.8949095837        1.8173664922        0.7798248659
   H         -1.0384372694        1.2259326220       -0.6063572911
   O         -0.0179019747        1.0253273563       -2.0970480043
   H          0.1568919996        1.5327645878       -2.8896300900
   H          0.8045966056        1.0528518676       -1.6082020912
   O          0.8790580886        1.9722346098        1.8411838686
   H          0.6221277558        1.0831973190        2.0857883241
   H          1.1719773121        2.3713645385        2.6604063466
   O         -2.6331019277       -1.2587779148       -0.1271987605
   H         -2.4599034847       -0.3281132355        0.0145665173
   H         -2.8887549387       -1.5892157836        0.7340121271
   O          2.0981244012        0.9509463110       -0.4479635022
   H          2.0943712232        0.0241999262       -0.2084663374
   H          1.8182640497        1.4053117767        0.3466823606
   O         -0.0991386274       -0.5204225165        2.0245489212
   H          0.4880163615       -1.0586097887        1.4936672780
   H         -0.7089071592       -0.1369992946        1.3941515778
   O          1.5568691347       -1.7113543551        0.1733018536
   H          0.8901935201       -1.7990264960       -0.5079389706
   H          2.0395045108       -2.5374691299        0.1445040651
   O         -0.3964320379       -1.6943571824       -1.6749599869
   H         -0.3113548315       -0.8018383707       -2.0102268652
   H         -1.2388525001       -1.7007268769       -1.2205163359
    24
 Energy=    -287.165030250764
   O         -1.4322971799        1.2079743594        0.2871040954
   H         -0.9164873547        1.8410839015        0.7864480369
   H         -1.0481703319        1.2235718110       -0.5895002191
   O         -0.0375163285        1.0278601778       -2.0841513195
   H          0.1341177066        1.5288141868       -2.8815337113
   H          0.7869925567        1.0591520218       -1.5989320301
   O          0.9142731412        1.9628420929        1.8431774618
   H          0.6361036231        1.0818153434        2.0934681449
   H          1.2133184832        2.3613493402        2.6604874992
   O         -2.6087426356       -1.2693101751       -0.1430636501
   H         -2.4478248549       -0.3378270185        0.0075233236
   H         -2.8681077517       -1.6095447040        0.7132085274
   O          2.0944114818        0.9476566474       -0.4602864434
   H          2.0874282043        0.0208698549       -0.2210181525
   H          1.8319697551        1.4039026664        0.3392107425
   O         -0.1147584826       -0.5098888737        2.0417131638
   H          0.4679515081       -1.0459104819        1.5037896170
   H         -0.7229791465       -0.1153200996        1.4167212066
   O          1.5351489634       -1.7035976362        0.1817218383
   H          0.8809243607       -1.7945002420       -0.5110686968
   H          2.0221369082       -2.5274097411        0.1615179367
   O         -0.3837543204       -1.6994335509       -1.7041742611
   H         -0.3019279616       -0.8022793318       -2.0276717019
   H         -1.2236799368       -1.7134161730       -1.2453046879
    24
 Energy=    -287.034836040409
   O         -1.4407671918        1.2142748033        0.2940768805
   H         -0.9292772901        1.8570539475        0.7854473032
   H         -1.0571035239        1.2219491446       -0.5828353924
   O         -0.0484940835        1.0303118292       -2.0751235850
   H          0.1220882408        1.5283594664       -2.8745496677
   H          0.7765842219        1.0635590296       -1.5910035032
   O          0.9337205255        1.9582805313        1.8446138183
   H          0.6461829708        1.0813033253        2.0985133553
   H          1.2356028070        2.3574682166        2.6605477127
   O         -2.5960570674       -1.2750097400       -0.1517237434
   H         -2.4393736494       -0.3433097203        0.0019552070
   H         -2.8576254149       -1.6184902966        0.7025800356
   O          2.0937803849        0.9468188389       -0.4669227960
   H          2.0842904036        0.0200517681       -0.2276644071
   H          1.8412789835        1.4043150833        0.3350572965
   O         -0.1231309599       -0.5095752059        2.0520052589
   H          0.4587106133       -1.0455395296        1.5130855364
   H         -0.7295978168       -0.1114606927        1.4275578023
   O          1.5237332190       -1.6990981007        0.1843416121
   H          0.8761834755       -1.7916002683       -0.5144820557
   H          2.0130014030       -2.5216549355        0.1685701928
   O         -0.3760066820       -1.7022731895       -1.7191284325
   H         -0.2945206874       -0.8036527993       -2.0386175044
   H         -1.2148750530       -1.7180280039       -1.2583861163
    24
 Energy=    -286.959243676355
   O         -1.4417604141        1.2203408981        0.2972064928
   H         -0.9311605197        1.8676169237        0.7835739820
   H         -1.0602314752        1.2241141768       -0.5806621028
   O         -0.0528573278        1.0311651181       -2.0715567585
   H          0.1174021769        1.5281811496       -2.8716933753
   H          0.7724017884        1.0650768312       -1.5877910850
   O          0.9424840974        1.9571919847        1.8454723891
   H          0.6531942161        1.0812291501        2.1008785693
   H          1.2446726721        2.3573662401        2.6608094180
   O         -2.5934206478       -1.2805528360       -0.1574659772
   H         -2.4420570908       -0.3480230807       -0.0034881570
   H         -2.8554179159       -1.6253170197        0.6961890639
   O          2.0940543709        0.9475908469       -0.4689062857
   H          2.0829335697        0.0208658634       -0.2295551361
   H          1.8457842643        1.4058153854        0.3339785544
   O         -0.1263894061       -0.5119000751        2.0569295460
   H          0.4558264637       -1.0491064333        1.5196532208
   H         -0.7311835725       -0.1136755778        1.4309318576
   O          1.5191322103       -1.6970447450        0.1843873844
   H          0.8743467316       -1.7902233382       -0.5168980613
   H          2.0093308026       -2.5190809054        0.1704686509
   O         -0.3743766946       -1.7031410425       -1.7236638534
   H         -0.2925715582       -0.8041850381       -2.0421255652
   H         -1.2131295652       -1.7190567118       -1.2627168353
    24
 Energy=    -286.771501558667
   O         -1.4423988193        1.2294639953        0.2977605995
   H         -0.9330963552        1.8792699865        0.7821106938
   H         -1.0610585072        1.2314721798       -0.5801957625
   O         -0.0605446281        1.0321374766       -2.0725452923
   H          0.1101319735        1.5292611488       -2.8725261622
   H          0.7644240442        1.0660897878       -1.5882873338
   O          0.9468569252        1.9577916126        1.8436568484
   H          0.6586830372        1.0815245121        2.0992808277
   H          1.2481377299        2.3587050349        2.6589666941
   O         -2.5897229578       -1.2859568036       -0.1575587563
   H         -2.4312317252       -0.3547286659       -0.0028767451
   H         -2.8529016191       -1.6296531592        0.6961634745
   O          2.0996993111        0.9487467411       -0.4653958507
   H          2.0885428903        0.0220464533       -0.2259507612
   H          1.8531317646        1.4071614182        0.3379050075
   O         -0.1311251483       -0.5177411172        2.0590139758
   H          0.4536467551       -1.0569757939        1.5265671480
   H         -0.7339030722       -0.1231335823        1.4287953568
   O          1.5118583525       -1.6967978122        0.1781858626
   H          0.8703381696       -1.7907216586       -0.5259888359
   H          2.0034760199       -2.5180145915        0.1660652036
   O         -0.3686843653       -1.7037907292       -1.7207748259
   H         -0.2864126747       -0.8046601291       -2.0386228602
   H         -1.2069271517       -1.7192967556       -1.2588869235
    24
 Energy=    -286.477310520240
   O         -1.4593664101        1.1995674405        0.3050149042
   H         -0.9421404718        1.8493915137        0.7808697588
   H         -1.0789672129        1.1864258064       -0.5732536129
   O         -0.0582529020        1.0329313132       -2.0691016415
   H          0.1120098730        1.5277739483       -2.8705835152
   H          0.7670132128        1.0681308971       -1.5854399115
   O          0.9730243957        1.9744605537        1.8443881341
   H          0.6682138694        1.1038482172        2.1000373911
   H          1.2799429024        2.3703710113        2.6600398857
   O         -2.5822155720       -1.2857203551       -0.1542067250
   H         -2.4441909076       -0.3552746294        0.0231397821
   H         -2.8504752234       -1.6533219718        0.6878963867
   O          2.0886019361        0.9470530522       -0.4731515733
   H          2.0749511381        0.0198025267       -0.2359766198
   H          1.8479648237        1.4044172546        0.3325429138
   O         -0.1422628712       -0.5090175625        2.0648849985
   H          0.4343376141       -1.0421999200        1.5176370711
   H         -0.7415485896       -0.0913594880        1.4462977366
   O          1.5099132941       -1.6937554050        0.1886292582
   H          0.8641892699       -1.7886425157       -0.5115626875
   H          1.9994744641       -2.5162023280        0.1766810478
   O         -0.3615470667       -1.7009187553       -1.7442849864
   H         -0.2782508623       -0.8019971526       -2.0624571639
   H         -1.1988407604       -1.7147676781       -1.2806263643
    24
 Energy=    -285.473523239110
   O         -1.4203893594        1.2313919266        0.3266374239
   H         -0.8855482434        1.8912266210        0.7679932855
   H         -1.0697250417        1.1942436764       -0.5632425590
   O         -0.0644061937        1.0293496446       -2.0779539871
   H          0.1068184530        1.5226352583       -2.8801904009
   H          0.7606246065        1.0645277827       -1.5938894073
   O          1.0080151793        1.9719977997        1.8629740439
   H          0.6909058959        1.1071890425        2.1233187307
   H          1.3188840184        2.3686245999        2.6767796633
   O         -2.6066288682       -1.3713732540       -0.1775937174
   H         -2.5677937339       -0.4437010181        0.0551032853
   H         -2.8773390280       -1.8099878121        0.6289824531
   O          2.0870157445        0.9534305730       -0.4787525361
   H          2.0616805022        0.0268135104       -0.2400670005
   H          1.8598811756        1.4154163028        0.3282238656
   O         -0.1442597004       -0.4769864108        2.0693255519
   H          0.4240522972       -1.0158159209        1.5189474343
   H         -0.7162913940       -0.0223918261        1.4509766657
   O          1.4840987873       -1.6736966751        0.1860056477
   H          0.8373930387       -1.7726480061       -0.5127161487
   H          1.9728618913       -2.4966745457        0.1789421819
   O         -0.3696438135       -1.6964292377       -1.7479039953
   H         -0.2910174703       -0.7948776917       -2.0597606096
   H         -1.2062153828       -1.7175298334       -1.2832163429
    24
 Energy=    -284.719878059986
   O         -1.4096262450        1.2199151821        0.3394177569
   H         -0.8757117738        1.8873527502        0.7703403371
   H         -1.0683185267        1.1795037607       -0.5539510351
   O         -0.0673913479        1.0287669180       -2.0782461461
   H          0.1039176942        1.5217436650       -2.8806543833
   H          0.7575886624        1.0641310497       -1.5941085615
   O          1.0178109342        1.9633523291        1.8717431840
   H          0.7048817222        1.0985961215        2.1372687942
   H          1.3280122243        2.3658196124        2.6829318707
   O         -2.6296165831       -1.3619189772       -0.2136415671
   H         -2.6566820638       -0.4266936688       -0.0115205086
   H         -2.8879014296       -1.7912827385        0.6019364724
   O          2.0863397535        0.9563097386       -0.4797402887
   H          2.0554862608        0.0304923939       -0.2386134628
   H          1.8656060122        1.4218878323        0.3269476895
   O         -0.1294870102       -0.4719055220        2.0850886667
   H          0.4342067193       -1.0121587529        1.5313670166
   H         -0.7055367955       -0.0176001806        1.4702674394
   O          1.4855169794       -1.6706395336        0.1845344768
   H          0.8368371424       -1.7695630621       -0.5123589473
   H          1.9731342305       -2.4942944552        0.1771978141
   O         -0.3758296953       -1.6979172261       -1.7442992671
   H         -0.2912373231       -0.7966742729       -2.0554858831
   H         -1.2177513250       -1.7166665991       -1.2892736959
    24
 Energy=    -283.897152350668
   O         -1.4046643271        1.2182017906        0.3439931739
   H         -0.8700781451        1.8865891550        0.7726046356
   H         -1.0649557672        1.1760334631       -0.5499037813
   O         -0.0675644056        1.0296971154       -2.0802693396
   H          0.1039299352        1.5226713607       -2.8826395313
   H          0.7572862212        1.0651117115       -1.5959150376
   O          1.0095851227        1.9402794770        1.8760125317
   H          0.6947768134        1.0769705182        2.1440147894
   H          1.3214086424        2.3440823848        2.6859144667
   O         -2.6287643382       -1.3671800060       -0.2179753903
   H         -2.6667645459       -0.4330394487       -0.0126238787
   H         -2.8868233022       -1.8022292162        0.5946558888
   O          2.0859278551        0.9562663653       -0.4798210665
   H          2.0531130203        0.0308839449       -0.2372877644
   H          1.8673688366        1.4235732536        0.3264593237
   O         -0.1205853988       -0.4440058333        2.0811173314
   H          0.4411088963       -0.9826370594        1.5237953767
   H         -0.6955250520        0.0158616115        1.4693999388
   O          1.4861242014       -1.6685466956        0.1843000869
   H          0.8380985565       -1.7673785957       -0.5132146864
   H          1.9738269533       -2.4921533490        0.1772328187
   O         -0.3816924586       -1.6990291427       -1.7423702339
   H         -0.2957087372       -0.7975588357       -2.0525152408
   H         -1.2249223400       -1.7177100282       -1.2897708176
    24
 Energy=    -282.518479663927
   O         -1.3838336169        1.2679606233        0.3395517767
   H         -0.8336416687        1.9410262365        0.7401804581
   H         -1.0731977961        1.2105695262       -0.5640208484
   O         -0.0692479888        1.0293168220       -2.0867486604
   H          0.1023241444        1.5209961952       -2.8898963661
   H          0.7561292400        1.0639071046       -1.6032325981
   O          1.0595544349        2.0001170126        1.8803075387
   H          0.7444463807        1.1352687233        2.1429407252
   H          1.3670801536        2.4006249447        2.6934822853
   O         -2.6246555998       -1.4438422717       -0.2082706604
   H         -2.6900083757       -0.5282551935        0.0631352294
   H         -2.8878595814       -1.9427600801        0.5650575523
   O          2.0885607821        0.9671073736       -0.4831456693
   H          2.0477021824        0.0412471390       -0.2436770060
   H          1.8759393478        1.4336634939        0.3251546166
   O         -0.1633587843       -0.4912364066        2.0863492335
   H          0.4016676690       -1.0432311301        1.5457211060
   H         -0.7048887235       -0.0138127185        1.4578241449
   O          1.4711774995       -1.6563588711        0.1830225096
   H          0.8292890196       -1.7583747769       -0.5196892196
   H          1.9605664237       -2.4789947711        0.1823175117
   O         -0.3989350930       -1.7012916637       -1.7462236967
   H         -0.3268126550       -0.7957653940       -2.0479725474
   H         -1.2369218999       -1.7344711935       -1.2848029882
    24
 Energy=    -280.079099251789
   O         -1.3784493444        1.2943477653        0.3342891929
   H         -0.8203045120        1.9677434564        0.7231907605
   H         -1.0800474130        1.2298194407       -0.5729176317
   O         -0.0710355395        1.0301484057       -2.0922084628
   H          0.1008755690        1.5216368222       -2.8954005614
   H          0.7543548494        1.0642427885       -1.6086796438
   O          1.0799694274        2.0279373615        1.8815546706
   H          0.7636938260        1.1623223140        2.1402285452
   H          1.3855348943        2.4253466973        2.6969854803
   O         -2.6032291497       -1.4816149929       -0.2030865503
   H         -2.6659665960       -0.5779499582        0.1062439492
   H         -2.8722358499       -2.0113871062        0.5473857964
   O          2.0928040225        0.9689969402       -0.4829890764
   H          2.0515868491        0.0424936406       -0.2460827228
   H          1.8800683662        1.4333915558        0.3265249887
   O         -0.1831698742       -0.5152683756        2.0822832834
   H          0.3848477692       -1.0755943508        1.5534897525
   H         -0.7066442670       -0.0323919980        1.4427234315
   O          1.4597844246       -1.6471079708        0.1832872921
   H          0.8227088536       -1.7509393298       -0.5235264074
   H          1.9508562962       -2.4687348780        0.1863666060
   O         -0.4180290237       -1.7018982933       -1.7387510780
   H         -0.3551544297       -0.7938098763       -2.0348153487
   H         -1.2524932942       -1.7448426603       -1.2717853376
    24
 Energy=    -279.619116986419
   O         -1.3716596959        1.3319175268        0.3235447870
   H         -0.8013633273        1.9964229848        0.7101018828
   H         -1.0753401807        1.2597162725       -0.5837663855
   O         -0.0667206295        1.0313406855       -2.0993886142
   H          0.1055978089        1.5224261730       -2.9027398698
   H          0.7586572005        1.0650219666       -1.6158094075
   O          1.0692006111        2.0136418306        1.8803461833
   H          0.7355300700        1.1533633935        2.1349376612
   H          1.3805106314        2.4019008011        2.6980092454
   O         -2.5694690676       -1.5530603102       -0.1403299086
   H         -2.5705808686       -0.6862479026        0.2657080870
   H         -2.8665325660       -2.1429814873        0.5524746258
   O          2.0913763504        0.9690690153       -0.4849425880
   H          2.0493352314        0.0423454827       -0.2490445627
   H          1.8778636312        1.4327490512        0.3247764886
   O         -0.2090958245       -0.4705297562        2.0479465805
   H          0.3598709305       -1.0254483382        1.5144917661
   H         -0.7061528757        0.0446406352        1.4125210572
   O          1.4485392780       -1.6410172351        0.1830701884
   H          0.8170607422       -1.7465765740       -0.5284942324
   H          1.9416802173       -2.4613807761        0.1899632686
   O         -0.4170492011       -1.7009292416       -1.7487290284
   H         -0.3655699558       -0.7907589666       -2.0405711052
   H         -1.2425158248       -1.7521129579       -1.2668401196
    24
 Energy=    -278.351614694974
   O         -1.3627149573        1.3697668622        0.3136576661
   H         -0.7817661421        2.0257351156        0.6989315487
   H         -1.0666235252        1.2899077571       -0.5930860833
   O         -0.0630256194        1.0316489618       -2.1058257984
   H          0.1098877982        1.5225368915       -2.9091699529
   H          0.7622063106        1.0648495569       -1.6219644317
   O          1.0576441151        1.9956841431        1.8791983751
   H          0.7075552744        1.1410137751        2.1306107963
   H          1.3746189454        2.3756534326        2.6985774913
   O         -2.5379725812       -1.6212317032       -0.0731164098
   H         -2.4754228533       -0.8053032812        0.4234519961
   H         -2.8692436229       -2.2609554751        0.5571572075
   O          2.0896054697        0.9711996321       -0.4866845272
   H          2.0455718471        0.0444778822       -0.2511432817
   H          1.8762849596        1.4350123223        0.3230092349
   O         -0.2407049302       -0.4242419898        2.0110639602
   H          0.3298362728       -0.9717310431        1.4716473196
   H         -0.7152746948        0.1199278237        1.3826575689
   O          1.4382435362       -1.6383725071        0.1811823906
   H          0.8109667773       -1.7455323003       -0.5338508160
   H          1.9329654640       -2.4577508497        0.1912415069
   O         -0.4091126452       -1.6990739178       -1.7604047913
   H         -0.3673026490       -0.7873632982       -2.0489658945
   H         -1.2256583641       -1.7565500086       -1.2642380572
    24
 Energy=    -277.076025945048
   O         -1.3555120529        1.4057453691        0.3038304130
   H         -0.7654798244        2.0548599147        0.6869023592
   H         -1.0606700811        1.3188160737       -0.6026701934
   O         -0.0601435279        1.0322972998       -2.1115697986
   H          0.1132946763        1.5230456641       -2.9148860952
   H          0.7649497564        1.0650799639       -1.6274435660
   O          1.0521195579        1.9869306650        1.8784882118
   H          0.6889402057        1.1368569751        2.1268977929
   H          1.3732929221        2.3598531005        2.6994683378
   O         -2.5089195574       -1.6806657465       -0.0190450912
   H         -2.3964480979       -0.9186189519        0.5491685073
   H         -2.8727483576       -2.3556334823        0.5539112770
   O          2.0886405777        0.9724704269       -0.4881435321
   H          2.0432874400        0.0456613805       -0.2531968903
   H          1.8752363568        1.4360552544        0.3216586575
   O         -0.2690184218       -0.3941413078        1.9815970552
   H          0.3031628985       -0.9363045618        1.4385506643
   H         -0.7241052045        0.1728791897        1.3590092175
   O          1.4293258143       -1.6345736333        0.1801327844
   H          0.8061366906       -1.7431150892       -0.5382584101
   H          1.9255137347       -2.4530237673        0.1931237701
   O         -0.4068159784       -1.6980679128       -1.7677280719
   H         -0.3731608594       -0.7849380125       -2.0528472720
   H         -1.2160248391       -1.7613962181       -1.2603796852
    24
 Energy=    -276.654790407652
   O         -1.3503766894        1.4314260831        0.2970739580
   H         -0.7549689211        2.0769904953        0.6778206182
   H         -1.0568438100        1.3394634954       -0.6093548429
   O         -0.0587872141        1.0328315588       -2.1151142614
   H          0.1150419246        1.5235647671       -2.9183553142
   H          0.7661741167        1.0653298061       -1.6307440449
   O          1.0524083507        1.9862265100        1.8783900754
   H          0.6820834999        1.1386956023        2.1249315637
   H          1.3756889140        2.3551186083        2.7003633944
   O         -2.4889117581       -1.7179840439        0.0111563470
   H         -2.3486799055       -0.9933299843        0.6206178810
   H         -2.8740440097       -2.4112476172        0.5471513160
   O          2.0884680371        0.9733325386       -0.4889745976
   H          2.0422457281        0.0464523421       -0.2544784582
   H          1.8751497688        1.4367185312        0.3209640287
   O         -0.2893031678       -0.3835629703        1.9642888089
   H          0.2843545051       -0.9235349674        1.4206170726
   H         -0.7331114432        0.1948546601        1.3440476465
   O          1.4237826699       -1.6314704463        0.1797590142
   H          0.8031462918       -1.7408547297       -0.5407112521
   H          1.9208433101       -2.4493595404        0.1945910668
   O         -0.4087395381       -1.6976981897       -1.7696316463
   H         -0.3798144181       -0.7836226388       -2.0522286467
   H         -1.2139165937       -1.7648554757       -1.2563952016
    24
 Energy=    -276.600744126569
   O         -1.3480485726        1.4446025757        0.2932853459
   H         -0.7500441391        2.0883214534        0.6730860096
   H         -1.0548297982        1.3500550586       -0.6129791615
   O         -0.0582327578        1.0331388733       -2.1168438340
   H          0.1158369927        1.5239056545       -2.9200122650
   H          0.7666328194        1.0654770840       -1.6322998633
   O          1.0525162987        1.9858591843        1.8782893821
   H          0.6785915906        1.1396398474        2.1239008364
   H          1.3768587321        2.3527178652        2.7007542957
   O         -2.4765999761       -1.7350574473        0.0267272044
   H         -2.3210328882       -1.0298962218        0.6550411127
   H         -2.8730861922       -2.4352618324        0.5451327788
   O          2.0883638874        0.9737619173       -0.4894067286
   H          2.0416868634        0.0468490050       -0.2551300792
   H          1.8750724991        1.4370578655        0.3205904862
   O         -0.3010673772       -0.3803178011        1.9551662113
   H          0.2737537763       -0.9190017261        1.4114455933
   H         -0.7400028994        0.2028191265        1.3358772876
   O          1.4210012856       -1.6299269051        0.1796190536
   H          0.8016336440       -1.7397041306       -0.5418825232
   H          1.9184855323       -2.4475417223        0.1953440329
   O         -0.4100045849       -1.6974457859       -1.7701735328
   H         -0.3832824656       -0.7829182589       -2.0515223744
   H         -1.2131253148       -1.7663528491       -1.2539557978
    24
 Energy=    -276.654830351421
   O         -1.3457192276        1.4577796184        0.2894967032
   H         -0.7451224444        2.0996403348        0.6683504544
   H         -1.0528323589        1.3606498883       -0.6166020429
   O         -0.0576782964        1.0334461854       -2.1185734122
   H          0.1166320641        1.5242465621       -2.9216691278
   H          0.7670914444        1.0656243725       -1.6338556810
   O          1.0526241621        1.9854910706        1.8781887028
   H          0.6751049438        1.1406003667        2.1228737620
   H          1.3780246314        2.3503134473        2.7011413188
   O         -2.4642582024       -1.7521279905        0.0423389849
   H         -2.2936630031       -1.0672352410        0.6889076508
   H         -2.8723311193       -2.4585490366        0.5430161664
   O          2.0882597359        0.9741912809       -0.4898388550
   H          2.0411279787        0.0472459123       -0.2557817659
   H          1.8749952878        1.4373972040        0.3202169382
   O         -0.3128304926       -0.3770736790        1.9460401956
   H          0.2631479516       -0.9144485157        1.4022489151
   H         -0.7469067546        0.2107803848        1.3277868183
   O          1.4182199042       -1.6283833774        0.1794788827
   H          0.8001228542       -1.7385534406       -0.5430516939
   H          1.9161258404       -2.4457237685        0.1960982597
   O         -0.4112706019       -1.6971930210       -1.7707152923
   H         -0.3867477853       -0.7822184486       -2.0508081399
   H         -1.2123212313       -1.7678514209       -1.2515263868
    24
 Energy=    -277.076407427222
   O         -1.3415658066        1.4847715845        0.2810434218
   H         -0.7359450760        2.1227521751        0.6584505450
   H         -1.0486801850        1.3823464795       -0.6244724259
   O         -0.0568094698        1.0341292542       -2.1219776014
   H          0.1180716131        1.5250697094       -2.9248635935
   H          0.7677073126        1.0659631386       -1.6368069929
   O          1.0527311847        1.9846722325        1.8779312431
   H          0.6679274509        1.1425303765        2.1207377933
   H          1.3802626667        2.3453447704        2.7018670954
   O         -2.4350300305       -1.7826111352        0.0743025067
   H         -2.2317833579       -1.1389700645        0.7530136398
   H         -2.8671968242       -2.4968630702        0.5426056945
   O          2.0879858059        0.9750766101       -0.4907301226
   H          2.0399160160        0.0480648987       -0.2571269928
   H          1.8747438373        1.4380957327        0.3194383752
   O         -0.3394346421       -0.3751413217        1.9271158622
   H          0.2397855786       -0.9094713151        1.3837676921
   H         -0.7653221671        0.2202489994        1.3103808935
   O          1.4126206146       -1.6252839714        0.1792541175
   H          0.7970600223       -1.7362063033       -0.5453238518
   H          1.9113456083       -2.4420869956        0.1976399919
   O         -0.4144161969       -1.6965901352       -1.7710006239
   H         -0.3939989463       -0.7807579452       -2.0486089373
   H         -1.2111968965       -1.7704304710       -1.2457197832
    24
 Energy=    -278.335233774686
   O         -1.3342696199        1.5366363081        0.2644147527
   H         -0.7207214152        2.1692222680        0.6380796345
   H         -1.0420818035        1.4244358752       -0.6401675724
   O         -0.0559923570        1.0355044371       -2.1275268323
   H          0.1199155118        1.5267766313       -2.9299854873
   H          0.7680451789        1.0667358104       -1.6415036017
   O          1.0585798820        1.9904246947        1.8780437289
   H          0.6629452811        1.1523974014        2.1176587500
   H          1.3889856143        2.3446155414        2.7036421398
   O         -2.3829657077       -1.8340832175        0.1226520158
   H         -2.1310550387       -1.2651987575        0.8500744006
   H         -2.8566124784       -2.5561500613        0.5355806412
   O          2.0881818059        0.9766136929       -0.4920766176
   H          2.0385400500        0.0494644751       -0.2593496016
   H          1.8751616414        1.4392218128        0.3183849650
   O         -0.3877149658       -0.3857550697        1.8980192757
   H          0.1974025962       -0.9174101037        1.3583784661
   H         -0.8010260075        0.2179387887        1.2808000699
   O          1.4032329374       -1.6188854533        0.1791799675
   H          0.7918910022       -1.7310515128       -0.5487703422
   H          1.9032596968       -2.4348197991        0.2005393508
   O         -0.4246143564       -1.6961908182       -1.7670800744
   H         -0.4104220221       -0.7788396638       -2.0400219680
   H         -1.2152297024       -1.7755718936       -1.2333593053
    24
 Energy=    -279.382979609543
   O         -1.3269914033        1.6029841145        0.2415335614
   H         -0.7043277278        2.2296981788        0.6099779517
   H         -1.0365185668        1.4790776498       -0.6620728570
   O         -0.0553500832        1.0375089811       -2.1339492970
   H          0.1217109855        1.5291591299       -2.9359227063
   H          0.7681491644        1.0680553730       -1.6469711176
   O          1.0693650608        2.0024786141        1.8787382493
   H          0.6619655436        1.1689748067        2.1143839080
   H          1.4025531537        2.3492141989        2.7063806654
   O         -2.3195752086       -1.8954993612        0.1764724433
   H         -2.0184634708       -1.4236399810        0.9529467099
   H         -2.8437156492       -2.6177092532        0.5227692963
   O          2.0889709578        0.9777795267       -0.4935721567
   H          2.0379668580        0.0503870793       -0.2621122888
   H          1.8759526608        1.4395859625        0.3173469890
   O         -0.4451546172       -0.4080387387        1.8668993153
   H          0.1467011076       -0.9386087299        1.3335756561
   H         -0.8432369448        0.2035372703        1.2474341544
   O          1.3922725664       -1.6099103009        0.1792360458
   H          0.7863015816       -1.7235406172       -0.5529655363
   H          1.8939052648       -2.4247536276        0.2042725944
   O         -0.4404930490       -1.6966388848       -1.7594265543
   H         -0.4329067530       -0.7774995951       -2.0265543406
   H         -1.2247447853       -1.7825610572       -1.2173947891
    24
 Energy=    -279.925433755419
   O         -1.3144118779        1.6495509188        0.2328120574
   H         -0.6832884463        2.2694163978        0.5984373328
   H         -1.0224582691        1.5133687540       -0.6685476645
   O         -0.0544933211        1.0374891938       -2.1409531553
   H          0.1243719492        1.5299761136       -2.9420122598
   H          0.7680626582        1.0670889294       -1.6523251204
   O          1.0727704808        2.0057280002        1.8761496072
   H          0.6518925955        1.1781222527        2.1088777157
   H          1.4100272092        2.3449351002        2.7052625564
   O         -2.2736543178       -1.9457885657        0.2298954453
   H         -1.9278748127       -1.5503626798        1.0300871366
   H         -2.8390000959       -2.6543976637        0.5372862998
   O          2.0877987796        0.9835206585       -0.4951768879
   H          2.0324135472        0.0563232017       -0.2639428244
   H          1.8765930196        1.4461292140        0.3157591708
   O         -0.4970212566       -0.4156305844        1.8365633222
   H          0.1045585512       -0.9361961220        1.3042616259
   H         -0.8885018843        0.2033990109        1.2203027293
   O          1.3812358911       -1.6083255473        0.1795394239
   H          0.7778073276       -1.7232928111       -0.5545507184
   H          1.8835969357       -2.4226401742        0.2070514087
   O         -0.4404932095       -1.6919051333       -1.7634946365
   H         -0.4428183855       -0.7711823023       -2.0252118544
   H         -1.2130805964       -1.7849102710       -1.2060983555
    24
 Energy=    -281.507822286275
   O         -1.3118192420        1.6405789874        0.2334553952
   H         -0.6742839162        2.2501776731        0.6051676370
   H         -1.0156065330        1.5025597386       -0.6662337501
   O         -0.0527954106        1.0416189510       -2.1399093278
   H          0.1262273633        1.5333787752       -2.9413798275
   H          0.7698581806        1.0711146283       -1.6514393554
   O          1.0529095521        1.9838241251        1.8733947580
   H          0.6181475859        1.1632525694        2.1055072192
   H          1.3958175855        2.3166878740        2.7027605671
   O         -2.2687857091       -1.9508333995        0.2335010092
   H         -1.8997696927       -1.5375063143        1.0140263069
   H         -2.8347836474       -2.6437484824        0.5737169136
   O          2.0827706815        0.9799424008       -0.4980586594
   H          2.0261734666        0.0530707848       -0.2658139553
   H          1.8711997258        1.4437069072        0.3121216004
   O         -0.4792959734       -0.3860246886        1.8425655060
   H          0.1314852558       -0.8835237586        1.2988074665
   H         -0.8780696461        0.2431544195        1.2414456777
   O          1.3784142535       -1.6047087780        0.1791801710
   H          0.7802783983       -1.7193366481       -0.5592816019
   H          1.8821323924       -2.4181208942        0.2085162522
   O         -0.4416916397       -1.6929402825       -1.7705812955
   H         -0.4466212517       -0.7717785731       -2.0307132697
   H         -1.2074894649       -1.7864057514       -1.2039687850
    24
 Energy=    -282.814770631119
   O         -1.3111482947        1.6399046137        0.2369790781
   H         -0.6560047166        2.2233445558        0.6198845051
   H         -1.0086664098        1.4948826331       -0.6595169757
   O         -0.0549631532        1.0437221871       -2.1476204287
   H          0.1246011525        1.5338093066       -2.9499938551
   H          0.7680544269        1.0722644766       -1.6597072802
   O          1.0236858500        1.9426110410        1.8743238548
   H          0.5629483547        1.1352499378        2.1026237660
   H          1.3748997882        2.2617720235        2.7055981037
   O         -2.2321729908       -1.9554012242        0.2802142970
   H         -1.8045612062       -1.5238024345        1.0198780628
   H         -2.8076647513       -2.6061973851        0.6820916796
   O          2.0826020188        0.9774837020       -0.5002480718
   H          2.0255970464        0.0504477016       -0.2687604324
   H          1.8682497757        1.4406686341        0.3095325618
   O         -0.4776977525       -0.3561176623        1.8213431633
   H          0.1596475990       -0.8141722134        1.2734300578
   H         -0.8856020925        0.2802688219        1.2340969354
   O          1.3585703516       -1.5939571431        0.1775523699
   H          0.7686725938       -1.7105724819       -0.5671981508
   H          1.8648529861       -2.4055717225        0.2120706058
   O         -0.4340183879       -1.6903834399       -1.7927121329
   H         -0.4498456712       -0.7675203405       -2.0462965111
   H         -1.1829011370       -1.7906647007       -1.2050471460
    24
 Energy=    -283.327352865581
   O         -1.3191433811        1.6436051689        0.2290076190
   H         -0.6554554048        2.2136507898        0.6173349296
   H         -1.0168280556        1.4995016504       -0.6676926988
   O         -0.0531263164        1.0433489393       -2.1447334586
   H          0.1250665118        1.5311036085       -2.9488320462
   H          0.7712626617        1.0717539673       -1.6591329980
   O          1.0229591971        1.9337826782        1.8780682218
   H          0.5566037523        1.1285801891        2.1025529440
   H          1.3735548938        2.2483304892        2.7113593906
   O         -2.2091549054       -1.9469108256        0.3040568096
   H         -1.7588225565       -1.5030282083        1.0226671613
   H         -2.7864027985       -2.5770003903        0.7353384466
   O          2.0799949675        0.9805538304       -0.5043825066
   H          2.0228885823        0.0528138967       -0.2757576695
   H          1.8640113190        1.4412546080        0.3063811439
   O         -0.4918730047       -0.3626694203        1.8158920114
   H          0.1564948054       -0.8093700588        1.2715487720
   H         -0.8998834401        0.2742223444        1.2292675961
   O          1.3586145552       -1.5935557585        0.1740857121
   H          0.7720515525       -1.7117275642       -0.5730495555
   H          1.8657715620       -2.4044888816        0.2116500619
   O         -0.4355304361       -1.6915584185       -1.8030410838
   H         -0.4529903069       -0.7684069199       -2.0554659313
   H         -1.1811738968       -1.7927286224       -1.2114227446
    24
 Energy=    -283.528220474679
   O         -1.3301949561        1.6424687417        0.2293671673
   H         -0.6565073314        2.1948566418        0.6259077482
   H         -1.0282045670        1.5025716739       -0.6681084342
   O         -0.0633870078        1.0428072301       -2.1507804970
   H          0.1132499086        1.5275263499       -2.9570550251
   H          0.7627450382        1.0706892659       -1.6681209123
   O          1.0225496872        1.9202879066        1.8838772668
   H          0.5570809918        1.1128166447        2.1019618713
   H          1.3668528550        2.2323213981        2.7207298636
   O         -2.1864745211       -1.9249937658        0.3215459026
   H         -1.7156490252       -1.4374567404        0.9974622002
   H         -2.7570778485       -2.5198154922        0.8081985473
   O          2.0900023858        0.9865476479       -0.5008554838
   H          2.0351208942        0.0568800065       -0.2796362747
   H          1.8712900733        1.4402432870        0.3131205793
   O         -0.5022071997       -0.3766983995        1.8073053104
   H          0.1619410208       -0.8181755955        1.2779312776
   H         -0.9048668203        0.2538465537        1.2102206163
   O          1.3558875083       -1.5884684520        0.1606472412
   H          0.7709794321       -1.7109084905       -0.5870979155
   H          1.8634985040       -2.3988557677        0.2034878251
   O         -0.4365887740       -1.6978737771       -1.8031409977
   H         -0.4502635745       -0.7740845810       -2.0534575195
   H         -1.1835835118       -1.7976892649       -1.2129990063
    24
 Energy=    -283.708310192365
   O         -1.3250750996        1.6502836778        0.2266778535
   H         -0.6518372476        2.2047471359        0.6210798162
   H         -1.0250067511        1.5104981574       -0.6714595717
   O         -0.0581732766        1.0420665975       -2.1446070700
   H          0.1174266456        1.5257514874       -2.9517287675
   H          0.7686034320        1.0704935056       -1.6630844587
   O          1.0234915786        1.9254061851        1.8843506125
   H          0.5590237031        1.1173491224        2.1023992676
   H          1.3669496923        2.2381141721        2.7212986867
   O         -2.1914865489       -1.9416766406        0.3174965297
   H         -1.7223203269       -1.4661635684        1.0030636047
   H         -2.7699042026       -2.5385557464        0.7922598296
   O          2.0849138920        0.9873758563       -0.5055249313
   H          2.0295234575        0.0575106755       -0.2852648911
   H          1.8669999783        1.4403530784        0.3090651512
   O         -0.4993379242       -0.3748320544        1.8069361032
   H          0.1619475485       -0.8178152009        1.2752413642
   H         -0.8999431405        0.2593699107        1.2123478691
   O          1.3602702737       -1.5861190152        0.1671565472
   H          0.7726699353       -1.7090625806       -0.5783919502
   H          1.8668578571       -2.3971593930        0.2097519200
   O         -0.4439942685       -1.6976428367       -1.8042306364
   H         -0.4600114385       -0.7739046667       -2.0545965357
   H         -1.1907171669       -1.7993144061       -1.2140614700
    24
 Energy=    -283.779560318936
   O         -1.3205899219        1.6559803159        0.2270529185
   H         -0.6460712289        2.2087647234        0.6216232819
   H         -1.0213148659        1.5165441838       -0.6714034499
   O         -0.0584124267        1.0416114170       -2.1428566240
   H          0.1162994896        1.5239983681       -2.9509472227
   H          0.7690391539        1.0703810674       -1.6625150487
   O          1.0242206935        1.9269778666        1.8851756082
   H          0.5606621421        1.1180453862        2.1019094349
   H          1.3655080780        2.2398395162        2.7229538303
   O         -2.1933824164       -1.9526764606        0.3185255055
   H         -1.7232427142       -1.4778619336        1.0039098250
   H         -2.7780972971       -2.5431883358        0.7935371617
   O          2.0849501216        0.9907069357       -0.5065625185
   H          2.0297469494        0.0603659281       -0.2882735834
   H          1.8673853489        1.4419142455        0.3091024699
   O         -0.4997907877       -0.3749282221        1.8035281370
   H          0.1622702938       -0.8168814368        1.2719415303
   H         -0.8982150746        0.2617492850        1.2101212954
   O          1.3602758855       -1.5844342511        0.1643950475
   H          0.7706527240       -1.7094095485       -0.5792161025
   H          1.8662088630       -2.3958017628        0.2085133347
   O         -0.4462554745       -1.6983405122       -1.8011323826
   H         -0.4644260873       -0.7743122240       -2.0502777045
   H         -1.1926565487       -1.8025008909       -1.2109901184
    24
 Energy=    -284.029305168419
   O         -1.2973478889        1.6846653953        0.2357141791
   H         -0.6124544273        2.2209918891        0.6350970509
   H         -1.0012805022        1.5484812358       -0.6643023859
   O         -0.0646950566        1.0391604701       -2.1357618327
   H          0.1033755496        1.5116073800       -2.9511010434
   H          0.7677132781        1.0705688389       -1.6642305839
   O          1.0271165965        1.9279622930        1.8941709806
   H          0.5689019817        1.1135401838        2.1015060593
   H          1.3527417628        2.2416054837        2.7378700028
   O         -2.2055089301       -2.0050588286        0.3321005849
   H         -1.7319124218       -1.5083163061        0.9993224773
   H         -2.8252245395       -2.5411813088        0.8268298944
   O          2.0894534627        1.0118935280       -0.5105778854
   H          2.0360833613        0.0782598227       -0.3063437633
   H          1.8740585501        1.4503222512        0.3125971423
   O         -0.5016315401       -0.3807282603        1.7756302773
   H          0.1684883036       -0.8124787178        1.2457597482
   H         -0.8881196793        0.2702756657        1.1899233142
   O          1.3743552600       -1.5675526021        0.1511637501
   H          0.7711872263       -1.7058864417       -0.5790991559
   H          1.8750682487       -2.3814774404        0.2063425559
   O         -0.4682873632       -1.7070498516       -1.7953597557
   H         -0.4998022123       -0.7810754651       -2.0357970442
   H         -1.2140971245       -1.8279113708       -1.2076590385
    24
 Energy=    -284.154488619683
   O         -1.2896800817        1.7066550844        0.2381490770
   H         -0.5951849355        2.2262342301        0.6430513409
   H         -0.9934950141        1.5699180189       -0.6617449282
   O         -0.0673992319        1.0402131708       -2.1269568248
   H          0.0948004330        1.5036843924       -2.9486121878
   H          0.7689526269        1.0749375630       -1.6626922184
   O          1.0284982610        1.9167269755        1.9050568327
   H          0.5680628409        1.1020673644        2.1064539081
   H          1.3444281870        2.2296922674        2.7526846095
   O         -2.2055301607       -2.0365490048        0.3485456354
   H         -1.7256567467       -1.5245943216        0.9995876838
   H         -2.8560582869       -2.5213898252        0.8564574151
   O          2.0899285066        1.0273670212       -0.5161870601
   H          2.0407748488        0.0922405896       -0.3178078404
   H          1.8760619952        1.4596614673        0.3106227531
   O         -0.5078152025       -0.3853109883        1.7591102914
   H          0.1683120956       -0.8051072513        1.2272693241
   H         -0.8879164623        0.2785834566        1.1837851326
   O          1.3815435954       -1.5554916075        0.1185132936
   H          0.7741576347       -1.7047993010       -0.6060702747
   H          1.8795997620       -2.3701262249        0.1859101413
   O         -0.4746434987       -1.7124068749       -1.7800363181
   H         -0.5167610742       -0.7856243965       -2.0156890025
   H         -1.2185129034       -1.8446384519       -1.1923246891
    24
 Energy=    -284.245916223583
   O         -1.2898679307        1.7085686667        0.2431494572
   H         -0.5935171838        2.2242373477        0.6498597825
   H         -0.9921120551        1.5701512091       -0.6559689366
   O         -0.0731849241        1.0400178016       -2.1284592152
   H          0.0885000795        1.5020320528       -2.9510360392
   H          0.7634511365        1.0755840566       -1.6647707598
   O          1.0304597108        1.9120801167        1.9071890839
   H          0.5693983098        1.0974910425        2.1074360932
   H          1.3438703012        2.2252685232        2.7556692922
   O         -2.2054027259       -2.0384656980        0.3523534230
   H         -1.7252797617       -1.5198882802        0.9979471351
   H         -2.8634018546       -2.5091400211        0.8639535287
   O          2.0941931200        1.0330770794       -0.5147161229
   H          2.0456844569        0.0976600056       -0.3175521104
   H          1.8815230242        1.4641526512        0.3130381412
   O         -0.5102458609       -0.3887502112        1.7516484145
   H          0.1670527013       -0.8066418775        1.2197978218
   H         -0.8898198719        0.2764679538        1.1775053982
   O          1.3870684921       -1.5520886147        0.1163658841
   H          0.7776301127       -1.7034214922       -0.6060710072
   H          1.8836196537       -2.3674321166        0.1862497723
   O         -0.4776748215       -1.7139176631       -1.7816900167
   H         -0.5214942356       -0.7869483733       -2.0162952910
   H         -1.2206257724       -1.8479163190       -1.1932173456
    24
 Energy=    -284.308064627245
   O         -1.2933298498        1.7093514541        0.2496751351
   H         -0.5939449814        2.2188750599        0.6589163121
   H         -0.9936311094        1.5684635993       -0.6484134560
   O         -0.0791161161        1.0401076657       -2.1253845236
   H          0.0808304974        1.4988083316       -2.9501527455
   H          0.7583962801        1.0778512009       -1.6634535203
   O          1.0334969051        1.9018779325        1.9116545958
   H          0.5710645112        1.0877246320        2.1105076176
   H          1.3427884509        2.2158878321        2.7613418104
   O         -2.2073951033       -2.0379833432        0.3548130893
   H         -1.7291416276       -1.5067983469        0.9914825111
   H         -2.8786884729       -2.4844848325        0.8707912594
   O          2.0968337879        1.0411177688       -0.5157249012
   H          2.0510022259        0.1053414418       -0.3196280531
   H          1.8860182941        1.4706517682        0.3133041760
   O         -0.5094589789       -0.3934100883        1.7433568889
   H          0.1685178531       -0.8087653061        1.2103847524
   H         -0.8891233289        0.2737217310        1.1714985524
   O          1.3953605169       -1.5459176098        0.1097066667
   H          0.7837464458       -1.7004648154       -0.6102066817
   H          1.8894240274       -2.3623522363        0.1843229397
   O         -0.4800842703       -1.7159888692       -1.7825386539
   H         -0.5263608058       -0.7890179729       -2.0166652857
   H         -1.2218085251       -1.8519206549       -1.1929629425
    24
 Energy=    -284.360153111447
   O         -1.2954632001        1.7154311989        0.2549694044
   H         -0.5920880021        2.2183077500        0.6655913050
   H         -0.9949475813        1.5709348655       -0.6422724874
   O         -0.0859562957        1.0406265730       -2.1208414191
   H          0.0721330518        1.4956945770       -2.9479766619
   H          0.7523487218        1.0811672746       -1.6605882397
   O          1.0365360903        1.8918469936        1.9141606371
   H          0.5711280565        1.0788802900        2.1109151570
   H          1.3414282001        2.2058899569        2.7654242029
   O         -2.2030096270       -2.0440143608        0.3587264189
   H         -1.7198105914       -1.5140947693        0.9927104554
   H         -2.8948517573       -2.4610162115        0.8722395768
   O          2.0983780626        1.0485320864       -0.5181107799
   H          2.0563033947        0.1122440552       -0.3236209728
   H          1.8898946625        1.4758208267        0.3126664733
   O         -0.5119980659       -0.3970258525        1.7356867750
   H          0.1669376366       -0.8081704887        1.2006744014
   H         -0.8922587248        0.2729885283        1.1676072023
   O          1.4012371709       -1.5388340306        0.1030951705
   H          0.7891130900       -1.6964099771       -0.6157273185
   H          1.8925911713       -2.3563574574        0.1834601684
   O         -0.4825308577       -1.7183327640       -1.7824390783
   H         -0.5312630007       -0.7910463299       -2.0148113818
   H         -1.2217507635       -1.8565103945       -1.1902459397
    24
 Energy=    -284.500404573821
   O         -1.3050557932        1.7241815690        0.2738426839
   H         -0.5930202011        2.2145913063        0.6846168860
   H         -1.0056718305        1.5718589030       -0.6224825296
   O         -0.1033192831        1.0386405158       -2.1038833786
   H          0.0487837461        1.4832974218       -2.9377759044
   H          0.7371990168        1.0883478897       -1.6485922580
   O          1.0488151178        1.8696953564        1.9198025919
   H          0.5795900030        1.0576421097        2.1111900423
   H          1.3391964139        2.1863797402        2.7751513769
   O         -2.2051593213       -2.0522187772        0.3556412634
   H         -1.7201092983       -1.5247076142        0.9902200908
   H         -2.9530741740       -2.3914699696        0.8473361297
   O          2.0996832835        1.0695861598       -0.5285802324
   H          2.0698583901        0.1318568169       -0.3388277748
   H          1.8988707681        1.4901291212        0.3075117430
   O         -0.5078188995       -0.4061752539        1.7254066542
   H          0.1696050049       -0.8114333697        1.1840245771
   H         -0.8924731084        0.2672219603        1.1643280755
   O          1.4147367172       -1.5262236437        0.0878225745
   H          0.8009435519       -1.6907027037       -0.6280240774
   H          1.8974624125       -2.3472360206        0.1834594924
   O         -0.4810753886       -1.7216790489       -1.7845805140
   H         -0.5350777814       -0.7936128002       -2.0126344983
   H         -1.2149858393       -1.8650728292       -1.1870476579
    24
 Energy=    -284.662872763426
   O         -1.3112024044        1.7254111912        0.3066402589
   H         -0.5869994381        2.2022324977        0.7121070826
   H         -1.0219970475        1.5688010627       -0.5922843037
   O         -0.1286077550        1.0370751851       -2.0806288308
   H          0.0126707905        1.4655909373       -2.9248127341
   H          0.7158053075        1.1015191510       -1.6344837927
   O          1.0619133457        1.8497917523        1.9243638995
   H          0.5903941840        1.0368349779        2.1060306356
   H          1.3285323195        2.1702676039        2.7860142876
   O         -2.1970462169       -2.0513733532        0.3442417155
   H         -1.7075557778       -1.5392096802        0.9879181265
   H         -3.0181915362       -2.2693059796        0.7852151558
   O          2.0940029493        1.0858675241       -0.5460252555
   H          2.0827105230        0.1458739197       -0.3657023653
   H          1.9049781579        1.4945559201        0.2986493938
   O         -0.5017800344       -0.4154234244        1.7168196528
   H          0.1728013249       -0.8083724125        1.1629578266
   H         -0.8983550005        0.2614361059        1.1683478555
   O          1.4291146395       -1.5092579426        0.0710752220
   H          0.8167193904       -1.6804581717       -0.6443927231
   H          1.8983883327       -2.3352796800        0.1881313207
   O         -0.4802907483       -1.7303986053       -1.7889011591
   H         -0.5353477755       -0.7993163509       -2.0040439008
   H         -1.2122141619       -1.8822471372       -1.1910199166
    24
 Energy=    -284.839556092771
   O         -1.3205268796        1.7306700611        0.3316596807
   H         -0.5860823535        2.1976928531        0.7300474188
   H         -1.0440823424        1.5743313353       -0.5713178720
   O         -0.1576569938        1.0307340653       -2.0609122017
   H         -0.0267905347        1.4445311430       -2.9140697419
   H          0.6900864631        1.1094296732       -1.6234537778
   O          1.0725335122        1.8347164292        1.9251204557
   H          0.6007102502        1.0198445761        2.0971626378
   H          1.3152604200        2.1591693147        2.7923262060
   O         -2.1945219381       -2.0493384631        0.3302867755
   H         -1.6995582592       -1.5599192664        0.9873344499
   H         -3.0685533935       -2.1432846077        0.7090676845
   O          2.0889665176        1.1044409545       -0.5592626711
   H          2.0918896658        0.1626962679       -0.3879727399
   H          1.9140040016        1.5028919211        0.2932962917
   O         -0.4847908028       -0.4283643704        1.7249803378
   H          0.1859969355       -0.8109305874        1.1593667420
   H         -0.8926606066        0.2509436029        1.1879377505
   O          1.4360094915       -1.5039905005        0.0594015180
   H          0.8240787364       -1.6805087866       -0.6551710015
   H          1.8914258447       -2.3347393532        0.1960914185
   O         -0.4695721432       -1.7316019717       -1.8010737116
   H         -0.5256465384       -0.7978702400       -2.0041317212
   H         -1.1971305100       -1.8905371175       -1.1997166775
    24
 Energy=    -284.962549929272
   O         -1.3231135700        1.7149077701        0.3426684503
   H         -0.5904263128        2.1916238151        0.7327236203
   H         -1.0559081908        1.5642422821       -0.5640470708
   O         -0.1629068401        1.0281239172       -2.0606707871
   H         -0.0351935866        1.4404993317       -2.9149937252
   H          0.6854564709        1.1106549869       -1.6251249743
   O          1.0739785372        1.8447860670        1.9241582324
   H          0.6106404557        1.0248556143        2.0952246379
   H          1.3082005718        2.1736633249        2.7920358896
   O         -2.1911110872       -2.0302775627        0.3110059055
   H         -1.6965929354       -1.5556899108        0.9791751941
   H         -3.0765353799       -2.0954273937        0.6687923802
   O          2.0762754826        1.0993970318       -0.5633612826
   H          2.0805779472        0.1577451097       -0.3915911271
   H          1.9055155587        1.4982095100        0.2898804742
   O         -0.4719411830       -0.4288364258        1.7431292604
   H          0.1958653783       -0.8172221746        1.1779542903
   H         -0.8844637709        0.2430987758        1.2003954035
   O          1.4286470961       -1.5155048414        0.0649160093
   H          0.8213896543       -1.6886488152       -0.6544527444
   H          1.8797280036       -2.3482371504        0.2038935484
   O         -0.4581945146       -1.7266199058       -1.8101087938
   H         -0.5085230698       -0.7917428556       -2.0093668619
   H         -1.1858735287       -1.8832412575       -1.2082908441
    24
 Energy=    -285.039887550237
   O         -1.3208094697        1.7033759957        0.3439062155
   H         -0.5908026623        2.1876618770        0.7296380995
   H         -1.0593136784        1.5592225420       -0.5655285391
   O         -0.1701218334        1.0308674479       -2.0654018518
   H         -0.0439680647        1.4439451599       -2.9196172055
   H          0.6785455595        1.1145669806       -1.6306721836
   O          1.0711388637        1.8565053920        1.9272990749
   H          0.6146314281        1.0328041671        2.0986148459
   H          1.2998696243        2.1891328621        2.7952121151
   O         -2.1849232547       -2.0194657742        0.3050937597
   H         -1.6869887484       -1.5578590808        0.9797880076
   H         -3.0771389098       -2.0582100614        0.6495962198
   O          2.0675181745        1.0922475050       -0.5620119352
   H          2.0706825637        0.1509431194       -0.3883229019
   H          1.8988809641        1.4930647155        0.2907124605
   O         -0.4605478318       -0.4317256009        1.7537072705
   H          0.2061162502       -0.8214898757        1.1881326496
   H         -0.8745408713        0.2385089841        1.2099911641
   O          1.4229904947       -1.5222771969        0.0682784646
   H          0.8185026789       -1.6923409618       -0.6541512112
   H          1.8707583454       -2.3566698866        0.2080090314
   O         -0.4530234420       -1.7252918496       -1.8184294095
   H         -0.5000611124       -0.7894472591       -2.0139139360
   H         -1.1807205892       -1.8816079871       -1.2165540345
    24
 Energy=    -285.142714512783
   O         -1.3180693705        1.6848740272        0.3532268222
   H         -0.5931903649        2.1808850743        0.7336940458
   H         -1.0637430558        1.5503415864       -0.5597085469
   O         -0.1808857878        1.0333221764       -2.0759692618
   H         -0.0576289157        1.4475925492       -2.9300299398
   H          0.6685485324        1.1185976416       -1.6430474782
   O          1.0659408636        1.8674097485        1.9353231420
   H          0.6227954883        1.0368667394        2.1086792103
   H          1.2811816049        2.2102015094        2.8027313919
   O         -2.1714107736       -2.0067207247        0.2997660565
   H         -1.6650284895       -1.5649257248        0.9814008564
   H         -3.0766257599       -1.9648341842        0.6080892412
   O          2.0488178561        1.0924723332       -0.5561774132
   H          2.0486606717        0.1518545594       -0.3787795021
   H          1.8881323492        1.4974568305        0.2961133617
   O         -0.4433286564       -0.4382730241        1.7658115089
   H          0.2221625861       -0.8291846799        1.1996478192
   H         -0.8579075245        0.2314050338        1.2218560871
   O          1.4247800070       -1.5336985068        0.0626911413
   H          0.8223758103       -1.6998999609       -0.6623730630
   H          1.8635728635       -2.3720498234        0.2071201518
   O         -0.4524543113       -1.7201580758       -1.8307069082
   H         -0.4997534368       -0.7835304928       -2.0223404216
   H         -1.1777895929       -1.8784239213       -1.2264946182
    24
 Energy=    -285.248873210151
   O         -1.3186443843        1.6568913377        0.3555329514
   H         -0.6028974270        2.1673960244        0.7341133234
   H         -1.0662777883        1.5314645073       -0.5592408192
   O         -0.1928122362        1.0419044845       -2.0833828780
   H         -0.0679981692        1.4631273886       -2.9338089793
   H          0.6550976188        1.1258732610       -1.6472292784
   O          1.0610288905        1.8789357187        1.9498334217
   H          0.6318263303        1.0424412871        2.1295389256
   H          1.2642408110        2.2350976169        2.8147527576
   O         -2.1643968334       -1.9906164475        0.2984131827
   H         -1.6520465345       -1.5628969355        0.9845509459
   H         -3.0751794112       -1.8602145225        0.5624250649
   O          2.0305706100        1.0883276403       -0.5508105956
   H          2.0324424096        0.1486419314       -0.3685495056
   H          1.8746407337        1.4975644495        0.3003315474
   O         -0.4214232904       -0.4516778976        1.7708516907
   H          0.2405112764       -0.8454306824        1.2024915815
   H         -0.8366381856        0.2180639328        1.2274602006
   O          1.4266542885       -1.5367461930        0.0560290681
   H          0.8226043324       -1.6965600774       -0.6691019634
   H          1.8545978509       -2.3803759683        0.2022650068
   O         -0.4468458469       -1.7143102029       -1.8411530610
   H         -0.4943609144       -0.7782504208       -2.0354884483
   H         -1.1666620999       -1.8692768352       -1.2295308372
    24
 Energy=    -285.331546647170
   O         -1.3231373858        1.6391190252        0.3512857365
   H         -0.6156519644        2.1587925975        0.7329080587
   H         -1.0661597351        1.5185291531       -0.5628545207
   O         -0.1939331224        1.0485877686       -2.0896076098
   H         -0.0639259542        1.4793030205       -2.9344829545
   H          0.6513327057        1.1274979535       -1.6474190726
   O          1.0555461024        1.8797419201        1.9548938453
   H          0.6336571509        1.0410296833        2.1414503684
   H          1.2558872662        2.2445860807        2.8168590399
   O         -2.1622593570       -1.9818719336        0.3001236972
   H         -1.6457906319       -1.5548342435        0.9835933068
   H         -3.0717492983       -1.8077610049        0.5424979350
   O          2.0249865972        1.0922661712       -0.5447196583
   H          2.0304138656        0.1529919858       -0.3604199315
   H          1.8689407970        1.5028109067        0.3057711227
   O         -0.4109467176       -0.4564472951        1.7732189408
   H          0.2491297080       -0.8519869329        1.2039392668
   H         -0.8256113789        0.2139112102        1.2301678078
   O          1.4344732159       -1.5410948535        0.0496692915
   H          0.8292487131       -1.6959324585       -0.6755620214
   H          1.8578867941       -2.3873770471        0.1937499313
   O         -0.4509419208       -1.7116493242       -1.8390553794
   H         -0.4997750303       -0.7769072836       -2.0393164214
   H         -1.1684315993       -1.8630772817       -1.2238237362
    24
 Energy=    -285.409290076658
   O         -1.3330263388        1.6224197586        0.3524804839
   H         -0.6339288640        2.1498056374        0.7389500115
   H         -1.0703213747        1.5078659371       -0.5608077312
   O         -0.1894123851        1.0544978193       -2.0938325362
   H         -0.0537448795        1.4963401441       -2.9320458312
   H          0.6530835192        1.1268461156       -1.6452812959
   O          1.0484895986        1.8757992091        1.9566342133
   H          0.6339118964        1.0350087576        2.1500989015
   H          1.2422330125        2.2511289719        2.8156003935
   O         -2.1636831803       -1.9771949873        0.3102201190
   H         -1.6371841239       -1.5567800652        0.9901332582
   H         -3.0629708164       -1.7142968753        0.5061746299
   O          2.0180852287        1.1021549027       -0.5414186247
   H          2.0379957311        0.1621985456       -0.3616480526
   H          1.8603182771        1.5063801256        0.3117773658
   O         -0.3988785127       -0.4687600816        1.7686623746
   H          0.2619790344       -0.8626480582        1.1991438022
   H         -0.8140357351        0.2019382849        1.2264078017
   O          1.4477073138       -1.5396443850        0.0379561265
   H          0.8375666279       -1.6895889668       -0.6841773832
   H          1.8634498941       -2.3898404111        0.1813320799
   O         -0.4566515891       -1.7064087532       -1.8334241313
   H         -0.5114208510       -0.7733937424       -2.0401005873
   H         -1.1690135095       -1.8567801249       -1.2120057658
    24
 Energy=    -285.465107093154
   O         -1.3381947245        1.6022227352        0.3381713700
   H         -0.6508634299        2.1414865953        0.7293260972
   H         -1.0692562996        1.4952657538       -0.5742233734
   O         -0.1817946417        1.0589910723       -2.0956621531
   H         -0.0381575846        1.5150296466       -2.9248961699
   H          0.6571111383        1.1214629216       -1.6389716668
   O          1.0405878351        1.8826508492        1.9484022953
   H          0.6316333934        1.0407147759        2.1487314074
   H          1.2403331711        2.2620934074        2.8041808798
   O         -2.1740437755       -1.9671395244        0.3127130984
   H         -1.6429977023       -1.5480967395        0.9899317135
   H         -3.0698321009       -1.6893041843        0.5040312624
   O          2.0229283537        1.0991107596       -0.5364391098
   H          2.0530267554        0.1589665023       -0.3590843759
   H          1.8560191410        1.4991081803        0.3170099033
   O         -0.3966966812       -0.4681620591        1.7726438062
   H          0.2650359837       -0.8646525009        1.2059542529
   H         -0.8146044088        0.1964358129        1.2250174375
   O          1.4563232612       -1.5479538648        0.0403520284
   H          0.8428882864       -1.6906747867       -0.6804531534
   H          1.8731804675       -2.3993659271        0.1728639511
   O         -0.4572891834       -1.6989319710       -1.8226322535
   H         -0.5110380682       -0.7678693223       -2.0381902308
   H         -1.1716058424       -1.8432080858       -1.2020132453
    24
 Energy=    -285.512850167082
   O         -1.3457084387        1.5931336690        0.3362973910
   H         -0.6636537568        2.1382151615        0.7286230432
   H         -1.0756330204        1.4905811695       -0.5762671784
   O         -0.1777451351        1.0636718553       -2.0977513583
   H         -0.0328204520        1.5247015500       -2.9239960538
   H          0.6606973644        1.1226603386       -1.6397487667
   O          1.0346611655        1.8866664962        1.9423729611
   H          0.6274900816        1.0442363835        2.1442517707
   H          1.2361185194        2.2668781167        2.7974085734
   O         -2.1802890802       -1.9602254536        0.3126148780
   H         -1.6467066402       -1.5528194196        0.9949212191
   H         -3.0696754466       -1.6528285615        0.4879171369
   O          2.0243001235        1.0981141012       -0.5387817144
   H          2.0604166913        0.1577477241       -0.3637431176
   H          1.8535999574        1.4948453394        0.3154416860
   O         -0.3884604168       -0.4711780975        1.7743534844
   H          0.2747542372       -0.8677824499        1.2094790290
   H         -0.8096124056        0.1885565013        1.2233425031
   O          1.4599861917       -1.5532625028        0.0442962449
   H          0.8443585926       -1.6922309528       -0.6753719210
   H          1.8764057799       -2.4056425078        0.1718693364
   O         -0.4552503412       -1.6975280892       -1.8149914009
   H         -0.5071447600       -0.7664979263       -2.0311433038
   H         -1.1724998410       -1.8408921252       -1.1975517291
    24
 Energy=    -285.557704322590
   O         -1.3534603380        1.5821513959        0.3323071438
   H         -0.6776812106        2.1334161691        0.7268468259
   H         -1.0817933908        1.4856738127       -0.5804474704
   O         -0.1731257052        1.0672686059       -2.0992091536
   H         -0.0289471565        1.5323876089       -2.9232896710
   H          0.6662038975        1.1226037987       -1.6423769368
   O          1.0260971131        1.8922801552        1.9330131117
   H          0.6211841936        1.0488213838        2.1351384899
   H          1.2315336892        2.2708543251        2.7878284433
   O         -2.1884460174       -1.9505630428        0.3129186665
   H         -1.6479486630       -1.5618542423        1.0006685617
   H         -3.0674650982       -1.6088475451        0.4765884995
   O          2.0267048621        1.0913657997       -0.5408426354
   H          2.0666786655        0.1511688938       -0.3657320611
   H          1.8500456995        1.4871374626        0.3126139664
   O         -0.3822965540       -0.4737265646        1.7768047198
   H          0.2840476644       -0.8711506897        1.2162056765
   H         -0.8068952455        0.1784815368        1.2195145048
   O          1.4662293760       -1.5584777114        0.0508354521
   H          0.8469441873       -1.6936857337       -0.6664068262
   H          1.8842068313       -2.4111770402        0.1709626407
   O         -0.4508263982       -1.6920252646       -1.8064340705
   H         -0.5019648651       -0.7614641539       -2.0247748966
   H         -1.1721706125       -1.8347395597       -1.1936314967
    24
 Energy=    -285.604531230072
   O         -1.3624802577        1.5658465625        0.3294351557
   H         -0.6948863404        2.1242911244        0.7277941305
   H         -1.0863933814        1.4750170264       -0.5825724496
   O         -0.1712728375        1.0711536602       -2.0998048576
   H         -0.0293298354        1.5395727846       -2.9224029052
   H          0.6696435972        1.1236324105       -1.6455611227
   O          1.0168660793        1.8961594389        1.9233533799
   H          0.6160838593        1.0507427237        2.1255315925
   H          1.2271600729        2.2725585258        2.7779480227
   O         -2.2007513937       -1.9326516199        0.3097425419
   H         -1.6554974931       -1.5652842208        1.0054229412
   H         -3.0655866592       -1.5488891180        0.4547189044
   O          2.0294700648        1.0863677197       -0.5442307691
   H          2.0688379754        0.1470649376       -0.3642521842
   H          1.8472946591        1.4862330972        0.3061524630
   O         -0.3745656352       -0.4798720883        1.7788962035
   H          0.2924774273       -0.8784363063        1.2199400720
   H         -0.8041830849        0.1652223303        1.2171899831
   O          1.4765947615       -1.5643856296        0.0581068330
   H          0.8546783732       -1.6962481548       -0.6574797239
   H          1.8979402012       -2.4165522778        0.1699632775
   O         -0.4434777698       -1.6860874753       -1.7946192552
   H         -0.4938951537       -0.7567894215       -2.0184385007
   H         -1.1704724043       -1.8266245512       -1.1880222129
    24
 Energy=    -285.654836112938
   O         -1.3901164685        1.5264229929        0.3238554502
   H         -0.7390975937        2.0963989992        0.7331641565
   H         -1.1030550749        1.4488916884       -0.5859887635
   O         -0.1684662075        1.0792566386       -2.1042146099
   H         -0.0327434086        1.5540680400       -2.9241934480
   H          0.6764666277        1.1264334355       -1.6568951558
   O          0.9989888730        1.8962426850        1.9072375678
   H          0.6165354273        1.0421481307        2.1084431694
   H          1.2179397000        2.2684056156        2.7615133596
   O         -2.2342050750       -1.8871835238        0.3001581094
   H         -1.6743533401       -1.5711214510        1.0093143975
   H         -3.0488933574       -1.3946708599        0.3998883384
   O          2.0404553765        1.0738847472       -0.5499726023
   H          2.0803918908        0.1371165941       -0.3573529199
   H          1.8427480613        1.4838264829        0.2921030658
   O         -0.3587871105       -0.4903862909        1.7877400094
   H          0.3103129022       -0.8971377155        1.2372036422
   H         -0.7925093800        0.1397131565        1.2123344834
   O          1.5071093442       -1.5658584595        0.0698236232
   H          0.8784655716       -1.6939808975       -0.6405449347
   H          1.9393303269       -2.4147307265        0.1638062615
   O         -0.4278368831       -1.6795802980       -1.7701126547
   H         -0.4803969239       -0.7543181866       -2.0096106866
   H         -1.1654110154       -1.8158181707       -1.1754232557
    24
 Energy=    -285.719584799774
   O         -1.3960998582        1.5004485148        0.3205906120
   H         -0.7548644230        2.0780336835        0.7346489769
   H         -1.1044577674        1.4305988524       -0.5884186044
   O         -0.1701135365        1.0791264773       -2.1017276882
   H         -0.0360744951        1.5584879412       -2.9193327043
   H          0.6756151799        1.1241889589       -1.6556961299
   O          0.9877019904        1.8970533760        1.9005663187
   H          0.6145546038        1.0392082867        2.1032845235
   H          1.2103698396        2.2695883508        2.7537184514
   O         -2.2431740641       -1.8550510976        0.2934034654
   H         -1.6807563676       -1.5641167411        1.0112303073
   H         -3.0225293777       -1.3033755101        0.3604197421
   O          2.0386066676        1.0760172996       -0.5521755508
   H          2.0763206678        0.1404798751       -0.3532302780
   H          1.8372366923        1.4917264485        0.2861966079
   O         -0.3475583080       -0.5028146084        1.7893109068
   H          0.3198726124       -0.9095743949        1.2367583911
   H         -0.7863692532        0.1236718923        1.2138185447
   O          1.5168365157       -1.5713348650        0.0764259177
   H          0.8876298558       -1.6977374931       -0.6337523661
   H          1.9538164113       -2.4185041052        0.1635160400
   O         -0.4208832883       -1.6738555474       -1.7598221843
   H         -0.4727768616       -0.7511445343       -2.0091077298
   H         -1.1626452155       -1.8049642996       -1.1692025279
    24
 Energy=    -285.764338096166
   O         -1.4045061521        1.4685952924        0.3165086150
   H         -0.7762093009        2.0565813086        0.7357309326
   H         -1.1072833774        1.4075830065       -0.5913283545
   O         -0.1686887803        1.0800602473       -2.1053883356
   H         -0.0339683681        1.5673243915       -2.9181957570
   H          0.6763789086        1.1216485683       -1.6577692423
   O          0.9748935355        1.8997620812        1.8954557248
   H          0.6145975245        1.0374064656        2.1022440626
   H          1.2034224410        2.2746274341        2.7460333795
   O         -2.2536876679       -1.8152229831        0.2843875178
   H         -1.6877109064       -1.5494965656        1.0091575616
   H         -2.9933979676       -1.2089347593        0.3227945774
   O          2.0358829670        1.0743256188       -0.5507463931
   H          2.0732175666        0.1402137722       -0.3451423423
   H          1.8288854779        1.4955882694        0.2834727979
   O         -0.3352361558       -0.5140195211        1.7976429227
   H          0.3298686972       -0.9241389478        1.2447691303
   H         -0.7772263034        0.1081485738        1.2199030061
   O          1.5269098629       -1.5764648039        0.0819393505
   H          0.8979200993       -1.7002810279       -0.6288864086
   H          1.9702338742       -2.4212176954        0.1599663542
   O         -0.4129291428       -1.6707649920       -1.7514829284
   H         -0.4628390863       -0.7511341511       -2.0122892819
   H         -1.1581047436       -1.7942536760       -1.1635239938
    24
 Energy=    -285.821636461479
   O         -1.4185698924        1.4201556004        0.3141234209
   H         -0.8088075334        2.0218806945        0.7411463905
   H         -1.1145472496        1.3735781481       -0.5923161047
   O         -0.1716151760        1.0824497914       -2.1075517096
   H         -0.0376109812        1.5800005995       -2.9142225899
   H          0.6731210899        1.1204878971       -1.6589922560
   O          0.9562543097        1.9015241734        1.8899021392
   H          0.6171482800        1.0317775139        2.1015142584
   H          1.1887203696        2.2811764740        2.7372836953
   O         -2.2729927076       -1.7562320242        0.2710750018
   H         -1.7095080032       -1.5382828073        1.0135135290
   H         -2.9171085454       -1.0487369415        0.2428378725
   O          2.0319445073        1.0752759518       -0.5511207294
   H          2.0735899249        0.1428658892       -0.3387319953
   H          1.8174787625        1.5011245470        0.2788727996
   O         -0.3137229271       -0.5323754245        1.8086213221
   H          0.3494137829       -0.9456846974        1.2557587816
   H         -0.7611756468        0.0827564611        1.2275613708
   O          1.5474588830       -1.5824468392        0.0854597680
   H          0.9166601882       -1.7036331514       -0.6242153158
   H          1.9975959883       -2.4245089948        0.1528374536
   O         -0.4015259090       -1.6672081985       -1.7388198150
   H         -0.4491823141       -0.7519089180       -2.0148414341
   H         -1.1514855160       -1.7811812017       -1.1550368223
    24
 Energy=    -285.882835126855
   O         -1.4338224657        1.3691034911        0.3070106474
   H         -0.8455445205        1.9853080832        0.7434196297
   H         -1.1212645691        1.3382978314       -0.5971964155
   O         -0.1699055648        1.0844755947       -2.1118020086
   H         -0.0357037561        1.5942111842       -2.9107959656
   H          0.6741410049        1.1173704056       -1.6615407959
   O          0.9338577889        1.9042783398        1.8819509179
   H          0.6161302066        1.0278227179        2.0989913894
   H          1.1764631269        2.2871969695        2.7250095238
   O         -2.2940157764       -1.6899573823        0.2572518019
   H         -1.7367079203       -1.5226710747        1.0172880411
   H         -2.8321456698       -0.9024985921        0.1762782786
   O          2.0296605642        1.0730832428       -0.5503145899
   H          2.0735882808        0.1426755729       -0.3297612775
   H          1.8048103069        1.5047470430        0.2739065973
   O         -0.2927905021       -0.5499966940        1.8208257698
   H          0.3692663457       -0.9679021368        1.2701283836
   H         -0.7450973551        0.0562050015        1.2341658554
   O          1.5673681787       -1.5896491006        0.0932936058
   H          0.9341228369       -1.7078952360       -0.6146965273
   H          2.0280286434       -2.4270788256        0.1455930509
   O         -0.3891824174       -1.6641281329       -1.7237033937
   H         -0.4335430931       -0.7541181813       -2.0172095411
   H         -1.1452607530       -1.7670204984       -1.1457842371
    24
 Energy=    -285.957981285316
   O         -1.4459577983        1.3193979357        0.2957260512
   H         -0.8804930952        1.9483954110        0.7438819232
   H         -1.1216694650        1.3042305075       -0.6047398649
   O         -0.1652204404        1.0841121533       -2.1166587031
   H         -0.0299561885        1.6067236821       -2.9071095948
   H          0.6775277892        1.1116640669       -1.6636154893
   O          0.9087489061        1.9059173630        1.8748341277
   H          0.6122392915        1.0235225829        2.0977541597
   H          1.1674264320        2.2908637478        2.7121716094
   O         -2.3152998300       -1.6188720681        0.2440633466
   H         -1.7655586961       -1.5053960930        1.0193953586
   H         -2.7397751656       -0.7693212388        0.1244142016
   O          2.0288205253        1.0713682223       -0.5478696551
   H          2.0735306240        0.1428189132       -0.3197709317
   H          1.7917787460        1.5082914282        0.2701408258
   O         -0.2748304675       -0.5668426301        1.8325972396
   H          0.3874813697       -0.9893412543        1.2857245096
   H         -0.7300948661        0.0308470974        1.2395262851
   O          1.5862094723       -1.5958960255        0.1015846978
   H          0.9505791159       -1.7135087630       -0.6043707782
   H          2.0620821909       -2.4256790970        0.1367564184
   O         -0.3784454646       -1.6647154212       -1.7075895342
   H         -0.4181551807       -0.7610332435       -2.0206606126
   H         -1.1413413489       -1.7545902172       -1.1364991467
    24
 Energy=    -286.185602341768
   O         -1.4388726698        1.3017052365        0.2814475825
   H         -0.8863762621        1.9333934125        0.7418274342
   H         -1.0974164148        1.2910754068       -0.6127148595
   O         -0.1534174794        1.0739860955       -2.1221946737
   H         -0.0155663227        1.6044285698       -2.9069619513
   H          0.6864406948        1.1008702498       -1.6637763829
   O          0.8897810563        1.9035794650        1.8779872616
   H          0.6041488062        1.0191967438        2.1071449805
   H          1.1741503417        2.2865211372        2.7078798000
   O         -2.3298804398       -1.5702257014        0.2368847730
   H         -1.7665497630       -1.4996788596        1.0075426295
   H         -2.6974584912       -0.6932471733        0.1272176514
   O          2.0300684519        1.0750453300       -0.5391422874
   H          2.0731037434        0.1463282614       -0.3114046969
   H          1.7827952083        1.5109185997        0.2763957410
   O         -0.2747434271       -0.5761101155        1.8377092268
   H          0.3903382626       -0.9991061423        1.2945954751
   H         -0.7256540698        0.0225189105        1.2422642490
   O          1.5928599955       -1.5937556893        0.1030212475
   H          0.9571529335       -1.7210887147       -0.6011766451
   H          2.0926108700       -2.4098249076        0.1256472145
   O         -0.3791702338       -1.6801646953       -1.6990978764
   H         -0.4110466189       -0.7819011288       -2.0282457172
   H         -1.1466769795       -1.7553631727       -1.1320789841
    24
 Energy=    -286.486212515659
   O         -1.4436679631        1.2753678229        0.2626233812
   H         -0.9124037030        1.9165280117        0.7347502056
   H         -1.0880578042        1.2768276524       -0.6260672983
   O         -0.1352439985        1.0600228002       -2.1330306864
   H          0.0029644809        1.6004337813       -2.9109035730
   H          0.7017762591        1.0880639302       -1.6695194963
   O          0.8689763873        1.9071786404        1.8785237476
   H          0.5978749355        1.0208543500        2.1176159792
   H          1.1850051331        2.2904137787        2.6967465172
   O         -2.3541342217       -1.5046848160        0.2204637176
   H         -1.8002209610       -1.5045806948        1.0011121204
   H         -2.6048982916       -0.5882855104        0.1040097180
   O          2.0273581097        1.0712675687       -0.5188125670
   H          2.0745851028        0.1424100555       -0.2924827828
   H          1.7672559573        1.5035618599        0.2946370972
   O         -0.2601497614       -0.5915698316        1.8472675530
   H          0.4077425930       -1.0154255324        1.3082889005
   H         -0.7131434172        0.0003075223        1.2466763561
   O          1.6060964241       -1.5945546644        0.1053932140
   H          0.9641916393       -1.7302755408       -0.5915787589
   H          2.1306309107       -2.3952353604        0.1078088706
   O         -0.3814502337       -1.6894135506       -1.6848736272
   H         -0.3997657513       -0.7982758182       -2.0338291026
   H         -1.1580929663       -1.7451460000       -1.1281404775
    24
 Energy=    -286.725904272048
   O         -1.4265378511        1.3136467708        0.2426623925
   H         -0.8910351104        1.9495662731        0.7170831353
   H         -1.0589218203        1.3021344190       -0.6410557525
   O         -0.1030456623        1.0285210388       -2.1419393826
   H          0.0358138450        1.5668760809       -2.9211208286
   H          0.7267145803        1.0751750531       -1.6670149858
   O          0.8710261126        1.9098045546        1.9037998518
   H          0.5874503403        1.0306040609        2.1544452451
   H          1.2317029050        2.2839164323        2.7076558056
   O         -2.3767380967       -1.4885911020        0.2082513460
   H         -1.8032213681       -1.5609072119        0.9711935339
   H         -2.5953040277       -0.5579457681        0.1596711409
   O          2.0268293691        1.0756885852       -0.4909573296
   H          2.0780465618        0.1416954511       -0.2878183016
   H          1.7625123885        1.4862105204        0.3323531310
   O         -0.2672533382       -0.5893924671        1.8466322580
   H          0.4083478512       -1.0118071247        1.3161977853
   H         -0.7151903130       -0.0000146566        1.2398224829
   O          1.6010569754       -1.5901276790        0.0924125988
   H          0.9471279212       -1.7484784692       -0.5884204639
   H          2.1547307742       -2.3708408679        0.0796031778
   O         -0.4051959206       -1.7216505429       -1.6858932807
   H         -0.4013595769       -0.8296538629       -2.0331094171
   H         -1.1896803630       -1.7629168622       -1.1389809564
    24
 Energy=    -287.029289178751
   O         -1.4456430714        1.2669416563        0.2296938605
   H         -0.9315060674        1.9178972639        0.7073462215
   H         -1.0731653190        1.2668680437       -0.6520612974
   O         -0.0925711059        1.0245495124       -2.1455208186
   H          0.0454186512        1.5721867753       -2.9183623905
   H          0.7337741787        1.0749149764       -1.6650537224
   O          0.8558086115        1.9186474046        1.8947516270
   H          0.5797231842        1.0384730234        2.1502936698
   H          1.2419270588        2.2889667196        2.6884820532
   O         -2.4085869419       -1.4126387884        0.1881346306
   H         -1.8839634051       -1.5470685517        0.9773941718
   H         -2.5174112738       -0.4633566480        0.1311037375
   O          2.0264066686        1.0648046772       -0.4878150955
   H          2.0764891574        0.1316693486       -0.2804939849
   H          1.7520610528        1.4781331790        0.3307970670
   O         -0.2418803223       -0.5947158047        1.8664769116
   H          0.4336658113       -1.0291099791        1.3457361290
   H         -0.6999540083       -0.0309782939        1.2430987301
   O          1.6158385904       -1.6077579959        0.1039873550
   H          0.9536066108       -1.7613893020       -0.5698657944
   H          2.1807850264       -2.3795068701        0.0656332222
   O         -0.3924295151       -1.7207954575       -1.6734456742
   H         -0.3728198530       -0.8325785552       -2.0297012505
   H         -1.1897174267       -1.7496843926       -1.1445513034
    24
 Energy=    -287.233323478008
   O         -1.4486952154        1.2747815483        0.2530697502
   H         -0.9206777693        1.9217750589        0.7208611716
   H         -1.0903718304        1.2690424992       -0.6345130656
   O         -0.1164581138        1.0309559335       -2.1319601722
   H          0.0155938571        1.5654825453       -2.9149514992
   H          0.7129597401        1.0907070201       -1.6579056697
   O          0.8789964707        1.9158533347        1.8842826298
   H          0.5947758513        1.0353562832        2.1295894208
   H          1.2319603035        2.2879740360        2.6924747829
   O         -2.3931522796       -1.4534918373        0.1856464713
   H         -1.8868210785       -1.5576540062        0.9912585352
   H         -2.5426508964       -0.5105794476        0.1163772229
   O          2.0210694271        1.0615705213       -0.4966522831
   H          2.0731497933        0.1287126653       -0.2885761047
   H          1.7609017852        1.4767142469        0.3256617234
   O         -0.2322836907       -0.5802313918        1.8650605228
   H          0.4365842881       -1.0190918868        1.3394666369
   H         -0.6984786139       -0.0220105265        1.2427393845
   O          1.6054226549       -1.6076854081        0.0991985885
   H          0.9495782208       -1.7466050170       -0.5840299681
   H          2.1454342091       -2.3977212777        0.0776884479
   O         -0.3912341088       -1.7024539685       -1.6827751032
   H         -0.3765761221       -0.8075580435       -2.0221543408
   H         -1.1840040489       -1.7433238620       -1.1479131454
    24
 Energy=    -287.367168155087
   O         -1.4515259538        1.2650708241        0.2475198218
   H         -0.9297789881        1.9154309344        0.7176726382
   H         -1.0913457736        1.2640188469       -0.6393290781
   O         -0.1067724116        1.0320728483       -2.1390390249
   H          0.0258554340        1.5681347768       -2.9208825537
   H          0.7202169159        1.0957658948       -1.6612695323
   O          0.8765170450        1.9270266638        1.8830538849
   H          0.5894954569        1.0472452789        2.1276661552
   H          1.2356407638        2.2954011994        2.6902479112
   O         -2.4035846710       -1.4481472130        0.1871217277
   H         -1.9156655443       -1.5763556639        1.0005892187
   H         -2.5363120509       -0.5017114460        0.1335062292
   O          2.0259066720        1.0579264951       -0.4970003093
   H          2.0768917282        0.1250999151       -0.2885130535
   H          1.7622432420        1.4732873665        0.3240896871
   O         -0.2267062663       -0.5758896285        1.8684131573
   H          0.4392362505       -1.0189934574        1.3426647372
   H         -0.7004288874       -0.0274586101        1.2430795372
   O          1.6076408070       -1.6179676206        0.0998207086
   H          0.9436140744       -1.7493231199       -0.5769703014
   H          2.1445313394       -2.4097036776        0.0661396686
   O         -0.3961431663       -1.6998817232       -1.6749582760
   H         -0.3791393075       -0.8054653007       -2.0154901717
   H         -1.1903675337       -1.7387432724       -1.1421081337
    24
 Energy=    -287.469304324498
   O         -1.4520485190        1.2482691270        0.2339923962
   H         -0.9433043293        1.9043948718        0.7103433135
   H         -1.0838988573        1.2541684619       -0.6495588838
   O         -0.0932612885        1.0236585273       -2.1414390439
   H          0.0374229419        1.5591019323       -2.9240333398
   H          0.7292766181        1.1005311623       -1.6579580927
   O          0.8683338995        1.9299283753        1.8788078796
   H          0.5841795626        1.0488388807        2.1220556038
   H          1.2408370324        2.2924190928        2.6825950005
   O         -2.4282911522       -1.4140475165        0.1816361870
   H         -1.9918409147       -1.6039787143        1.0120994134
   H         -2.4840428081       -0.4589086053        0.1527700624
   O          2.0304116345        1.0575816367       -0.4912226132
   H          2.0795411429        0.1243128168       -0.2842746941
   H          1.7622486505        1.4715153453        0.3291305662
   O         -0.2077535114       -0.5718934021        1.8776611951
   H          0.4533511583       -1.0274304994        1.3564525913
   H         -0.6950581106       -0.0476468602        1.2421050363
   O          1.6131437851       -1.6260794251        0.0975880227
   H          0.9378408267       -1.7493808599       -0.5694910660
   H          2.1518559751       -2.4153733071        0.0424864430
   O         -0.4053500251       -1.7041975019       -1.6631210713
   H         -0.3773870663       -0.8128956790       -2.0110161322
   H         -1.2039789865       -1.7311851700       -1.1361530572
    24
 Energy=    -287.484644113921
   O         -1.4515975660        1.2476703120        0.2341581274
   H         -0.9428987039        1.9041732003        0.7100375926
   H         -1.0839976578        1.2535491543       -0.6496221545
   O         -0.0926151256        1.0229297624       -2.1418068488
   H          0.0380416723        1.5577448986       -2.9248352079
   H          0.7298350861        1.1004222583       -1.6582756684
   O          0.8686499459        1.9309489757        1.8782957038
   H          0.5850499323        1.0495281094        2.1209891911
   H          1.2399901626        2.2935418625        2.6825746864
   O         -2.4289363582       -1.4143223308        0.1817241236
   H         -1.9936855881       -1.6050579425        1.0126323818
   H         -2.4896174754       -0.4593873249        0.1562530319
   O          2.0306828257        1.0573998311       -0.4907192945
   H          2.0797460212        0.1241278818       -0.2837697562
   H          1.7627557449        1.4713772334        0.3296889147
   O         -0.2063844760       -0.5712175888        1.8790275633
   H          0.4535998880       -1.0281949722        1.3576599862
   H         -0.6943666223       -0.0479030174        1.2432232504
   O          1.6121870385       -1.6260340588        0.0969852050
   H          0.9369948252       -1.7484467149       -0.5703696157
   H          2.1502153011       -2.4157828719        0.0417200199
   O         -0.4062857204       -1.7040185808       -1.6638662987
   H         -0.3780360284       -0.8127881794       -2.0119211315
   H         -1.2048355793       -1.7306047293       -1.1367580180
    24
 Energy=    -287.537817833233
   O         -1.4475460872        1.2464966228        0.2420991152
   H         -0.9359911887        1.9003795473        0.7185238699
   H         -1.0802985029        1.2519149143       -0.6418305731
   O         -0.0961242751        1.0198089599       -2.1405380937
   H          0.0333012212        1.5478974408       -2.9283219709
   H          0.7278576901        1.0996988151       -1.6600142420
   O          0.8701208020        1.9360356831        1.8774411315
   H          0.5949348915        1.0497632928        2.1120169290
   H          1.2222274307        2.3007951000        2.6893545073
   O         -2.4318418247       -1.4254305503        0.1825956367
   H         -2.0105711346       -1.6160654538        1.0207013456
   H         -2.5041098548       -0.4711873092        0.1618831125
   O          2.0331932748        1.0649226209       -0.4954620126
   H          2.0826733856        0.1316385964       -0.2886662480
   H          1.7672582888        1.4788900892        0.3255991048
   O         -0.1974226533       -0.5720742748        1.8829850494
   H          0.4546488479       -1.0365234095        1.3582740828
   H         -0.6888256875       -0.0504755736        1.2484066911
   O          1.6114618103       -1.6212752535        0.0882746798
   H          0.9369408986       -1.7403211509       -0.5803668191
   H          2.1415502469       -2.4167507725        0.0387086826
   O         -0.4133126231       -1.7037727844       -1.6642773465
   H         -0.3900645161       -0.8125434109       -2.0127046266
   H         -1.2079867955       -1.7324870950       -1.1314544041
    24
 Energy=    -287.556888433754
   O         -1.4483422043        1.2416108297        0.2424479104
   H         -0.9354195009        1.8946773950        0.7185216458
   H         -1.0830533438        1.2479171045       -0.6422871456
   O         -0.0958384284        1.0190520924       -2.1411115369
   H          0.0339396555        1.5450248897       -2.9302516420
   H          0.7286083843        1.0986987041       -1.6613452289
   O          0.8678532897        1.9347370136        1.8770179215
   H          0.5990532573        1.0459980753        2.1096581634
   H          1.2126617056        2.3019794747        2.6909417332
   O         -2.4327415854       -1.4211415940        0.1811149332
   H         -2.0213396727       -1.6186219838        1.0225314780
   H         -2.5001366334       -0.4664510806        0.1651220821
   O          2.0327558861        1.0677368250       -0.4938151522
   H          2.0826835357        0.1347123370       -0.2859585317
   H          1.7656019319        1.4823943991        0.3265016775
   O         -0.1898274148       -0.5717296636        1.8858319206
   H          0.4590991391       -1.0376654547        1.3585464133
   H         -0.6868689708       -0.0541092720        1.2523884251
   O          1.6113258680       -1.6200822392        0.0850418863
   H          0.9345993522       -1.7395768717       -0.5812869331
   H          2.1397218540       -2.4167161233        0.0360115209
   O         -0.4157592423       -1.7048194476       -1.6636721516
   H         -0.3898868148       -0.8146697254       -2.0146649288
   H         -1.2100825773       -1.7294129310       -1.1301204296
    24
 Energy=    -287.572460993197
   O         -1.4478735539        1.2384874337        0.2445931436
   H         -0.9326736219        1.8887994595        0.7219767829
   H         -1.0829082628        1.2456728082       -0.6402687364
   O         -0.0967516715        1.0174661566       -2.1393928855
   H          0.0337124533        1.5411560834       -2.9299368834
   H          0.7282648587        1.0962577475       -1.6604654900
   O          0.8633265881        1.9350551616        1.8760111147
   H          0.5989435901        1.0444427971        2.1065389581
   H          1.2015137075        2.3038114978        2.6920258675
   O         -2.4367449303       -1.4167284137        0.1800815056
   H         -2.0358544520       -1.6225354781        1.0245707694
   H         -2.4931055750       -0.4612697392        0.1676702583
   O          2.0333937147        1.0706969899       -0.4946882520
   H          2.0835158486        0.1376929448       -0.2867866801
   H          1.7647734569        1.4851814816        0.3252371124
   O         -0.1825121548       -0.5739338651        1.8876912591
   H          0.4645468101       -1.0399022775        1.3581443068
   H         -0.6852439382       -0.0604569002        1.2553669748
   O          1.6146179963       -1.6177829364        0.0804238833
   H          0.9359660288       -1.7400687786       -0.5834356800
   H          2.1429926025       -2.4145324832        0.0330712162
   O         -0.4176154957       -1.7068850579       -1.6622229647
   H         -0.3897804456       -0.8174391931       -2.0148461397
   H         -1.2121109467       -1.7288174686       -1.1288115028
    24
 Energy=    -287.587622323506
   O         -1.4483744535        1.2337459204        0.2512136126
   H         -0.9253320369        1.8764836485        0.7303239165
   H         -1.0875639944        1.2435710230       -0.6353252303
   O         -0.1008514359        1.0190097007       -2.1334437182
   H          0.0332884490        1.5387923874       -2.9259487907
   H          0.7244618061        1.0943556005       -1.6544730636
   O          0.8578471986        1.9372561329        1.8744593915
   H          0.6012641797        1.0444986552        2.1055028517
   H          1.1796250983        2.3140358716        2.6934391542
   O         -2.4414865295       -1.4133071560        0.1784529672
   H         -2.0559905951       -1.6306956978        1.0271973023
   H         -2.4849153141       -0.4571118007        0.1724344033
   O          2.0341971746        1.0751199400       -0.4956111989
   H          2.0841169323        0.1420472429       -0.2879691998
   H          1.7658518890        1.4894555867        0.3244794177
   O         -0.1686602623       -0.5783276771        1.8864400961
   H          0.4776665743       -1.0425458531        1.3544674039
   H         -0.6808085830       -0.0730342123        1.2550808861
   O          1.6206774185       -1.6158409681        0.0705872935
   H          0.9396975880       -1.7446593409       -0.5896430734
   H          2.1484527258       -2.4133484939        0.0297606925
   O         -0.4224831820       -1.7093763004       -1.6610925031
   H         -0.3988939204       -0.8186622027       -2.0108120807
   H         -1.2147756541       -1.7356558905       -1.1246096405
    24
 Energy=    -287.595858534064
   O         -1.4506185602        1.2328416074        0.2567584609
   H         -0.9254328215        1.8723949515        0.7377816413
   H         -1.0904553800        1.2448671211       -0.6300164319
   O         -0.1032137384        1.0206478488       -2.1319832711
   H          0.0328269703        1.5389206187       -2.9251529261
   H          0.7224484816        1.0934016777       -1.6532133692
   O          0.8537721294        1.9402251889        1.8705578277
   H          0.5989076554        1.0474161072        2.1032977762
   H          1.1691017363        2.3211530416        2.6901266473
   O         -2.4440701747       -1.4148410045        0.1800222313
   H         -2.0637544933       -1.6368249224        1.0299133788
   H         -2.4852101170       -0.4585278018        0.1779237987
   O          2.0342526793        1.0735161930       -0.4990934297
   H          2.0842067894        0.1403436958       -0.2919086873
   H          1.7654031352        1.4873845301        0.3210679947
   O         -0.1636651839       -0.5805619363        1.8872524119
   H          0.4827465977       -1.0432041894        1.3540115712
   H         -0.6802239958       -0.0788880452        1.2566002568
   O          1.6258180361       -1.6162902212        0.0679818607
   H          0.9437915684       -1.7459272969       -0.5910067324
   H          2.1528734997       -2.4143203687        0.0280787032
   O         -0.4210200383       -1.7069618307       -1.6607373012
   H         -0.3914270247       -0.8169499485       -2.0117856496
   H         -1.2158849921       -1.7284526964       -1.1278586208
    24
 Energy=    -287.599607688675
   O         -1.4512669016        1.2335344477        0.2560436024
   H         -0.9265272787        1.8737626573        0.7366557202
   H         -1.0911280082        1.2452592238       -0.6307451814
   O         -0.1034019568        1.0217451790       -2.1319020248
   H          0.0320995656        1.5400950153       -2.9251136136
   H          0.7223382941        1.0950344083       -1.6533484051
   O          0.8551816602        1.9396706164        1.8697809266
   H          0.5990672766        1.0474134122        2.1032639969
   H          1.1719896657        2.3205118677        2.6888196736
   O         -2.4430832610       -1.4159401575        0.1796970654
   H         -2.0603047420       -1.6358383119        1.0290245918
   H         -2.4873175996       -0.4597674024        0.1767262713
   O          2.0345781925        1.0720139199       -0.4993449350
   H          2.0851532548        0.1389061644       -0.2920192981
   H          1.7658782216        1.4858756414        0.3208688427
   O         -0.1655739344       -0.5797716457        1.8869492186
   H          0.4812300589       -1.0425914376        1.3543384092
   H         -0.6806756663       -0.0770963825        1.2559027658
   O          1.6250263213       -1.6171194761        0.0700007181
   H          0.9431360220       -1.7454086854       -0.5893924412
   H          2.1516675154       -2.4153711036        0.0290711224
   O         -0.4201611942       -1.7057475023       -1.6604075540
   H         -0.3927124708       -0.8150958543       -2.0100045358
   H         -1.2146769248       -1.7298553141       -1.1271201951
    24
 Energy=    -287.603098077416
   O         -1.4525192607        1.2329996153        0.2563657812
   H         -0.9276129220        1.8729414288        0.7371772316
   H         -1.0929142278        1.2455046809       -0.6306289671
   O         -0.1047729162        1.0239053407       -2.1314699909
   H          0.0305719474        1.5413729808       -2.9252841060
   H          0.7213903941        1.0969520619       -1.6536099684
   O          0.8553891596        1.9400245162        1.8675820312
   H          0.5999469979        1.0481425171        2.1032250698
   H          1.1709280298        2.3234256294        2.6859160998
   O         -2.4424991608       -1.4169645116        0.1794867247
   H         -2.0592050313       -1.6370926596        1.0285220883
   H         -2.4877470848       -0.4608371942        0.1772465863
   O          2.0347481510        1.0702357819       -0.5003987427
   H          2.0862457170        0.1372366356       -0.2928115715
   H          1.7659753378        1.4841002795        0.3197897677
   O         -0.1656430097       -0.5799421549        1.8872113615
   H          0.4816586087       -1.0430521045        1.3554580077
   H         -0.6799038352       -0.0773057715        1.2554485030
   O          1.6256477821       -1.6185447801        0.0716130758
   H          0.9435966676       -1.7450562711       -0.5879572084
   H          2.1516017406       -2.4171718332        0.0291972345
   O         -0.4189574613       -1.7034023378       -1.6595993138
   H         -0.3933094438       -0.8121704116       -2.0078516260
   H         -1.2135154376       -1.7299734853       -1.1264919734
    24
 Energy=    -287.606741921893
   O         -1.4538209700        1.2321821638        0.2586585559
   H         -0.9271357326        1.8702972124        0.7399523180
   H         -1.0956513522        1.2459989641       -0.6288973359
   O         -0.1079239721        1.0271737290       -2.1302828480
   H          0.0273701003        1.5419137828       -2.9258769851
   H          0.7193483942        1.0992962592       -1.6542044800
   O          0.8541987678        1.9398110163        1.8641145003
   H          0.6012082643        1.0481647874        2.1032685252
   H          1.1647521065        2.3286422501        2.6817933709
   O         -2.4419619111       -1.4185251934        0.1791729703
   H         -2.0594100851       -1.6404682003        1.0280706332
   H         -2.4874568936       -0.4624069839        0.1790459622
   O          2.0348347729        1.0689853530       -0.5032168246
   H          2.0877636615        0.1362270630       -0.2949085311
   H          1.7660092980        1.4831389437        0.3168084844
   O         -0.1643986025       -0.5811723853        1.8882702108
   H          0.4831837603       -1.0443346999        1.3569044293
   H         -0.6786514034       -0.0789954439        1.2561355604
   O          1.6275469946       -1.6196896772        0.0727326688
   H          0.9451986632       -1.7440495467       -0.5869393842
   H          2.1524434851       -2.4189241531        0.0286898854
   O         -0.4168678431       -1.7004142346       -1.6586924773
   H         -0.3930259559       -0.8087197977       -2.0058875745
   H         -1.2116620934       -1.7293927828       -1.1260629780
    24
 Energy=    -287.609535002494
   O         -1.4532758829        1.2297363955        0.2613740038
   H         -0.9233902678        1.8648158281        0.7431698001
   H         -1.0971692819        1.2448506645       -0.6269904978
   O         -0.1113465181        1.0292958106       -2.1305340736
   H          0.0250083926        1.5408996468       -2.9279678910
   H          0.7166776359        1.0999587154       -1.6555450271
   O          0.8523582775        1.9399176278        1.8614103171
   H          0.6032417014        1.0481783082        2.1042554479
   H          1.1559723180        2.3352422570        2.6785815304
   O         -2.4414460124       -1.4190839241        0.1786315119
   H         -2.0609030824       -1.6457703581        1.0271786109
   H         -2.4833048253       -0.4628061006        0.1821534486
   O          2.0334126764        1.0694748885       -0.5058978863
   H          2.0875141306        0.1370416718       -0.2964386566
   H          1.7648658191        1.4843964474        0.3138304378
   O         -0.1620451681       -0.5836584216        1.8912755327
   H          0.4856523692       -1.0464143296        1.3596960845
   H         -0.6769853640       -0.0820044839        1.2592852152
   O          1.6292578473       -1.6193028388        0.0728082781
   H          0.9467464601       -1.7417160037       -0.5870591808
   H          2.1543246501       -2.4182720596        0.0260656108
   O         -0.4153702886       -1.6979123604       -1.6582763947
   H         -0.3923684485       -0.8066191219       -2.0065566244
   H         -1.2106011063       -1.7272559202       -1.1263189320
    24
 Energy=    -287.610769391855
   O         -1.4497736005        1.2293389332        0.2610456098
   H         -0.9186229682        1.8637670161        0.7423063016
   H         -1.0954909222        1.2450810894       -0.6280369557
   O         -0.1112816925        1.0285145596       -2.1335047372
   H          0.0267669411        1.5396400410       -2.9309538936
   H          0.7158415610        1.0991975772       -1.6569516189
   O          0.8520530674        1.9392396303        1.8644169170
   H          0.6031379788        1.0473039307        2.1067469122
   H          1.1534770693        2.3348656090        2.6822527783
   O         -2.4412230990       -1.4183102622        0.1789531670
   H         -2.0599217448       -1.6451182161        1.0271272466
   H         -2.4814273528       -0.4619595861        0.1819267554
   O          2.0313484656        1.0701507378       -0.5060241126
   H          2.0850040146        0.1377114564       -0.2964772000
   H          1.7646299655        1.4854692655        0.3141000257
   O         -0.1617037383       -0.5841442618        1.8929105867
   H          0.4857576720       -1.0468010051        1.3609572993
   H         -0.6766370006       -0.0820214084        1.2612871106
   O          1.6281475910       -1.6185220886        0.0723287954
   H          0.9456324269       -1.7414994486       -0.5874298421
   H          2.1561231609       -2.4154076458        0.0228611675
   O         -0.4162878257       -1.6979366469       -1.6590991944
   H         -0.3931963730       -0.8072926205       -2.0090303920
   H         -1.2115411141       -1.7262256772       -1.1271182003
    24
 Energy=    -287.611797903039
   O         -1.4487757998        1.2292373661        0.2606541071
   H         -0.9167627863        1.8629208953        0.7419431870
   H         -1.0953227919        1.2454959627       -0.6287493273
   O         -0.1115883387        1.0291596894       -2.1349910306
   H          0.0276044716        1.5384935694       -2.9333870477
   H          0.7151973077        1.1000751524       -1.6578869203
   O          0.8530494688        1.9387224923        1.8645219253
   H          0.6036958039        1.0467320636        2.1061987032
   H          1.1515259878        2.3346537605        2.6832905364
   O         -2.4422627476       -1.4178951471        0.1797965293
   H         -2.0608024116       -1.6444882355        1.0279565522
   H         -2.4819682339       -0.4615223320        0.1823170231
   O          2.0299170781        1.0698355307       -0.5061664723
   H          2.0837076829        0.1373826448       -0.2967147446
   H          1.7646449931        1.4852082715        0.3143992150
   O         -0.1615642956       -0.5846261390        1.8929099526
   H          0.4860580164       -1.0478408127        1.3616385087
   H         -0.6760702475       -0.0828783815        1.2606405059
   O          1.6288681889       -1.6186992510        0.0723433410
   H          0.9456441450       -1.7416196233       -0.5866918082
   H          2.1600099644       -2.4131905132        0.0184556021
   O         -0.4164786876       -1.6973873711       -1.6577947182
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 Energy=    -287.589477699544
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 Energy=    -287.580468577535
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 Energy=    -287.568555245620
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 Energy=    -287.540868521058
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 Energy=    -287.514776008569
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 Energy=    -287.474719339218
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 Energy=    -287.420811694122
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 Energy=    -287.382407104759
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 Energy=    -273.332806721181
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 Energy=    -273.363037300541
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 Energy=    -273.369642890332
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 Energy=    -273.380082276192
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 Energy=    -273.386573420129
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 Energy=    -273.397430126289
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 Energy=    -273.410130858652
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 Energy=    -273.428895114875
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 Energy=    -273.433445127516
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 Energy=    -273.439268207525
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 Energy=    -273.443401733735
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 Energy=    -273.446449310974
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 Energy=    -273.447894487859
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 Energy=    -273.454417229507
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 Energy=    -273.455419039993
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 Energy=    -273.455457262053
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 Energy=    -273.455457262053
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 Energy=    -273.454789893296
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 Energy=    -273.447400875062
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 Energy=    -273.444352402953
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 Energy=    -273.441630005764
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 Energy=    -273.438307496444
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 Energy=    -273.435651396389
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 Energy=    -273.428092775103
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 Energy=    -273.426789377941
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 Energy=    -273.425284413343
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 Energy=    -273.423308092877
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 Energy=    -273.418707094110
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 Energy=    -273.415437379358
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 Energy=    -273.413657514186
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 Energy=    -273.412323879819
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 Energy=    -273.409644414714
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 Energy=    -273.408097657852
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 Energy=    -273.404044193745
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 Energy=    -273.401437425574
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 Energy=    -273.399969964123
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 Energy=    -273.397932849749
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 Energy=    -273.393177714733
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 Energy=    -273.385064876561
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 Energy=    -273.371995059486
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 Energy=    -273.358586139082
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 Energy=    -273.289270265455
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 Energy=    -273.276576199677
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 Energy=    -273.224680898097
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 Energy=    -273.190047334962
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 Energy=    -273.166173089546
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 Energy=    -273.115541290978
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 Energy=    -273.082303783280
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 Energy=    -280.334991126182
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 Energy=    -280.345170127337
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 Energy=    -280.349151730946
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 Energy=    -280.365738155610
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 Energy=    -280.367880935360
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 Energy=    -280.369308059477
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 Energy=    -280.371076114763
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 Energy=    -280.374355483851
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 Energy=    -280.376528711916
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 Energy=    -280.378229342379
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 Energy=    -280.379338320772
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 Energy=    -280.384309831551
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 Energy=    -280.157446701941
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 Energy=    -273.027583155564
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 Energy=    -273.139688577571
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 Energy=    -273.290183876588
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 Energy=    -273.632255769643
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 Energy=    -273.679459914133
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 Energy=    -273.738292444105
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 Energy=    -273.795252751625
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 Energy=    -273.847641939185
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 Energy=    -273.916730278338
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 Energy=    -273.926751436802
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 Energy=    -282.316559930426
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 Energy=    -295.066187049748
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 Energy=    -287.504982193593
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 Energy=    -287.526415585796
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 Energy=    -287.686189413932
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 Energy=    -287.695111515227
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 Energy=    -287.699084336874
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 Energy=    -287.704707638700
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 Energy=    -287.709307396162
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 Energy=    -287.727237887854
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 Energy=    -287.728829595290
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 Energy=    -287.729881579641
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 Energy=    -287.731386291981
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 Energy=    -287.733854160637
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 Energy=    -287.694800047711
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 Energy=    -287.691021329061
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 Energy=    -287.686189379954
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 Energy=    -287.682027092769
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 Energy=    -287.668126120531
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 Energy=    -287.579928477331
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 Energy=    -287.477029107310
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 Energy=    -287.470711028940
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 Energy=    -288.962586831882
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 Energy=    -288.527481769167
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 Energy=    -288.221376782747
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 Energy=    -287.874901920064
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 Energy=    -287.636055628603
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 Energy=    -287.085525698850
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 Energy=    -287.030300872775
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 Energy=    -287.012625043158
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 Energy=    -287.010640878123
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 Energy=    -287.009303988669
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 Energy=    -287.010616642241
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 Energy=    -287.012254027314
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