    18
 Energy=    -45.9398026651041
O             0.3242957713       -2.5787422980        1.3812374220
O            -0.1435656068       -3.3690800010        1.1124104830
O             0.1304121936       -1.9033261350        0.7106238413
O             0.1486034167       -0.1682040659        0.0172017200
O             1.1095662340        0.0241384171       -0.0926768250
O            -0.2952710625        0.1983196694       -0.7461592958
O             0.2769343605       -0.0870111145        2.8995314070
O             0.1696456378       -1.0443112950        2.8646738500
O             0.0279120967        0.1781741559        2.0044430290
O             3.2232197110       -2.2100178490        1.4411806130
O             2.3115815920       -2.5222282260        1.5000767050
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O             2.7898504530        0.1616613057        0.0152923134
O             3.0647499540       -0.7405609479        0.2560506307
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O             3.3309977910        0.7734632736        3.6798912040
O             2.0245650290        0.2529325287        3.0388472240
    18
 Energy=    -45.9398026651079
O             0.3242957773       -2.5787422940        1.3812374230
O            -0.1435656277       -3.3690799890        1.1124105000
O             0.1304121900       -1.9033261360        0.7106238431
O             0.1486034137       -0.1682040655        0.0172017167
O             1.1095662300        0.0241384168       -0.0926768272
O            -0.2952710617        0.1983196608       -0.7461593070
O             0.2769343562       -0.0870111191        2.8995314090
O             0.1696456458       -1.0443113030        2.8646738340
O             0.0279120874        0.1781741603        2.0044430380
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O             2.3115816020       -2.5222282310        1.5000767080
O             3.3136675970       -1.5926573430        2.1767666250
O             2.7898504580        0.1616613110        0.0152923113
O             3.0647499580       -0.7405609422        0.2560506302
O             2.9982889690        0.6454623626        0.8233188856
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O             3.3309977890        0.7734632693        3.6798912090
O             2.0245650290        0.2529325299        3.0388472240
    18
 Energy=    -45.9398026650624
O             0.3242957055       -2.5787423830        1.3812373870
O            -0.1435649805       -3.3690803060        1.1124098990
O             0.1304122078       -1.9033261840        0.7106238200
O             0.1486034914       -0.1682040672        0.0172018475
O             1.1095663150        0.0241384112       -0.0926767575
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O             0.2769344477       -0.0870109293        2.8995313580
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O             2.7898503910        0.1616611639        0.0152923022
O             3.0647498350       -0.7405610820        0.2560507128
O             2.9982888930        0.6454622581        0.8233188568
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O             3.3309978220        0.7734634239        3.6798910610
O             2.0245650590        0.2529325561        3.0388471880
    18
 Energy=    -45.9398026650855
O             0.3242956966       -2.5787424020        1.3812373660
O            -0.1435649035       -3.3690803600        1.1124098240
O             0.1304121928       -1.9033261900        0.7106238156
O             0.1486034903       -0.1682040571        0.0172018693
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O            -0.2952711208        0.1983199803       -0.7461589233
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O             2.3115812400       -2.5222280300        1.5000767400
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O             2.7898504030        0.1616611518        0.0152923083
O             3.0647498370       -0.7405611025        0.2560507112
O             2.9982888890        0.6454622443        0.8233188653
O             2.9900276690        0.3183053890        2.9109223660
O             3.3309978360        0.7734634593        3.6798910400
O             2.0245650710        0.2529325754        3.0388471790
    18
 Energy=    -45.9398026650410
O             0.3242957991       -2.5787424430        1.3812373170
O            -0.1435647932       -3.3690803920        1.1124097630
O             0.1304121586       -1.9033261930        0.7106238442
O             0.1486034693       -0.1682039603        0.0172019628
O             1.1095663050        0.0241383428       -0.0926767565
O            -0.2952711201        0.1983199807       -0.7461589046
O             0.2769344261       -0.0870108556        2.8995313430
O             0.1696452747       -1.0443110310        2.8646744450
O             0.0279125194        0.1781738919        2.0044427200
O             3.2232193910       -2.2100179350        1.4411806900
O             2.3115811490       -2.5222280050        1.5000767960
O             3.3136674670       -1.5926574160        2.1767666520
O             2.7898504760        0.1616611359        0.0152922847
O             3.0647498560       -0.7405611175        0.2560507837
O             2.9982887670        0.6454622171        0.8233188900
O             2.9900277070        0.3183053748        2.9109223560
O             3.3309978260        0.7734634494        3.6798910520
O             2.0245651000        0.2529326226        3.0388471000
    18
 Energy=    -45.9398026650238
O             0.3242953185       -2.5787427520        1.3812371080
O            -0.1435635585       -3.3690812720        1.1124082410
O             0.1304117862       -1.9033264980        0.7106236282
O             0.1486034859       -0.1682040682        0.0172020678
O             1.1095662740        0.0241385101       -0.0926765879
O            -0.2952713625        0.1983207740       -0.7461581982
O             0.2769343080       -0.0870103401        2.8995312500
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O             0.0279123838        0.1781732184        2.0044422250
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O             2.3115806400       -2.5222276500        1.5000770320
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O             3.0647498290       -0.7405613910        0.2560505238
O             2.9982892060        0.6454618654        0.8233190290
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O             3.3309981040        0.7734643385        3.6798905230
O             2.0245653060        0.2529330073        3.0388471880
    18
 Energy=    -45.9398026647714
O             0.3242948499       -2.5787431880        1.3812369100
O            -0.1435619261       -3.3690821580        1.1124057310
O             0.1304121113       -1.9033266580        0.7106235257
O             0.1486039119       -0.1682027267        0.0172027704
O             1.1095668340        0.0241387873       -0.0926766773
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O             0.2769349612       -0.0870111686        2.8995320720
O             0.1696432525       -1.0443111400        2.8646774080
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O             3.0647496300       -0.7405624207        0.2560505488
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O             3.3309973070        0.7734671857        3.6798896000
O             2.0245653890        0.2529336249        3.0388466900
    18
 Energy=    -45.9398026645101
O             0.3242945029       -2.5787435060        1.3812355430
O            -0.1435610978       -3.3690824630        1.1124025690
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O             0.1486050034       -0.1682017779        0.0172046176
O             1.1095679850        0.0241393591       -0.0926759701
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O             3.3309966120        0.7734718396        3.6798862930
O             2.0245649100        0.2529338273        3.0388465440
    18
 Energy=    -45.9398026628883
O             0.3242942806       -2.5787453270        1.3812308300
O            -0.1435602334       -3.3690836010        1.1123935440
O             0.1304122525       -1.9033249320        0.7106211477
O             0.1486066558       -0.1681994103        0.0172096449
O             1.1095699320        0.0241385144       -0.0926738340
O            -0.2952715990        0.1983348343       -0.7461440962
O             0.2769340827       -0.0870160495        2.8995342020
O             0.1696449803       -1.0443163110        2.8646827460
O             0.0279153521        0.1781636200        2.0044430350
O             3.2232156990       -2.2100213820        1.4411874410
O             2.3115757620       -2.5222272070        1.5000806070
O             3.3136640050       -1.5926593880        2.1767720290
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O             3.0647508430       -0.7405679779        0.2560491900
O             2.9982916590        0.6454545754        0.8233180737
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O             3.3309953490        0.7734844622        3.6798764870
O             2.0245631980        0.2529355963        3.0388452320
    18
 Energy=    -45.9398026620629
O             0.3242932278       -2.5787464920        1.3812287780
O            -0.1435598093       -3.3690850070        1.1123898650
O             0.1304099882       -1.9033254280        0.7106201274
O             0.1486072336       -0.1681977884        0.0172101086
O             1.1095707950        0.0241400473       -0.0926720884
O            -0.2952704816        0.1983398010       -0.7461423076
O             0.2769344131       -0.0870181529        2.8995358750
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O             2.9982935520        0.6454523628        0.8233174921
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O             3.3309942870        0.7734895226        3.6798737430
O             2.0245628320        0.2529381688        3.0388437330
    18
 Energy=    -45.9398026599560
O             0.3242907829       -2.5787466290        1.3812274070
O            -0.1435581441       -3.3690860640        1.1123838210
O             0.1304095052       -1.9033247790        0.7106190790
O             0.1486084833       -0.1681953707        0.0172119325
O             1.1095723270        0.0241397449       -0.0926718897
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O             3.3309933730        0.7734974730        3.6798678670
O             2.0245620860        0.2529379302        3.0388437890
    18
 Energy=    -45.9398026597206
O             0.3242908674       -2.5787465340        1.3812274770
O            -0.1435581080       -3.3690859120        1.1123835490
O             0.1304094303       -1.9033248580        0.7106191378
O             0.1486084962       -0.1681954863        0.0172118381
O             1.1095723710        0.0241396697       -0.0926717159
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O             3.0647520020       -0.7405724590        0.2560441010
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O             3.3309933010        0.7734976387        3.6798677340
O             2.0245621510        0.2529379653        3.0388439000
    18
 Energy=    -45.9398026562057
O             0.3242910470       -2.5787452520        1.3812277510
O            -0.1435560331       -3.3690843470        1.1123805230
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O             1.1095742400        0.0241412754       -0.0926736536
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O             3.3309941260        0.7735019732        3.6798618750
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    18
 Energy=    -45.9398026527301
O             0.3242902772       -2.5787462850        1.3812264650
O            -0.1435572708       -3.3690853580        1.1123793630
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O             3.3309918730        0.7735076903        3.6798575310
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    18
 Energy=    -45.9398026227189
O             0.3242871248       -2.5787427000        1.3812163470
O            -0.1435761748       -3.3690797650        1.1123908800
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    18
 Energy=    -45.9398023745412
O             0.3242905463       -2.5787709320        1.3812074870
O            -0.1434611168       -3.3691308990        1.1122535490
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O             2.0245170640        0.2529599011        3.0388185000
    18
 Energy=    -45.9398016730479
O             0.3242008692       -2.5787954390        1.3811626420
O            -0.1433812503       -3.3691971500        1.1120316940
O             0.1303693255       -1.9033064680        0.7106101901
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O             2.0245550960        0.2529778753        3.0388273390
    18
 Energy=    -45.9397974727823
O             0.3240945693       -2.5788913110        1.3807791900
O            -0.1433929898       -3.3693327500        1.1116120700
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    18
 Energy=    -45.9397970586348
O             0.3241024740       -2.5789186060        1.3807539890
O            -0.1434028012       -3.3693341500        1.1115473030
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    18
 Energy=    -45.9397967060789
O             0.3240993872       -2.5789288440        1.3807368770
O            -0.1434062891       -3.3693477060        1.1115206330
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    18
 Energy=    -45.9397961613583
O             0.3240833291       -2.5789533170        1.3807096960
O            -0.1434043280       -3.3693743370        1.1114930790
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O             3.3311696800        0.7742964896        3.6795963700
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    18
 Energy=    -45.9397950550454
O             0.3240816390       -2.5789816050        1.3806838690
O            -0.1434019279       -3.3693967140        1.1114157960
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    18
 Energy=    -45.9397947069071
O             0.3240783668       -2.5789848630        1.3806839730
O            -0.1433972576       -3.3693902680        1.1114057450
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    18
 Energy=    -45.9397939256408
O             0.3240670263       -2.5789868320        1.3807068050
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    18
 Energy=    -45.9397815155275
O             0.3237721839       -2.5790649300        1.3803809910
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    18
 Energy=    -45.9395461949185
O             0.3222950038       -2.5793711470        1.3795559800
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    18
 Energy=    -45.9395317111092
O             0.3222742698       -2.5794149250        1.3795444170
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    18
 Energy=    -45.9393336764574
O             0.3222508934       -2.5792651510        1.3795349210
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    18
 Energy=    -45.9389015864740
O             0.3215285655       -2.5803957000        1.3782088460
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    18
 Energy=    -45.9375534131562
O             0.3201742467       -2.5828563000        1.3753609850
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    18
 Energy=    -45.9352049320541
O             0.3206289807       -2.5857508100        1.3734358030
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    18
 Energy=    -45.9351090357104
O             0.3206157230       -2.5858551710        1.3734221060
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    18
 Energy=    -45.9339689412952
O             0.3209934288       -2.5859851960        1.3735964640
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    18
 Energy=    -45.9325619279083
O             0.3223634389       -2.5853988320        1.3743310250
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    18
 Energy=    -45.9307458008270
O             0.3219854030       -2.5861983480        1.3743338820
O            -0.1298322010       -3.3791033330        1.0884372080
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    18
 Energy=    -45.9119734543651
O             0.3272696191       -2.5779885460        1.3713323630
O            -0.1180892187       -3.3703510740        1.0708131260
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    18
 Energy=    -45.9067674014784
O             0.3277891826       -2.5773200000        1.3708574330
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    18
 Energy=    -45.8901413311477
O             0.3215896791       -2.5826193320        1.3643539350
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    18
 Energy=    -45.8650527855059
O             0.3174692338       -2.5858255450        1.3613395310
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O             3.3111939450        0.8230633061        3.6203986330
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    18
 Energy=    -45.7837567197536
O             0.3070946537       -2.6138647940        1.3202576050
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    18
 Energy=    -45.5879026446997
O             0.3003724346       -2.6479671400        1.2479017070
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    18
 Energy=    -45.5688476349286
O             0.3026386182       -2.6502880820        1.2424007430
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    18
 Energy=    -45.3647909259022
O             0.2668115823       -2.6667512450        1.2219088910
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    18
 Energy=    -45.2670355707517
O             0.2219228563       -2.6646297740        1.2332932820
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O             3.0274850600        0.5718285062        0.8384975582
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O             3.3066023300        1.1928654700        3.4688460140
O             2.0854318080        0.3585285577        3.0188594260
    18
 Energy=    -45.0955453527227
O             0.2384969098       -2.6768034890        1.2365474660
O            -0.0071259899       -3.4623891310        0.7519221754
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O             1.1429424900        0.0265114712       -0.0603510447
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O             3.2819621190        1.2280721190        3.4522573270
O             2.1030888650        0.3355623494        3.0168802850
    18
 Energy=    -44.9796347311143
O             0.2527971476       -2.6710108120        1.2283335370
O             0.0057796773       -3.4653434200        0.7518892639
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O             3.2737969790        1.2373467090        3.4485175390
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    18
 Energy=    -44.8776917647623
O             0.2474717752       -2.6659599770        1.2285133930
O             0.0264880102       -3.4692715390        0.7538470506
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    18
 Energy=    -43.3176929338548
O             0.0393306585       -2.6375706250        1.2652047760
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    18
 Energy=    -42.1040510093476
O            -0.1117301102       -2.6610492990        1.2409734550
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    18
 Energy=    -41.8426508195530
O            -0.1986341836       -2.6949073850        1.2105440070
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    18
 Energy=    -41.8051521290218
O            -0.2483569156       -2.7083368740        1.1919160050
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O             3.2621707930        1.4081208640        3.4575148300
O             2.2212198480        0.3414526304        3.0715980890
    18
 Energy=    -41.9876522367577
O            -0.3550965572       -2.7645597110        1.1285785650
O             0.4616738597       -3.2557525950        1.0330014270
O            -0.2672604528       -2.0368864950        0.5011493922
O             0.1850681613       -0.0920109252        0.0463536711
O             1.1372890450        0.0822564222       -0.1120850553
O            -0.3038516266        0.4856544211       -0.5381178547
O             0.6318804401       -0.6181815071        2.7764036240
O             0.1145508570       -1.4337545470        2.7979482320
O             0.3549059377       -0.2338927529        1.9299454200
O             2.7079543720       -2.2685891840        1.5789414140
O             2.0935875920       -1.7340917380        2.1028833280
O             3.4834790880       -2.3636577860        2.1351805400
O             2.8692495540        0.1285533992        0.0361035424
O             3.0175273100       -0.7921710090        0.2969958520
O             3.0867953020        0.6038086371        0.8485594969
O             3.0833031180        0.7531939563        2.8562511620
O             3.2724279870        1.4744988890        3.4552305740
O             2.2219977910        0.4019001907        3.1203090070
    18
 Energy=    -42.0377232409282
O            -0.3375525969       -2.7728763960        1.1377963230
O             0.4919796330       -3.2419492220        1.0242002220
O            -0.2760550344       -2.0375708390        0.5160471923
O             0.1828289873       -0.0924357959        0.0370835925
O             1.1354136610        0.0810755927       -0.1195405075
O            -0.3039201392        0.5023400582       -0.5317734842
O             0.6287990506       -0.6134256442        2.7796516300
O             0.1098560918       -1.4270219910        2.7986364940
O             0.3571159045       -0.2257518396        1.9329292970
O             2.6949013500       -2.3058832290        1.5787022680
O             2.0973702010       -1.7387797880        2.0907494230
O             3.4754512090       -2.4038202200        2.1248866090
O             2.8674508810        0.1262803511        0.0433027219
O             3.0294445080       -0.7916010667        0.3005363958
O             3.0786695280        0.6069244165        0.8548652456
O             3.0761548330        0.7757804177        2.8487851280
O             3.2638237730        1.4882660680        3.4582946620
O             2.2237499380        0.4067667937        3.1184791240
    18
 Energy=    -42.1238988835655
O            -0.2895814958       -2.7885272810        1.1324399550
O             0.5762350781       -3.1932278710        1.0398045850
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O             1.1303744650        0.0884458851       -0.1033881381
O            -0.3040972602        0.5277177530       -0.5156568793
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O             0.3531906004       -0.2154432010        1.9338510400
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O             2.1058037670       -1.7604583310        2.0813084460
O             3.4153284830       -2.5451698900        2.1027389400
O             2.8642638200        0.1199218880        0.0592597025
O             3.0343703240       -0.8023284940        0.2926183559
O             3.0753505950        0.5892663985        0.8778691395
O             3.0627354670        0.8122765327        2.8445541560
O             3.2101654700        1.5495836850        3.4358166870
O             2.2175660920        0.4218939475        3.1064879420
    18
 Energy=    -42.1465295323323
O            -0.2847716049       -2.7929915840        1.1266009470
O             0.5939146334       -3.1754487020        1.0514748790
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O             1.1278373170        0.0898266185       -0.1011846251
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O             0.1313158327       -1.4098090590        2.8170607580
O             0.3576328489       -0.2167653981        1.9318887200
O             2.6566614600       -2.3436614470        1.5390449760
O             2.1050432970       -1.7659356070        2.0882287540
O             3.3999413080       -2.5842046600        2.0951921330
O             2.8686279060        0.1204170397        0.0593401550
O             3.0356116400       -0.8028642161        0.2901519574
O             3.0768646490        0.5824664458        0.8830577457
O             3.0600646070        0.8197437501        2.8456200010
O             3.1996787160        1.5667421160        3.4268552150
O             2.2145258220        0.4298352537        3.1064063020
    18
 Energy=    -42.1556666756577
O            -0.2757260537       -2.7978524060        1.1225320730
O             0.6163081908       -3.1513087690        1.0620552210
O            -0.2682696445       -2.0567975480        0.5057277916
O             0.1737711785       -0.0618756855        0.0613645905
O             1.1279027290        0.0944273442       -0.0994227720
O            -0.3056341445        0.5423303455       -0.5050863165
O             0.6538876108       -0.6033829680        2.7778880370
O             0.1315671935       -1.4126156970        2.8186386330
O             0.3644823769       -0.2243147823        1.9322763610
O             2.6460523230       -2.3499913480        1.5341380180
O             2.1134420580       -1.7663363410        2.0961629960
O             3.3770910460       -2.6346611890        2.0847759050
O             2.8667122700        0.1198665555        0.0631142900
O             3.0406401330       -0.8041951316        0.2849258110
O             3.0806356960        0.5785895124        0.8873979223
O             3.0567198170        0.8317145069        2.8468411680
O             3.1854066790        1.5911105820        3.4127533190
O             2.2104923210        0.4416106880        3.1075492890
    18
 Energy=    -42.1875560675869
O            -0.3003680353       -2.8054460350        1.1109256090
O             0.5985107946       -3.1380912590        1.0382745050
O            -0.3148039619       -2.0598195490        0.5003153561
O             0.1848068388       -0.0644207491        0.0673195387
O             1.1404388610        0.0835099174       -0.0966864688
O            -0.2881808572        0.5724309073       -0.4665490693
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O             0.1339455972       -1.4358041020        2.8244282080
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O             2.1220375900       -1.7702260700        2.1081687680
O             3.3725201680       -2.6593262030        2.0920657100
O             2.8789220910        0.1165237585        0.0596590250
O             3.0596933200       -0.8036366101        0.2913812927
O             3.0773860710        0.5841760416        0.8827573705
O             3.0421784870        0.8660572974        2.8323481570
O             3.1720753430        1.6325891120        3.3896070560
O             2.2089441630        0.4653372850        3.1139620640
    18
 Energy=    -42.2011798629993
O            -0.3106246837       -2.8039206920        1.0970582510
O             0.5810633707       -3.1531114480        1.0144973980
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O             0.1976565171       -0.0601704752        0.0818965096
O             1.1540462550        0.0834239030       -0.0857157695
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O             0.6920045764       -0.6506793680        2.7803190380
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O             2.6487958150       -2.3692559170        1.5292185980
O             2.1110612590       -1.7973164500        2.0992387150
O             3.3626951340       -2.6819175330        2.0871139220
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O             3.0612854260       -0.8174220899        0.3075601259
O             3.0932581520        0.5823970305        0.8761430886
O             3.0285549270        0.9087496128        2.8212305950
O             3.1257179990        1.6880316120        3.3673773410
O             2.2077034130        0.4837414503        3.1030987820
    18
 Energy=    -42.2103044152712
O            -0.3156699000       -2.8063040730        1.0769363830
O             0.5776877724       -3.1532024340        1.0052234440
O            -0.3122151438       -2.0495196540        0.4801443689
O             0.2078938664       -0.0573404486        0.0955425419
O             1.1637050860        0.0868273034       -0.0746901226
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O             0.6971418672       -0.6554581451        2.7908385970
O             0.1347972603       -1.4308721260        2.8899539770
O             0.4078812613       -0.3022535323        1.9331325870
O             2.6442641640       -2.3777424330        1.5221784300
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O             2.8984600770        0.1042169470        0.0652111536
O             3.0672372210       -0.8171489904        0.3021482622
O             3.0950471120        0.5756777911        0.8869929796
O             3.0244522760        0.9200214505        2.8169111380
O             3.0980755870        1.7248308240        3.3284667870
O             2.2076872290        0.4919271526        3.1060672080
    18
 Energy=    -42.2105428457546
O            -0.3155243745       -2.8061663190        1.0752282690
O             0.5784144805       -3.1514134010        1.0041509490
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O             0.2086520463       -0.0572847189        0.0965563070
O             1.1644638180        0.0865518893       -0.0738869324
O            -0.2642550147        0.6045217629       -0.4062162105
O             0.6981756482       -0.6562667176        2.7911272340
O             0.1358740220       -1.4307984790        2.8941549680
O             0.4070532834       -0.3038197175        1.9334045560
O             2.6435427390       -2.3780422870        1.5212859470
O             2.1075116490       -1.8149051570        2.1022357770
O             3.3535667350       -2.7106761120        2.0717083550
O             2.8986263480        0.1041408669        0.0661120284
O             3.0682065240       -0.8172192545        0.3023580875
O             3.0955865000        0.5746852129        0.8882627508
O             3.0243634400        0.9208448118        2.8168569410
O             3.0954971850        1.7283668920        3.3249460230
O             2.2076347230        0.4924762499        3.1058906270
    18
 Energy=    -42.2114309103187
O            -0.3141853387       -2.8073688400        1.0721377620
O             0.5817192816       -3.1475388340        0.9996636085
O            -0.3154776545       -2.0491179690        0.4772992101
O             0.2091619639       -0.0567506772        0.0984577819
O             1.1650964520        0.0861920351       -0.0723090088
O            -0.2629632705        0.6068588818       -0.4025508624
O             0.7026578115       -0.6577547339        2.7918735320
O             0.1375218254       -1.4293699720        2.9019024690
O             0.4091635071       -0.3086619003        1.9337610110
O             2.6418746950       -2.3813539760        1.5196322130
O             2.1061124150       -1.8172591440        2.0999118420
O             3.3478708790       -2.7190605180        2.0722399960
O             2.8991690610        0.1022059692        0.0668391173
O             3.0694921240       -0.8187514745        0.3041540252
O             3.0971002750        0.5749235244        0.8875809906
O             3.0234276270        0.9277540880        2.8157505820
O             3.0891524120        1.7358913040        3.3235384670
O             2.2085877120        0.4954799039        3.1037496010
    18
 Energy=    -42.2116209623471
O            -0.3147390130       -2.8080432280        1.0709732290
O             0.5815204218       -3.1475765930        0.9998553165
O            -0.3155947011       -2.0494676270        0.4765618958
O             0.2089620641       -0.0570690420        0.0982861599
O             1.1648780770        0.0856676968       -0.0725614181
O            -0.2627927430        0.6092424356       -0.3994918388
O             0.7031062140       -0.6583047000        2.7911122880
O             0.1380293852       -1.4297815310        2.9020990960
O             0.4097231207       -0.3103042326        1.9324631230
O             2.6416363940       -2.3814267570        1.5196862080
O             2.1070627120       -1.8175500740        2.1012595460
O             3.3470139230       -2.7218487620        2.0714106060
O             2.8998268580        0.1017072412        0.0670667615
O             3.0696854520       -0.8190265550        0.3056613093
O             3.0969902140        0.5753003462        0.8874777166
O             3.0228162380        0.9294678245        2.8151930410
O             3.0894948830        1.7375482240        3.3229209970
O             2.2078622770        0.4977829998        3.1036583010
    18
 Energy=    -42.2116277965729
O            -0.3148119233       -2.8080973820        1.0708494240
O             0.5815099051       -3.1475115190        0.9999180976
O            -0.3156698339       -2.0495714790        0.4763778520
O             0.2090503407       -0.0570713055        0.0983177570
O             1.1649635810        0.0856622117       -0.0725602019
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O             0.7031877368       -0.6584020971        2.7910442010
O             0.1380106755       -1.4297886040        2.9021401700
O             0.4098263560       -0.3105228578        1.9323334130
O             2.6416570810       -2.3814900090        1.5196494990
O             2.1072036280       -1.8177191160        2.1014195230
O             3.3469409080       -2.7221841140        2.0713326730
O             2.8998080160        0.1016763295        0.0671254858
O             3.0696535290       -0.8190551798        0.3057300737
O             3.0969843240        0.5752846441        0.8875269849
O             3.0226695670        0.9296899254        2.8150620190
O             3.0895116180        1.7377874550        3.3227525260
O             2.2077207410        0.4981091286        3.1036847040
    18
 Energy=    -42.2117400033290
O            -0.3146791004       -2.8091449800        1.0692771710
O             0.5826169750       -3.1460076450        0.9982690981
O            -0.3174046224       -2.0503959670        0.4751612289
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O             1.1656868440        0.0857462972       -0.0718147093
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O             0.7051286874       -0.6594633477        2.7911179150
O             0.1383247630       -1.4290658870        2.9055280410
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O             2.6412440810       -2.3828840450        1.5191964020
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O             2.9006059080        0.1006563300        0.0671165411
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O             3.0976871640        0.5745230144        0.8873950999
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O             3.0861476240        1.7418087240        3.3208863450
O             2.2073184070        0.4997816626        3.1030696750
    18
 Energy=    -42.2117598121768
O            -0.3146572689       -2.8090841620        1.0687991550
O             0.5826650274       -3.1459240600        0.9979636474
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O             0.2097975259       -0.0563734433        0.0996940743
O             1.1657810080        0.0856392226       -0.0715024509
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O             0.7051663369       -0.6594950278        2.7913566220
O             0.1384917377       -1.4290981830        2.9062898270
O             0.4107757197       -0.3132101886        1.9322899350
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O             3.3448722100       -2.7267511050        2.0706557110
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O             3.0214098010        0.9332729790        2.8141541830
O             3.0852822490        1.7427204270        3.3200830660
O             2.2073994110        0.5000189571        3.1028707510
    18
 Energy=    -42.2117969963035
O            -0.3149968142       -2.8091908600        1.0673167480
O             0.5824994018       -3.1457397120        0.9973938420
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O             0.2103635777       -0.0561836104        0.1007970286
O             1.1663817280        0.0856301249       -0.0705934278
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O             3.0836389580        1.7447567080        3.3178252050
O             2.2075186980        0.5004980148        3.1026024910
    18
 Energy=    -42.2118129178813
O            -0.3151345277       -2.8091142050        1.0663301680
O             0.5823818958       -3.1456786100        0.9967117160
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O             0.2108422646       -0.0561568747        0.1013879491
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O             3.0208979380        0.9351414040        2.8131573540
O             3.0821779610        1.7466007240        3.3161606730
O             2.2075166620        0.5010807713        3.1024094630
    18
 Energy=    -42.2118178714831
O            -0.3151779730       -2.8091670230        1.0663969030
O             0.5823233068       -3.1456986290        0.9964579678
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O             0.2108759867       -0.0560406238        0.1013634199
O             1.1668774090        0.0857742253       -0.0702105645
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O             0.4114793264       -0.3153326431        1.9327775060
O             2.6404376890       -2.3841712180        1.5184808170
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O             3.0207511400        0.9353458951        2.8131569420
O             3.0821490420        1.7467599420        3.3162351460
O             2.2074926540        0.5011397076        3.1025578610
    18
 Energy=    -42.2118226969671
O            -0.3152947043       -2.8092690470        1.0661724560
O             0.5822129820       -3.1457736470        0.9961688744
O            -0.3170263314       -2.0493345150        0.4735839487
O             0.2109243928       -0.0559321207        0.1015036714
O             1.1669257230        0.0857683044       -0.0701285422
O            -0.2603317382        0.6134643287       -0.3925871315
O             0.7066947143       -0.6607177786        2.7921317340
O             0.1383758564       -1.4285317920        2.9102648080
O             0.4116156596       -0.3155441985        1.9328068780
O             2.6404488560       -2.3843559200        1.5183868440
O             2.1064312650       -1.8215750290        2.1015850500
O             3.3436811580       -2.7297854160        2.0697403330
O             2.9014762080        0.1001373309        0.0676939632
O             3.0711818880       -0.8206035554        0.3063458482
O             3.0982473590        0.5740264663        0.8880651148
O             3.0206090140        0.9357334142        2.8131341730
O             3.0818544000        1.7472096950        3.3161370940
O             2.2074550760        0.5014011467        3.1026272190
    18
 Energy=    -42.2118250781823
O            -0.3154270570       -2.8092190590        1.0661027860
O             0.5820219063       -3.1458715150        0.9960957559
O            -0.3171112664       -2.0492819830        0.4735112379
O             0.2109312882       -0.0560416686        0.1015055753
O             1.1669489030        0.0856670328       -0.0700473202
O            -0.2602493189        0.6135348346       -0.3924075033
O             0.7068220126       -0.6607618792        2.7920445100
O             0.1384585956       -1.4285167760        2.9103325170
O             0.4116826960       -0.3156873790        1.9327010660
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O             2.1064870910       -1.8215740140        2.1015152820
O             3.3437701210       -2.7297501490        2.0696168520
O             2.9014764200        0.0999979476        0.0677777691
O             3.0710970630       -0.8207174168        0.3066116182
O             3.0982884660        0.5740379861        0.8880495886
O             3.0205821360        0.9359541955        2.8131254460
O             3.0817908810        1.7473555810        3.3162377650
O             2.2074282800        0.5015776218        3.1025485350
    18
 Energy=    -42.2118250888239
O            -0.3154382651       -2.8092137020        1.0661054430
O             0.5820056832       -3.1458751870        0.9960860927
O            -0.3171120936       -2.0492855230        0.4735032878
O             0.2109392560       -0.0560483370        0.1015009878
O             1.1669546270        0.0856629329       -0.0700519621
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O             0.7068269574       -0.6607666606        2.7920459960
O             0.1384647796       -1.4285164080        2.9103414870
O             0.4116905693       -0.3156970893        1.9326969620
O             2.6404874610       -2.3843868820        1.5183068940
O             2.1064850500       -1.8215876960        2.1015185600
O             3.3437739140       -2.7297517240        2.0696109240
O             2.9014782500        0.0999971562        0.0677819475
O             3.0710906130       -0.8207187572        0.3066256378
O             3.0982911850        0.5740435531        0.8880489819
O             3.0205736650        0.9359660972        2.8131207830
O             3.0817886930        1.7473689350        3.3162392880
O             2.2074302550        0.5015855652        3.1025467580
    18
 Energy=    -42.2118254242421
O            -0.3154816400       -2.8092029290        1.0660938090
O             0.5819404043       -3.1459182410        0.9960598528
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O             0.2109669655       -0.0560649822        0.1014835975
O             1.1669774750        0.0856619409       -0.0700956092
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O             0.7068651045       -0.6607893372        2.7920498260
O             0.1384791912       -1.4285192650        2.9103898010
O             0.4117344509       -0.3157440551        1.9326915820
O             2.6405004230       -2.3843905920        1.5183029840
O             2.1064464080       -1.8216778800        2.1015517260
O             3.3437952260       -2.7297766050        2.0695845140
O             2.9015142100        0.1000083777        0.0677805000
O             3.0710800290       -0.8207023043        0.3066745614
O             3.0982804830        0.5740782092        0.8880467999
O             3.0205564510        0.9360274681        2.8131040550
O             3.0817672830        1.7474227100        3.3162257590
O             2.2074265470        0.5016206833        3.1025447850
    18
 Energy=    -42.2118257786338
O            -0.3155393549       -2.8092242270        1.0660501640
O             0.5818781335       -3.1459523220        0.9960261478
O            -0.3171440715       -2.0492591490        0.4734941274
O             0.2109923233       -0.0560623205        0.1015224082
O             1.1670050160        0.0856550761       -0.0700569653
O            -0.2602054122        0.6135658668       -0.3923035204
O             0.7069104065       -0.6608290625        2.7920445710
O             0.1384526367       -1.4284931410        2.9104618560
O             0.4117825453       -0.3158040248        1.9326755670
O             2.6404903980       -2.3844308880        1.5182806880
O             2.1064501540       -1.8217173160        2.1015430260
O             3.3437811310       -2.7298276010        2.0695583560
O             2.9015320560        0.1000146847        0.0677869317
O             3.0711266320       -0.8206897307        0.3066835991
O             3.0982988290        0.5741035915        0.8880421056
O             3.0205397250        0.9360983448        2.8130916370
O             3.0816945140        1.7475187070        3.3161839430
O             2.2074361160        0.5016511787        3.1025476940
    18
 Energy=    -42.2118258428951
O            -0.3155435408       -2.8092241220        1.0660374110
O             0.5818751337       -3.1459526320        0.9960253311
O            -0.3171482013       -2.0492571390        0.4734841007
O             0.2109988861       -0.0560696522        0.1015346205
O             1.1670115080        0.0856575537       -0.0700375883
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O             0.7069242737       -0.6608337728        2.7920454050
O             0.1384588873       -1.4284870130        2.9104825560
O             0.4117704946       -0.3158029146        1.9326878550
O             2.6404948910       -2.3844254810        1.5182683030
O             2.1064446000       -1.8217183540        2.1015264300
O             3.3437668050       -2.7298543910        2.0695530490
O             2.9015454020        0.1000147383        0.0677861941
O             3.0711347830       -0.8206928361        0.3066761504
O             3.0983028790        0.5740918389        0.8880502191
O             3.0205396430        0.9361094463        2.8130960320
O             3.0816660570        1.7475444480        3.3161664940
O             2.2074361110        0.5016587515        3.1025419210
    18
 Energy=    -42.2118260846157
O            -0.3155581349       -2.8092309360        1.0659978170
O             0.5818639725       -3.1459517640        0.9959895153
O            -0.3171488152       -2.0492481700        0.4734655546
O             0.2110409479       -0.0560651776        0.1015826784
O             1.1670525390        0.0856512921       -0.0700088648
O            -0.2601597170        0.6135567256       -0.3922485051
O             0.7069482083       -0.6608404996        2.7920891590
O             0.1384870483       -1.4284843100        2.9105981120
O             0.4117777015       -0.3158497910        1.9327199460
O             2.6404581670       -2.3844614840        1.5182164500
O             2.1064351210       -1.8217340230        2.1014779770
O             3.3436893220       -2.7299524900        2.0695157650
O             2.9015715270        0.1000198528        0.0678069450
O             3.0711870170       -0.8206947237        0.3066480224
O             3.0983279180        0.5740743294        0.8880854681
O             3.0205297710        0.9361695295        2.8130996290
O             3.0815432240        1.7476751870        3.3160720660
O             2.2074359610        0.5016841184        3.1025246010
    18
 Energy=    -42.2118264098519
O            -0.3155785904       -2.8092372920        1.0659375480
O             0.5818464053       -3.1459487470        0.9959243134
O            -0.3171577167       -2.0492183650        0.4734518315
O             0.2111061439       -0.0560634950        0.1016392972
O             1.1671193410        0.0856545167       -0.0699498970
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O             0.7070384548       -0.6608977844        2.7921204620
O             0.1385087423       -1.4284597660        2.9108020430
O             0.4117997403       -0.3159639739        1.9327506140
O             2.6403997060       -2.3845209970        1.5181425800
O             2.1063812520       -1.8218313900        2.1014501460
O             3.3435752780       -2.7301406540        2.0694277400
O             2.9016415680        0.1000375327        0.0678334622
O             3.0712677660       -0.8206822637        0.3066431005
O             3.0983667950        0.5740668828        0.8881358616
O             3.0204822860        0.9362919318        2.8130668780
O             3.0813343730        1.7479072980        3.3158807380
O             2.2074406460        0.5017368406        3.1025321600
    18
 Energy=    -42.2118265774960
O            -0.3156219650       -2.8092524260        1.0658578490
O             0.5818204465       -3.1459332470        0.9958790018
O            -0.3171811550       -2.0491972890        0.4734239715
O             0.2111740633       -0.0560565660        0.1017066276
O             1.1671887540        0.0856550434       -0.0698914811
O            -0.2600195085        0.6136296267       -0.3920439604
O             0.7071100278       -0.6609524608        2.7921576720
O             0.1385008200       -1.4284310030        2.9109747020
O             0.4118742480       -0.3160953748        1.9327546820
O             2.6403765230       -2.3845786230        1.5180680700
O             2.1063518580       -1.8219515440        2.1014272910
O             3.3434913110       -2.7303308580        2.0693520070
O             2.9016965090        0.1000435920        0.0678568248
O             3.0713033120       -0.8206774338        0.3066759669
O             3.0983876720        0.5740743039        0.8881677289
O             3.0204464340        0.9364220882        2.8130339520
O             3.0811394090        1.7481353760        3.3157117630
O             2.2074430180        0.5018144621        3.1025196690
    18
 Energy=    -42.2118269286279
O            -0.3156848732       -2.8092749500        1.0657373020
O             0.5817686513       -3.1459202570        0.9957703659
O            -0.3172582442       -2.0492024080        0.4733230910
O             0.2111980452       -0.0560506598        0.1017507746
O             1.1672146450        0.0856319295       -0.0698652717
O            -0.2599745198        0.6137798362       -0.3918244157
O             0.7072265337       -0.6610215586        2.7921346130
O             0.1385301254       -1.4284056470        2.9111146740
O             0.4119583611       -0.3162274132        1.9327136350
O             2.6403814690       -2.3846629310        1.5180667580
O             2.1063988880       -1.8220455620        2.1014787090
O             3.3434915950       -2.7305020620        2.0692981320
O             2.9017124110        0.0999543995        0.0678859600
O             3.0712979980       -0.8207525664        0.3067797098
O             3.0984145150        0.5740596627        0.8881504788
O             3.0203825310        0.9366367357        2.8129876300
O             3.0810022740        1.7483661720        3.3156462520
O             2.2074213720        0.5019549461        3.1024839380
    18
 Energy=    -42.2118269319649
O            -0.3156812057       -2.8092753760        1.0657336530
O             0.5817740279       -3.1459163200        0.9957680336
O            -0.3172575433       -2.0492012540        0.4733213970
O             0.2111970130       -0.0560478280        0.1017512184
O             1.1672135090        0.0856340651       -0.0698661473
O            -0.2599755681        0.6137846914       -0.3918211519
O             0.7072274458       -0.6610225577        2.7921348050
O             0.1385302096       -1.4284064030        2.9111148660
O             0.4119582846       -0.3162284985        1.9327144700
O             2.6403828700       -2.3846641060        1.5180710670
O             2.1063949980       -1.8220502210        2.1014817830
O             3.3434930580       -2.7304999510        2.0693042990
O             2.9017126840        0.0999518615        0.0678834811
O             3.0712958370       -0.8207543602        0.3067812949
O             3.0984094500        0.5740584147        0.8881487227
O             3.0203800910        0.9366365881        2.8129825780
O             3.0810060830        1.7483636850        3.3156439940
O             2.2074205340        0.5019552363        3.1024839740
    18
 Energy=    -42.2118269382936
O            -0.3156701343       -2.8092745380        1.0657247080
O             0.5817880200       -3.1459083350        0.9957606869
O            -0.3172519204       -2.0491995800        0.4733136118
O             0.2111952504       -0.0560399767        0.1017567758
O             1.1672114770        0.0856355353       -0.0698682807
O            -0.2599776894        0.6137937442       -0.3918136508
O             0.7072247552       -0.6610260800        2.7921386580
O             0.1385261366       -1.4284083690        2.9111166070
O             0.4119578941       -0.3162288686        1.9327181260
O             2.6403808990       -2.3846673230        1.5180829530
O             2.1063911520       -1.8220512400        2.1014898760
O             3.3434941220       -2.7304950410        2.0693174900
O             2.9017048090        0.0999465559        0.0678815426
O             3.0712923360       -0.8207585881        0.3067812149
O             3.0984040670        0.5740561080        0.8881442056
O             3.0203775660        0.9366324703        2.8129717830
O             3.0810134230        1.7483577350        3.3156351130
O             2.2074196150        0.5019534575        3.1024809160
    18
 Energy=    -42.2118269437841
O            -0.3156654114       -2.8092746050        1.0657172350
O             0.5817937059       -3.1459071820        0.9957575288
O            -0.3172471237       -2.0491985420        0.4733076318
O             0.2111905670       -0.0560396572        0.1017598777
O             1.1672073250        0.0856343837       -0.0698621258
O            -0.2599778467        0.6137976500       -0.3918100376
O             0.7072202881       -0.6610253680        2.7921426010
O             0.1385222685       -1.4284087030        2.9111171130
O             0.4119556765       -0.3162295905        1.9327209190
O             2.6403808680       -2.3846633750        1.5180879750
O             2.1063941700       -1.8220439120        2.1014943570
O             3.3434927610       -2.7304957090        2.0693215190
O             2.9017040080        0.0999436662        0.0678789235
O             3.0712886400       -0.8207619487        0.3067787806
O             3.0984068600        0.5740519452        0.8881414028
O             3.0203822520        0.9366280559        2.8129724840
O             3.0810131520        1.7483568830        3.3156303520
O             2.2074196200        0.5019536750        3.1024757990
    18
 Energy=    -42.2118269469519
O            -0.3156607647       -2.8092762500        1.0657087440
O             0.5818015250       -3.1459018840        0.9957543381
O            -0.3172427944       -2.0491973260        0.4733030776
O             0.2111880391       -0.0560367518        0.1017624915
O             1.1672048670        0.0856362293       -0.0698600103
O            -0.2599798069        0.6138031303       -0.3918045606
O             0.7072177114       -0.6610252717        2.7921430640
O             0.1385226859       -1.4284102300        2.9111192360
O             0.4119507702       -0.3162282167        1.9327223220
O             2.6403828980       -2.3846594980        1.5180937410
O             2.1063919320       -1.8220455240        2.1015008670
O             3.3434928920       -2.7304942590        2.0693289330
O             2.9017032710        0.0999393749        0.0678758718
O             3.0712853770       -0.8207663140        0.3067778748
O             3.0984051190        0.5740481876        0.8881381777
O             3.0203820150        0.9366247151        2.8129685470
O             3.0810163080        1.7483548780        3.3156250350
O             2.2074197340        0.5019526754        3.1024745880
    18
 Energy=    -42.2118269478201
O            -0.3156596392       -2.8092769030        1.0657069330
O             0.5818031851       -3.1459003520        0.9957534734
O            -0.3172416703       -2.0491970490        0.4733020085
O             0.2111876352       -0.0560358212        0.1017630947
O             1.1672045340        0.0856366186       -0.0698597331
O            -0.2599804734        0.6138044207       -0.3918032157
O             0.7072172940       -0.6610251597        2.7921430130
O             0.1385227990       -1.4284105490        2.9111197110
O             0.4119493945       -0.3162280167        1.9327227000
O             2.6403837120       -2.3846589690        1.5180949540
O             2.1063914550       -1.8220460710        2.1015026510
O             3.3434925610       -2.7304935590        2.0693306250
O             2.9017028990        0.0999382624        0.0678752065
O             3.0712846630       -0.8207673291        0.3067776721
O             3.0984047260        0.5740473530        0.8881374376
O             3.0203819390        0.9366242768        2.8129675960
O             3.0810171280        1.7483542370        3.3156236780
O             2.2074196360        0.5019522778        3.1024745330
    18
 Energy=    -42.2118269492665
O            -0.3156581117       -2.8092772890        1.0657047200
O             0.5818055944       -3.1458990710        0.9957518579
O            -0.3172407780       -2.0491969180        0.4733007952
O             0.2111877602       -0.0560337420        0.1017646482
O             1.1672046760        0.0856369608       -0.0698605009
O            -0.2599815378        0.6138058243       -0.3918013182
O             0.7072168447       -0.6610249673        2.7921429750
O             0.1385218036       -1.4284100800        2.9111204400
O             0.4119468893       -0.3162291145        1.9327231290
O             2.6403834950       -2.3846594220        1.5180966430
O             2.1063925690       -1.8220452300        2.1015039680
O             3.3434929260       -2.7304926710        2.0693328000
O             2.9017008550        0.0999365030        0.0678747751
O             3.0712838580       -0.8207686896        0.3067772760
O             3.0984054360        0.5740459832        0.8881362313
O             3.0203819220        0.9366238840        2.8129667160
O             3.0810177700        1.7483537960        3.3156222970
O             2.2074198060        0.5019519102        3.1024748850
    18
 Energy=    -42.2118269503560
O            -0.3156536046       -2.8092784000        1.0656982100
O             0.5818120161       -3.1458957080        0.9957483419
O            -0.3172381840       -2.0491959280        0.4732969220
O             0.2111864278       -0.0560302089        0.1017680477
O             1.1672030660        0.0856385497       -0.0698602629
O            -0.2599831755        0.6138100438       -0.3917966476
O             0.7072140273       -0.6610251851        2.7921435060
O             0.1385201236       -1.4284102890        2.9111232680
O             0.4119426353       -0.3162296404        1.9327236090
O             2.6403841520       -2.3846592060        1.5181021580
O             2.1063930800       -1.8220430000        2.1015076490
O             3.3434940470       -2.7304913610        2.0693382010
O             2.9016983550        0.0999324287        0.0678728824
O             3.0712811260       -0.8207727438        0.3067761560
O             3.0984056980        0.5740425671        0.8881331228
O             3.0203822940        0.9366217855        2.8129643590
O             3.0810196120        1.7483525960        3.3156184570
O             2.2074200820        0.5019513663        3.1024743580
    18
 Energy=    -42.2118269516849
O            -0.3156490623       -2.8092797430        1.0656914770
O             0.5818184668       -3.1458919730        0.9957441716
O            -0.3172350428       -2.0491955070        0.4732922568
O             0.2111836813       -0.0560270780        0.1017705091
O             1.1672004160        0.0856401741       -0.0698578378
O            -0.2599849052        0.6138153472       -0.3917923465
O             0.7072110286       -0.6610248425        2.7921456100
O             0.1385173314       -1.4284099280        2.9111266560
O             0.4119405189       -0.3162315530        1.9327245620
O             2.6403843360       -2.3846594800        1.5181071680
O             2.1063950030       -1.8220402260        2.1015111670
O             3.3434948540       -2.7304891140        2.0693440670
O             2.9016977750        0.0999280338        0.0678701865
O             3.0712777120       -0.8207773581        0.3067746557
O             3.0984056330        0.5740385122        0.8881300887
O             3.0203835070        0.9366192953        2.8129630150
O             3.0810210570        1.7483515090        3.3156147500
O             2.2074194690        0.5019515978        3.1024721800
    18
 Energy=    -42.2118269526399
O            -0.3156489651       -2.8092811130        1.0656881020
O             0.5818198258       -3.1458907440        0.9957428361
O            -0.3172364877       -2.0491983380        0.4732873139
O             0.2111833110       -0.0560262492        0.1017700162
O             1.1672002160        0.0856406086       -0.0698577848
O            -0.2599843773        0.6138194568       -0.3917892332
O             0.7072139107       -0.6610234869        2.7921452170
O             0.1385168733       -1.4284041820        2.9111372460
O             0.4119412490       -0.3162362440        1.9327224830
O             2.6403837240       -2.3846606650        1.5181072250
O             2.1063940420       -1.8220425300        2.1015120260
O             3.3434982550       -2.7304849210        2.0693422350
O             2.9016980080        0.0999260987        0.0678711279
O             3.0712761540       -0.8207800972        0.3067735872
O             3.0984069770        0.5740345889        0.8881319985
O             3.0203825210        0.9366194038        2.8129634490
O             3.0810199300        1.7483523130        3.3156143470
O             2.2074166120        0.5019537677        3.1024701440
    18
 Energy=    -42.2118269534605
O            -0.3156514122       -2.8092849910        1.0656775900
O             0.5818187021       -3.1458920090        0.9957364378
O            -0.3172367655       -2.0491988760        0.4732811973
O             0.2111876907       -0.0560280938        0.1017750847
O             1.1672045150        0.0856394833       -0.0698534783
O            -0.2599803353        0.6138217627       -0.3917781724
O             0.7072188852       -0.6610261139        2.7921465840
O             0.1385155893       -1.4283986820        2.9111574790
O             0.4119419107       -0.3162477358        1.9327214700
O             2.6403806290       -2.3846624750        1.5181033900
O             2.1063897170       -1.8220474550        2.1015102230
O             3.3434910150       -2.7304944490        2.0693387950
O             2.9017011700        0.0999257768        0.0678720903
O             3.0712788220       -0.8207801221        0.3067763383
O             3.0984100000        0.5740360057        0.8881319718
O             3.0203815300        0.9366287936        2.8129608800
O             3.0810134160        1.7483654070        3.3156063770
O             2.2074167000        0.5019614391        3.1024680800
    18
 Energy=    -42.2118269535428
O            -0.3156515797       -2.8092847730        1.0656763430
O             0.5818188704       -3.1458909230        0.9957353193
O            -0.3172371345       -2.0491984210        0.4732802782
O             0.2111882319       -0.0560277175        0.1017759057
O             1.1672050800        0.0856393336       -0.0698530528
O            -0.2599797165        0.6138231062       -0.3917761072
O             0.7072198153       -0.6610265124        2.7921473100
O             0.1385162591       -1.4283988120        2.9111587320
O             0.4119427475       -0.3162484723        1.9327220830
O             2.6403800720       -2.3846639410        1.5181031980
O             2.1063906790       -1.8220486140        2.1015111260
O             3.3434904950       -2.7304978070        2.0693373910
O             2.9017015470        0.0999250593        0.0678727873
O             3.0712792410       -0.8207807865        0.3067771728
O             3.0984096940        0.5740355012        0.8881327537
O             3.0203807960        0.9366305164        2.8129602090
O             3.0810101440        1.7483687520        3.3156034040
O             2.2074165360        0.5019621783        3.1024674840
    18
 Energy=    -42.2118269535844
O            -0.3156515785       -2.8092847280        1.0656762110
O             0.5818188920       -3.1458908150        0.9957351973
O            -0.3172372175       -2.0491983390        0.4732801849
O             0.2111882817       -0.0560276653        0.1017760298
O             1.1672051310        0.0856393375       -0.0698529651
O            -0.2599795943        0.6138232972       -0.3917758583
O             0.7072199138       -0.6610265957        2.7921473620
O             0.1385162513       -1.4283988330        2.9111588600
O             0.4119429282       -0.3162486039        1.9327221060
O             2.6403800260       -2.3846641450        1.5181032280
O             2.1063907850       -1.8220487540        2.1015112240
O             3.3434904930       -2.7304982660        2.0693372290
O             2.9017015580        0.0999249846        0.0678728706
O             3.0712792580       -0.8207808395        0.3067772714
O             3.0984096810        0.5740354621        0.8881328367
O             3.0203807030        0.9366307068        2.8129600970
O             3.0810097140        1.7483691850        3.3156030250
O             2.2074165530        0.5019622783        3.1024674290
    18
 Energy=    -42.2118269535958
O            -0.3156516469       -2.8092847140        1.0656761850
O             0.5818188708       -3.1458906510        0.9957351014
O            -0.3172372421       -2.0491982750        0.4732802354
O             0.2111882565       -0.0560275500        0.1017761341
O             1.1672051560        0.0856393453       -0.0698526986
O            -0.2599794611        0.6138235707       -0.3917756919
O             0.7072200217       -0.6610267769        2.7921472910
O             0.1385160679       -1.4283988210        2.9111588570
O             0.4119432097       -0.3162488756        1.9327219610
O             2.6403801700       -2.3846642570        1.5181032700
O             2.1063908070       -1.8220490550        2.1015113300
O             3.3434905520       -2.7304987100        2.0693372110
O             2.9017015640        0.0999249812        0.0678728825
O             3.0712791460       -0.8207808420        0.3067773096
O             3.0984097610        0.5740354647        0.8881328486
O             3.0203806140        0.9366309279        2.8129600190
O             3.0810093430        1.7483696000        3.3156026310
O             2.2074165890        0.5019623042        3.1024674610
    18
 Energy=    -42.2118269536354
O            -0.3156516999       -2.8092846340        1.0656759770
O             0.5818188865       -3.1458904020        0.9957349148
O            -0.3172374570       -2.0491980500        0.4732802140
O             0.2111883038       -0.0560273322        0.1017763914
O             1.1672052610        0.0856393974       -0.0698522886
O            -0.2599791668        0.6138241482       -0.3917751907
O             0.7072203121       -0.6610272071        2.7921472120
O             0.1385158535       -1.4283988070        2.9111589850
O             0.4119437070       -0.3162493342        1.9327217700
O             2.6403803580       -2.3846645920        1.5181031990
O             2.1063910660       -1.8220497680        2.1015116850
O             3.3434904530       -2.7304996380        2.0693371060
O             2.9017015480        0.0999249070        0.0678729998
O             3.0712790460       -0.8207809404        0.3067774472
O             3.0984098630        0.5740354175        0.8881329125
O             3.0203804010        0.9366314317        2.8129598170
O             3.0810083920        1.7483706130        3.3156017160
O             2.2074166490        0.5019624566        3.1024674700
    18
 Energy=    -42.2118269536123
O            -0.3156521043       -2.8092846380        1.0656756320
O             0.5818185076       -3.1458903100        0.9957344234
O            -0.3172379884       -2.0491979260        0.4732800422
O             0.2111886063       -0.0560267529        0.1017767279
O             1.1672055220        0.0856397235       -0.0698524018
O            -0.2599789184        0.6138254451       -0.3917738304
O             0.7072211441       -0.6610280639        2.7921471640
O             0.1385162925       -1.4283993080        2.9111592740
O             0.4119443867       -0.3162500393        1.9327218220
O             2.6403805580       -2.3846652680        1.5181032290
O             2.1063911340       -1.8220505670        2.1015117450
O             3.3434902080       -2.7305009510        2.0693372910
O             2.9017018320        0.0999244068        0.0678730545
O             3.0712793700       -0.8207813954        0.3067776530
O             3.0984099970        0.5740351015        0.8881328941
O             3.0203799940        0.9366326700        2.8129596440
O             3.0810065160        1.7483726100        3.3156005180
O             2.2074167210        0.5019629293        3.1024674560
    18
 Energy=    -42.2118269536279
O            -0.3156521515       -2.8092846090        1.0656755950
O             0.5818184267       -3.1458903630        0.9957343473
O            -0.3172380600       -2.0491979200        0.4732799719
O             0.2111886033       -0.0560267729        0.1017767521
O             1.1672055290        0.0856397258       -0.0698522960
O            -0.2599788543        0.6138256107       -0.3917736210
O             0.7072212825       -0.6610281557        2.7921471500
O             0.1385164180       -1.4283993790        2.9111592930
O             0.4119444464       -0.3162500808        1.9327218550
O             2.6403805640       -2.3846652910        1.5181031940
O             2.1063911050       -1.8220506360        2.1015117190
O             3.3434901330       -2.7305010440        2.0693373130
O             2.9017019090        0.0999243280        0.0678730631
O             3.0712794490       -0.8207814730        0.3067776705
O             3.0984100740        0.5740350333        0.8881328920
O             3.0203799060        0.9366328544        2.8129595860
O             3.0810062940        1.7483728340        3.3156004120
O             2.2074167040        0.5019630048        3.1024674410
    18
 Energy=    -42.2118269536703
O            -0.3156522384       -2.8092845980        1.0656755410
O             0.5818182982       -3.1458904410        0.9957342139
O            -0.3172381047       -2.0491979090        0.4732799203
O             0.2111886672       -0.0560267767        0.1017769146
O             1.1672056080        0.0856395983       -0.0698521636
O            -0.2599787032        0.6138257704       -0.3917733186
O             0.7072213859       -0.6610282299        2.7921471700
O             0.1385165384       -1.4283994700        2.9111593160
O             0.4119445128       -0.3162501492        1.9327218830
O             2.6403805640       -2.3846653190        1.5181031190
O             2.1063910320       -1.8220506710        2.1015115950
O             3.3434900510       -2.7305011480        2.0693373010
O             2.9017019590        0.0999242393        0.0678730890
O             3.0712795180       -0.8207815605        0.3067776929
O             3.0984101910        0.5740349637        0.8881328952
O             3.0203797940        0.9366331165        2.8129595030
O             3.0810060370        1.7483731170        3.3156003050
O             2.2074166690        0.5019631327        3.1024673610
    18
 Energy=    -42.2118269536411
O            -0.3156522368       -2.8092845990        1.0656755420
O             0.5818183013       -3.1458904390        0.9957342165
O            -0.3172381027       -2.0491979080        0.4732799238
O             0.2111886674       -0.0560267772        0.1017769124
O             1.1672056080        0.0856396009       -0.0698521659
O            -0.2599787045        0.6138257645       -0.3917733254
O             0.7072213816       -0.6610282271        2.7921471700
O             0.1385165324       -1.4283994670        2.9111593160
O             0.4119445106       -0.3162501483        1.9327218830
O             2.6403805640       -2.3846653190        1.5181031210
O             2.1063910320       -1.8220506680        2.1015115950
O             3.3434900550       -2.7305011460        2.0693372990
O             2.9017019580        0.0999242412        0.0678730871
O             3.0712795160       -0.8207815572        0.3067776931
O             3.0984101860        0.5740349664        0.8881328947
O             3.0203797970        0.9366331099        2.8129595050
O             3.0810060430        1.7483731100        3.3156003080
O             2.2074166700        0.5019631309        3.1024673620
    18
 Energy=    -42.2118269536685
O            -0.3156527155       -2.8092847172        1.0656749557
O             0.5818178473       -3.1458905163        0.9957337726
O            -0.3172383194       -2.0491977753        0.4732796666
O             0.2111894052       -0.0560269051        0.1017774866
O             1.1672063615        0.0856394587       -0.0698516482
O            -0.2599779294        0.6138260792       -0.3917721839
O             0.7072218730       -0.6610286057        2.7921474497
O             0.1385164863       -1.4283991943        2.9111609967
O             0.4119447417       -0.3162512012        1.9327219604
O             2.6403802782       -2.3846655970        1.5181025498
O             2.1063908069       -1.8220512998        2.1015114276
O             3.3434896132       -2.7305020973        2.0693365014
O             2.9017025210        0.0999242100        0.0678731107
O             3.0712799246       -0.8207815959        0.3067778113
O             3.0984105131        0.5740350051        0.8881329401
O             3.0203792766        0.9366341478        2.8129591302
O             3.0810046660        1.7483745755        3.3155993490
O             2.2074164287        0.5019636958        3.1024670604
    18
 Energy=    -42.2118269536206
O            -0.3156526930       -2.8092845774        1.0656751341
O             0.5818179556       -3.1458901952        0.9957341366
O            -0.3172383910       -2.0491976512        0.4732798095
O             0.2111893401       -0.0560269776        0.1017773057
O             1.1672062643        0.0856394618       -0.0698519772
O            -0.2599780961        0.6138259317       -0.3917722940
O             0.7072218363       -0.6610285722        2.7921473836
O             0.1385164856       -1.4283991832        2.9111609277
O             0.4119447570       -0.3162512838        1.9327218323
O             2.6403802833       -2.3846655959        1.5181025228
O             2.1063911350       -1.8220511041        2.1015115040
O             3.3434896114       -2.7305023000        2.0693363450
O             2.9017025599        0.0999242529        0.0678730160
O             3.0712801502       -0.8207815652        0.3067775119
O             3.0984105579        0.5740349123        0.8881329162
O             3.0203790782        0.9366340072        2.8129593424
O             3.0810048141        1.7483743662        3.3155996070
O             2.2074161307        0.5019637401        3.1024673136
    18
 Energy=    -42.2118269535964
O            -0.3156526571       -2.8092846374        1.0656752970
O             0.5818181142       -3.1458898884        0.9957344118
O            -0.3172383925       -2.0491977227        0.4732799910
O             0.2111891978       -0.0560270016        0.1017770950
O             1.1672060940        0.0856394466       -0.0698521729
O            -0.2599783292        0.6138258468       -0.3917725842
O             0.7072217681       -0.6610285004        2.7921472856
O             0.1385164823       -1.4283991896        2.9111606747
O             0.4119447877       -0.3162511127        1.9327217397
O             2.6403803592       -2.3846655903        1.5181025351
O             2.1063913248       -1.8220509564        2.1015114928
O             3.3434895828       -2.7305025732        2.0693363203
O             2.9017025462        0.0999243311        0.0678730147
O             3.0712802278       -0.8207814886        0.3067774101
O             3.0984104615        0.5740349470        0.8881329650
O             3.0203791023        0.9366338235        2.8129595290
O             3.0810050925        1.7483741270        3.3155998702
O             2.2074160177        0.5019638050        3.1024674615
    18
 Energy=    -42.2118269536021
O            -0.3156511414       -2.8092849774        1.0656784354
O             0.5818198341       -3.1458896286        0.9957366431
O            -0.3172386803       -2.0491991839        0.4732816555
O             0.2111873516       -0.0560272215        0.1017749130
O             1.1672043197        0.0856395558       -0.0698535149
O            -0.2599801161        0.6138238411       -0.3917772162
O             0.7072204157       -0.6610269226        2.7921461674
O             0.1385169188       -1.4283997999        2.9111547985
O             0.4119442506       -0.3162471976        1.9327213430
O             2.6403804099       -2.3846648081        1.5181031100
O             2.1063917905       -1.8220491522        2.1015114201
O             3.3434893880       -2.7305016381        2.0693373268
O             2.9017008561        0.0999255836        0.0678734687
O             3.0712793612       -0.8207801618        0.3067774906
O             3.0984092417        0.5740360769        0.8881333687
O             3.0203809474        0.9366313198        2.8129607745
O             3.0810094734        1.7483696773        3.3156039863
O             2.2074171617        0.5019623034        3.1024681643
    18
 Energy=    -42.2118269535230
O            -0.3156509803       -2.8092845433        1.0656799539
O             0.5818193054       -3.1458907678        0.9957373941
O            -0.3172379350       -2.0491991397        0.4732826706
O             0.2111868546       -0.0560273790        0.1017742911
O             1.1672036746        0.0856397239       -0.0698543687
O            -0.2599808914        0.6138226114       -0.3917790566
O             0.7072193077       -0.6610264894        2.7921460203
O             0.1385166211       -1.4284004386        2.9111521162
O             0.4119437398       -0.3162455457        1.9327215223
O             2.6403807969       -2.3846637484        1.5181034374
O             2.1063912214       -1.8220480017        2.1015107911
O             3.3434904446       -2.7304980701        2.0693383587
O             2.9017006767        0.0999257759        0.0678730281
O             3.0712787634       -0.8207799525        0.3067774752
O             3.0984093136        0.5740363994        0.8881327644
O             3.0203817072        0.9366294862        2.8129614995
O             3.0810114910        1.7483670535        3.3156058090
O             2.2074176702        0.5019606910        3.1024686291
    18
 Energy=    -42.2118269534720
O            -0.3156510834       -2.8092844358        1.0656801988
O             0.5818193416       -3.1458909877        0.9957374907
O            -0.3172378439       -2.0491991091        0.4732827267
O             0.2111868374       -0.0560273712        0.1017742125
O             1.1672036499        0.0856397279       -0.0698544892
O            -0.2599810387        0.6138224249       -0.3917792641
O             0.7072191534       -0.6610264320        2.7921460010
O             0.1385165656       -1.4284005343        2.9111517729
O             0.4119436898       -0.3162453335        1.9327215706
O             2.6403808483       -2.3846635631        1.5181034739
O             2.1063911305       -1.8220478572        2.1015106622
O             3.3434906061       -2.7304976021        2.0693385222
O             2.9017006166        0.0999258033        0.0678729627
O             3.0712786655       -0.8207799534        0.3067774555
O             3.0984093496        0.5740364246        0.8881326895
O             3.0203818242        0.9366292382        2.8129615483
O             3.0810116914        1.7483666956        3.3156060657
O             2.2074177773        0.5019605312        3.1024687370
    18
 Energy=    -42.2118269531450
O            -0.3156520422       -2.8092823719        1.0656833748
O             0.5818160585       -3.1458940547        0.9957395738
O            -0.3172358626       -2.0491974957        0.4732853152
O             0.2111863999       -0.0560279942        0.1017724068
O             1.1672033634        0.0856396785       -0.0698552572
O            -0.2599815605        0.6138197048       -0.3917838047
O             0.7072152681       -0.6610247439        2.7921460711
O             0.1385154346       -1.4284017445        2.9111470230
O             0.4119410532       -0.3162421288        1.9327218645
O             2.6403828800       -2.3846606347        1.5181053691
O             2.1063917296       -1.8220448790        2.1015111515
O             3.3434970456       -2.7304863286        2.0693400001
O             2.9016998141        0.0999265771        0.0678714569
O             3.0712779367       -0.8207792542        0.3067755685
O             3.0984083219        0.5740364934        0.8881316074
O             3.0203823190        0.9366225955        2.8129619888
O             3.0810171539        1.7483574434        3.3156100471
O             2.2074164677        0.5019568048        3.1024685801
    18
 Energy=    -42.2118269529479
O            -0.3156505370       -2.8092821595        1.0656840364
O             0.5818182306       -3.1458921696        0.9957403420
O            -0.3172362138       -2.0491983702        0.4732846162
O             0.2111857661       -0.0560279573        0.1017718919
O             1.1672025772        0.0856394759       -0.0698567046
O            -0.2599824444        0.6138191015       -0.3917848969
O             0.7072141961       -0.6610237810        2.7921456454
O             0.1385144748       -1.4284008203        2.9111468495
O             0.4119396851       -0.3162414584        1.9327214203
O             2.6403833367       -2.3846596460        1.5181063676
O             2.1063924385       -1.8220434997        2.1015119936
O             3.3434979972       -2.7304846621        2.0693407755
O             2.9016991014        0.0999265937        0.0678709308
O             3.0712761610       -0.8207793483        0.3067753606
O             3.0984082783        0.5740364160        0.8881309736
O             3.0203826573        0.9366205238        2.8129621581
O             3.0810198880        1.7483538975        3.3156123857
O             2.2074161867        0.5019555298        3.1024681894
    18
 Energy=    -42.2118269529538
O            -0.3156501017       -2.8092823587        1.0656840202
O             0.5818190301       -3.1458914363        0.9957406059
O            -0.3172362863       -2.0491986964        0.4732843987
O             0.2111855225       -0.0560280618        0.1017715629
O             1.1672023018        0.0856395698       -0.0698568811
O            -0.2599828149        0.6138189997       -0.3917852009
O             0.7072139451       -0.6610234271        2.7921455555
O             0.1385143568       -1.4284005553        2.9111468177
O             0.4119395692       -0.3162412183        1.9327212355
O             2.6403832895       -2.3846593670        1.5181066751
O             2.1063924853       -1.8220431019        2.1015122676
O             3.3434980602       -2.7304842731        2.0693410175
O             2.9016987848        0.0999264857        0.0678707665
O             3.0712757443       -0.8207794651        0.3067752534
O             3.0984082804        0.5740363830        0.8881306878
O             3.0203828509        0.9366200821        2.8129622356
O             3.0810205565        1.7483529005        3.3156131423
O             2.2074162065        0.5019552044        3.1024681768
    18
 Energy=    -42.2118269527890
O            -0.3156490779       -2.8092830990        1.0656835933
O             0.5818210433       -3.1458898446        0.9957413570
O            -0.3172364528       -2.0491993951        0.4732840682
O             0.2111846833       -0.0560283941        0.1017705680
O             1.1672014888        0.0856400391       -0.0698568972
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O             0.1385142655       -1.4283999345        2.9111465619
O             0.4119395511       -0.3162407937        1.9327207614
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O             3.3434979799       -2.7304833871        2.0693416263
O             2.9016982182        0.0999261414        0.0678702396
O             3.0712750593       -0.8207797527        0.3067750273
O             3.0984080134        0.5740362703        0.8881299330
O             3.0203833788        0.9366189448        2.8129625295
O             3.0810221749        1.7483507593        3.3156149670
O             2.2074163337        0.5019546208        3.1024680968
    18
 Energy=    -42.2118269521008
O            -0.3156442860       -2.8092868188        1.0656821382
O             0.5818277779       -3.1458889437        0.9957422165
O            -0.3172340647       -2.0492035665        0.4732821346
O             0.2111811507       -0.0560273738        0.1017693339
O             1.1671978127        0.0856409335       -0.0698585956
O            -0.2599877592        0.6138200061       -0.3917865084
O             0.7072112989       -0.6610207920        2.7921439641
O             0.1385131222       -1.4283992053        2.9111438873
O             0.4119375567       -0.3162384637        1.9327194661
O             2.6403817622       -2.3846579655        1.5181100120
O             2.1063910468       -1.8220393507        2.1015134410
O             3.3434937627       -2.7304845978        2.0693468230
O             2.9016959044        0.0999268483        0.0678700840
O             3.0712742106       -0.8207789137        0.3067741390
O             3.0984062703        0.5740366725        0.8881298082
O             3.0203866743        0.9366163136        2.8129629647
O             3.0810319384        1.7483463164        3.3156174959
O             2.2074176011        0.5019565676        3.1024695317
    18
 Energy=    -42.2118269518299
O            -0.3156437028       -2.8092864436        1.0656825016
O             0.5818283099       -3.1458890401        0.9957422057
O            -0.3172341458       -2.0492038153        0.4732817567
O             0.2111808429       -0.0560273040        0.1017693675
O             1.1671973442        0.0856408663       -0.0698596809
O            -0.2599878401        0.6138199997       -0.3917863788
O             0.7072110242       -0.6610207961        2.7921440893
O             0.1385126139       -1.4283990186        2.9111438594
O             0.4119369425       -0.3162387180        1.9327196329
O             2.6403821581       -2.3846579329        1.5181099292
O             2.1063913053       -1.8220390465        2.1015130304
O             3.3434934408       -2.7304848927        2.0693473285
O             2.9016963982        0.0999270614        0.0678698782
O             3.0712733400       -0.8207788277        0.3067744237
O             3.0984066244        0.5740366795        0.8881297421
O             3.0203866762        0.9366163326        2.8129633067
O             3.0810327827        1.7483463986        3.3156175034
O             2.2074176667        0.5019561628        3.1024698399
    18
 Energy=    -42.2118269490296
O            -0.3156361370       -2.8092890469        1.0656753595
O             0.5818390767       -3.1458837833        0.9957394050
O            -0.3172290513       -2.0492040872        0.4732775022
O             0.2111767924       -0.0560240335        0.1017714017
O             1.1671937087        0.0856423193       -0.0698568201
O            -0.2599916384        0.6138200247       -0.3917894528
O             0.7072070614       -0.6610173828        2.7921442211
O             0.1385106713       -1.4283962676        2.9111481182
O             0.4119304050       -0.3162378081        1.9327195349
O             2.6403804746       -2.3846577962        1.5181161729
O             2.1063918065       -1.8220369970        2.1015192754
O             3.3434923792       -2.7304856220        2.0693523460
O             2.9016906255        0.0999268401        0.0678707474
O             3.0712727476       -0.8207789381        0.3067712969
O             3.0984034274        0.5740345417        0.8881312679
O             3.0203891396        0.9366097480        2.8129597668
O             3.0810430261        1.7483394081        3.3156135248
O             2.2074172667        0.5019565461        3.1024686677
    18
 Energy=    -42.2118269346255
O            -0.3156258425       -2.8092847353        1.0656531823
O             0.5818587963       -3.1458589901        0.9957331106
O            -0.3172224156       -2.0491928522        0.4732650125
O             0.2111727006       -0.0560210635        0.1017746116
O             1.1671903905        0.0856439731       -0.0698550666
O            -0.2599955239        0.6138177838       -0.3917911439
O             0.7072031850       -0.6610124159        2.7921522656
O             0.1385040985       -1.4283861607        2.9111743349
O             0.4119228301       -0.3162439975        1.9327245663
O             2.6403821951       -2.3846514959        1.5181282858
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O             3.0712605709       -0.8207924688        0.3067663195
O             3.0984021917        0.5740224779        0.8881204791
O             3.0203899862        0.9365939899        2.8129596248
O             3.0810405651        1.7483264777        3.3156102251
O             2.2074140003        0.5019448528        3.1024623795
    18
 Energy=    -42.2118268987700
O            -0.3156284176       -2.8092836492        1.0656169745
O             0.5818486487       -3.1458767000        0.9957010579
O            -0.3172049504       -2.0491873176        0.4732331933
O             0.2111767511       -0.0560157616        0.1017907539
O             1.1671934153        0.0856446548       -0.0698483595
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O             0.7072042726       -0.6610211752        2.7921574330
O             0.1384947968       -1.4283844001        2.9111954334
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O             2.9016830475        0.0998881266        0.0678482699
O             3.0712343445       -0.8208186561        0.3067713877
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O             3.0203874892        0.9365977443        2.8129385442
O             3.0810450887        1.7483194313        3.3156029918
O             2.2074139931        0.5019471337        3.1024485055
    18
 Energy=    -42.2118268857254
O            -0.3156277634       -2.8092820249        1.0656144119
O             0.5818482077       -3.1458791732        0.9956984982
O            -0.3172040170       -2.0491855353        0.4732312963
O             0.2111748998       -0.0560164192        0.1017932098
O             1.1671902856        0.0856442774       -0.0698502393
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O             0.7072040161       -0.6610221070        2.7921581132
O             0.1384931994       -1.4283844367        2.9111962860
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O             3.0712277104       -0.8208207303        0.3067730560
O             3.0984034661        0.5740040038        0.8880988513
O             3.0203868313        0.9365972036        2.8129394452
O             3.0810475047        1.7483209434        3.3156037698
O             2.2074135289        0.5019462218        3.1024456032
    18
 Energy=    -42.2118268305633
O            -0.3156284197       -2.8092867746        1.0655976273
O             0.5818317114       -3.1459148679        0.9956671758
O            -0.3171896395       -2.0491849859        0.4732209295
O             0.2111778029       -0.0560014796        0.1018075775
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O             0.7071972774       -0.6610355806        2.7921550175
O             0.1384819723       -1.4283906195        2.9112089784
O             0.4119125338       -0.3162792303        1.9327220492
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O             2.1063588565       -1.8220437536        2.1015484170
O             3.3435555408       -2.7303609184        2.0694217708
O             2.9016851875        0.0998702010        0.0678417115
O             3.0712264840       -0.8208315614        0.3067883588
O             3.0984165246        0.5740051501        0.8880822939
O             3.0203865402        0.9366008759        2.8129241425
O             3.0810634978        1.7483250870        3.3155824399
O             2.2074107883        0.5019598942        3.1024416962
    18
 Energy=    -42.2118267920110
O            -0.3156286674       -2.8092878793        1.0655942732
O             0.5818295436       -3.1459257153        0.9956573786
O            -0.3171828772       -2.0491764977        0.4732296148
O             0.2111687875       -0.0560041122        0.1017961367
O             1.1671835242        0.0856551315       -0.0698487881
O            -0.2599995246        0.6138981009       -0.3916864170
O             0.7071902584       -0.6610353633        2.7921550568
O             0.1384801533       -1.4283952759        2.9112097210
O             0.4119130812       -0.3162908436        1.9327160807
O             2.6404005761       -2.3846430881        1.5181758874
O             2.1063512662       -1.8220480305        2.1015486715
O             3.3435611025       -2.7303443985        2.0694296660
O             2.9016938854        0.0998599618        0.0678345866
O             3.0712343491       -0.8208386511        0.3067999274
O             3.0984185346        0.5740077626        0.8880673459
O             3.0203883304        0.9365956301        2.8129284368
O             3.0810716667        1.7483258038        3.3155785709
O             2.2074077908        0.5019651311        3.1024461867
    18
 Energy=    -42.2118265901972
O            -0.3156483440       -2.8093174567        1.0655401836
O             0.5817967425       -3.1459851304        0.9956163463
O            -0.3171693093       -2.0492129392        0.4731706311
O             0.2111890357       -0.0559743077        0.1018449890
O             1.1672124728        0.0856501848       -0.0697963915
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O             0.7071873510       -0.6610535231        2.7921648302
O             0.1384643027       -1.4283988763        2.9112450556
O             0.4118920377       -0.3163011013        1.9327327451
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O             2.9016802964        0.0998522436        0.0678402303
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O             3.0203839434        0.9366253250        2.8128644657
O             3.0810776751        1.7483468425        3.3155237441
O             2.2074140785        0.5019904744        3.1024061264
    18
 Energy=    -42.2118265629826
O            -0.3156500018       -2.8093198091        1.0655352198
O             0.5817949753       -3.1459900657        0.9956140254
O            -0.3171688652       -2.0492152046        0.4731652841
O             0.2111886082       -0.0559731435        0.1018503733
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O             3.0810784682        1.7483497978        3.3155199549
O             2.2074145831        0.5019914315        3.1024011399
    18
 Energy=    -42.2118264923755
O            -0.3156484441       -2.8093224703        1.0655205030
O             0.5817960717       -3.1459969228        0.9956087431
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O             2.2074125108        0.5019913757        3.1023919970
    18
 Energy=    -42.2118258707166
O            -0.3156364015       -2.8093796581        1.0653008318
O             0.5818728939       -3.1459129156        0.9955190644
O            -0.3171574485       -2.0492033946        0.4730240010
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O             3.0808304104        1.7485927567        3.3152243789
O             2.2073686458        0.5020464935        3.1023588386
    18
 Energy=    -42.2118242326566
O            -0.3155887365       -2.8094085474        1.0650863378
O             0.5819988745       -3.1457408493        0.9953889505
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O             1.1674021362        0.0856972551       -0.0696476143
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O             2.9018920565        0.0997151001        0.0677885938
O             3.0713075368       -0.8210127027        0.3067451616
O             3.0985762211        0.5738182056        0.8880626775
O             3.0202743601        0.9368459999        2.8127576945
O             3.0804741397        1.7489341192        3.3148963534
O             2.2073470729        0.5021336819        3.1022854728
    18
 Energy=    -42.2118216094418
O            -0.3157072270       -2.8095449296        1.0646368725
O             0.5820176236       -3.1455638849        0.9950660237
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O             0.2114421187       -0.0558747747        0.1023024362
O             1.1674878049        0.0856360756       -0.0694055381
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O             0.7078076920       -0.6613296400        2.7922943317
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O             0.4121721372       -0.3171901247        1.9327127834
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O             3.3429451318       -2.7318838851        2.0690942281
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O             3.0714513585       -0.8210259550        0.3069829751
O             3.0985353976        0.5738710521        0.8882490298
O             3.0201026933        0.9376127403        2.8125877214
O             3.0799828851        1.7498427800        3.3145132415
O             2.2073194830        0.5026557132        3.1021810658
    18
 Energy=    -42.2118111022205
O            -0.3162244329       -2.8093832975        1.0648673556
O             0.5813287609       -3.1457849567        0.9949322421
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O             0.2118170771       -0.0559529689        0.1025269613
O             1.1678744481        0.0854193849       -0.0692347340
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O             0.7084593551       -0.6618611504        2.7923170425
O             0.1388897273       -1.4283481511        2.9126737957
O             0.4128162995       -0.3173574531        1.9328848129
O             2.6400197881       -2.3854930530        1.5173597675
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O             3.3425769630       -2.7327718179        2.0683923827
O             2.9022332534        0.0996368956        0.0682563131
O             3.0716833547       -0.8210435692        0.3073666540
O             3.0987152339        0.5739942950        0.8884351038
O             3.0198419340        0.9386615152        2.8126658489
O             3.0786534728        1.7513013549        3.3140812194
O             2.2075088608        0.5029682550        3.1023718011
    18
 Energy=    -42.2117994153455
O            -0.3166728187       -2.8091114680        1.0653933000
O             0.5805934301       -3.1461445242        0.9949401040
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O             0.2121993828       -0.0559789161        0.1025864939
O             1.1682410924        0.0854881534       -0.0691524334
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O             0.1390476706       -1.4286541984        2.9126255249
O             0.4129148754       -0.3174908662        1.9330818196
O             2.6401277087       -2.3856512700        1.5168880882
O             2.1063569245       -1.8235369123        2.1009931431
O             3.3426092168       -2.7331709527        2.0678626784
O             2.9026748665        0.0998176079        0.0683555572
O             3.0721710985       -0.8208809531        0.3073586349
O             3.0990323018        0.5740817285        0.8886223190
O             3.0195976861        0.9389389375        2.8126824694
O             3.0774852867        1.7520038546        3.3134872114
O             2.2074261010        0.5028617390        3.1023107882
    18
 Energy=    -42.2117923732626
O            -0.3168620931       -2.8089126659        1.0654867152
O             0.5802736097       -3.1463064714        0.9951290664
O            -0.3178283796       -2.0484906492        0.4735187069
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O             1.1683108043        0.0855439495       -0.0691324585
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O             0.7084739704       -0.6619870091        2.7925462257
O             0.1391568523       -1.4286980408        2.9126599020
O             0.4129850518       -0.3176252899        1.9330089393
O             2.6401792324       -2.3857737839        1.5168231883
O             2.1064953945       -1.8235593710        2.1009129908
O             3.3426421943       -2.7332998182        2.0678028275
O             2.9027553572        0.0999391039        0.0683379125
O             3.0725234079       -0.8207912063        0.3069909784
O             3.0990251864        0.5739758591        0.8887605336
O             3.0194030762        0.9388725340        2.8127365646
O             3.0771763048        1.7521440160        3.3132478565
O             2.2072400046        0.5028397421        3.1024259495
    18
 Energy=    -42.2115589394389
O            -0.3197399386       -2.8076709770        1.0669917094
O             0.5759499156       -3.1483881390        0.9944089620
O            -0.3192347138       -2.0469976598        0.4752919995
O             0.2140069548       -0.0569525189        0.1031779720
O             1.1701472600        0.0847636923       -0.0679854882
O            -0.2567519899        0.6131303734       -0.3904433599
O             0.7100568753       -0.6635710311        2.7930701552
O             0.1402099520       -1.4301376054        2.9119209962
O             0.4150365837       -0.3180852720        1.9338391577
O             2.6400472251       -2.3866503615        1.5145768674
O             2.1065736361       -1.8251594760        2.0995642431
O             3.3425903054       -2.7350443701        2.0649359307
O             2.9043290250        0.1003694906        0.0688652607
O             3.0737628184       -0.8202679964        0.3081948514
O             3.0998436368        0.5750519825        0.8890897524
O             3.0179817344        0.9423115380        2.8125585043
O             3.0731515203        1.7560283572        3.3126176692
O             2.2075209803        0.5035876390        3.1029571512
    18
 Energy=    -42.2092724846248
O            -0.3249681459       -2.8085398941        1.0651022268
O             0.5711562632       -3.1481372589        0.9932343448
O            -0.3230789951       -2.0469807475        0.4747212560
O             0.2168902744       -0.0574502467        0.1048949353
O             1.1731608141        0.0837781893       -0.0665737810
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O             0.7215628742       -0.6663037918        2.7906540176
O             0.1465290290       -1.4273348372        2.9182764561
O             0.4232055007       -0.3228764345        1.9316517151
O             2.6377743713       -2.3944195518        1.5079220981
O             2.1072979417       -1.8334192009        2.0962905157
O             3.3348719214       -2.7554612458        2.0569931415
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O             3.0782390563       -0.8192063088        0.3097780931
O             3.0992001368        0.5745111479        0.8967552907
O             3.0168485153        0.9552101481        2.8155500282
O             3.0565811814        1.7762902928        3.3051508266
O             2.2091861433        0.5105366569        3.1043909302
    18
 Energy=    -42.2078575168459
O            -0.3247361118       -2.8078944462        1.0636033342
O             0.5715901780       -3.1471517397        0.9914824262
O            -0.3240705854       -2.0467781189        0.4729962413
O             0.2170997396       -0.0584037428        0.1048860343
O             1.1725980438        0.0856880242       -0.0671811930
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O             0.1461325043       -1.4254395007        2.9245219894
O             0.4248114441       -0.3277839664        1.9304897312
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O             2.1101414040       -1.8366635589        2.0967701909
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O             2.9084505302        0.1025613740        0.0764368712
O             3.0827774975       -0.8187437234        0.3088875869
O             3.1000865657        0.5734862059        0.8998118602
O             3.0150690311        0.9595317988        2.8150619978
O             3.0514781484        1.7844398225        3.2987536319
O             2.2084768448        0.5142123837        3.1061341574
    18
 Energy=    -42.2052251986236
O            -0.3242351875       -2.8097190748        1.0575490391
O             0.5749746356       -3.1421585331        0.9894671990
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O             1.1751472330        0.0854334374       -0.0655437803
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O             3.3247656093       -2.7827379633        2.0504940032
O             2.9111600274        0.1023866536        0.0781954988
O             3.0843612963       -0.8189913057        0.3105857536
O             3.1038872613        0.5734808258        0.9012134015
O             3.0115907589        0.9659703006        2.8120915798
O             3.0433220537        1.7960109291        3.2880384894
O             2.2058998495        0.5197535181        3.1046214558
    18
 Energy=    -42.2048266574059
O            -0.3241841743       -2.8116968512        1.0534577028
O             0.5773288406       -3.1385908832        0.9875421862
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O             1.1771128085        0.0849661258       -0.0630658645
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O             0.4250529624       -0.3384478423        1.9336025393
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O             3.0850486791       -0.8200427961        0.3120205613
O             3.1049331380        0.5735139319        0.9006913239
O             3.0098110334        0.9699854499        2.8101187791
O             3.0381061234        1.8014525978        3.2826877577
O             2.2048663114        0.5228904052        3.1025302732
    18
 Energy=    -42.2028316700466
O            -0.3229639727       -2.8150811781        1.0436404721
O             0.5822685608       -3.1323205579        0.9822008225
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O             1.1814170300        0.0837777950       -0.0545383121
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O             0.7318662419       -0.6753937926        2.7976088677
O             0.1457134382       -1.4204813178        2.9583673111
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O             2.6321108578       -2.4050032305        1.5001357242
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O             3.3141503861       -2.8002754206        2.0442165245
O             2.9146944383        0.0971698079        0.0771239139
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O             3.1045976583        0.5728876272        0.8982841561
O             3.0064340239        0.9788178288        2.8051991533
O             3.0271031008        1.8133129239        3.2732924483
O             2.2033963590        0.5280079758        3.0973736177
    18
 Energy=    -42.1983749068444
O            -0.3219464703       -2.8188150394        1.0225301981
O             0.5857296664       -3.1302375684        0.9637132243
O            -0.3305509661       -2.0471204138        0.4461111375
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O             3.1123127365        0.5659207227        0.8921607298
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O             3.0115804774        1.8296651402        3.2608181244
O             2.2043534168        0.5339256835        3.0912383147
    18
 Energy=    -42.1951335314965
O            -0.3224089718       -2.8206655624        1.0104391235
O             0.5849719484       -3.1322884295        0.9536761615
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O             0.2309173209       -0.0503850014        0.1346372990
O             1.1868750750        0.0830892334       -0.0466608273
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O             0.4286171237       -0.3695416926        1.9410880955
O             2.6279115319       -2.4085235864        1.5051327410
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O             3.1150668246        0.5627152079        0.8871385112
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O             3.0066300654        1.8373827829        3.2523782134
O             2.2035717174        0.5392210380        3.0887364152
    18
 Energy=    -42.1926910657164
O            -0.3219471635       -2.8208904610        1.0049872931
O             0.5846454172       -3.1347011953        0.9502229885
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O             1.1872825556        0.0830543254       -0.0444356307
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O             0.1401572395       -1.4094300809        3.0047283184
O             0.4285240812       -0.3732136497        1.9403537620
O             2.6291271462       -2.4093420822        1.5063358357
O             2.0954693023       -1.8592332783        2.1025434157
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O             3.0011501256        0.9990529032        2.7932032347
O             3.0057227544        1.8406625621        3.2482283792
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    18
 Energy=    -42.1228300864656
O            -0.3020343388       -2.8247895628        0.8952992110
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O             1.1801823594        0.0865074491       -0.0173432446
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O             3.0044894679        0.9986975322        2.7636645834
O             2.9965757380        1.8630686460        3.1731484222
O             2.2006244516        0.5535444929        3.0632647414
    18
 Energy=    -42.0671020076570
O            -0.2790924736       -2.8276194250        0.8474624533
O             0.6409735097       -3.1014574098        0.8575124119
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O             0.3839165073       -0.4431495299        1.9719928792
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O             3.0179821482        0.9971737749        2.7713730336
O             2.9895369102        1.8761832103        3.1503898139
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    18
 Energy=    -41.8182135154326
O            -0.1477744570       -2.9692429409        0.4652844090
O             0.7822543313       -3.0998881064        0.6722638810
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O             2.8416364113        0.0081141874        0.0811525151
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O             3.0524008585        1.0656653333        2.7128239524
O             3.0347971663        1.9474087032        3.0836219671
O             2.2467719978        0.6307029546        3.0228519190
    18
 Energy=    -41.7762047646180
O            -0.1316874916       -3.0073161779        0.4071165208
O             0.7902173873       -3.1193235277        0.6562758327
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O             0.1596615761       -0.0497256334        0.3085264328
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O             0.8140919491       -0.6384202071        2.9138064881
O             0.1149058907       -0.9784412470        3.4724935923
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O             2.5576228951       -2.4692391409        1.5895757998
O             2.0283939721       -1.9719452754        2.2317064214
O             3.1651343006       -3.0008950170        2.1044434329
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O             3.0027175870       -0.9039579758        0.3612712337
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O             3.0454857845        1.9709059130        3.0785275195
O             2.2618382225        0.6498236228        3.0356121404
    18
 Energy=    -41.7195349410758
O            -0.1235899328       -3.0358881156        0.3810180760
O             0.7977195614       -3.1379724488        0.6374489952
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O             3.1538761426       -3.0049588523        2.0829654177
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    18
 Energy=    -41.6552103884206
O            -0.1242521437       -3.0822477151        0.3215159442
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O             2.0037040316       -1.9767802402        2.2406504175
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O             3.0470915591        2.0130411956        3.0848642027
O             2.2717648755        0.6868793785        3.0264160268
    18
 Energy=    -41.5515052454150
O            -0.1589262582       -3.1020805711        0.2540077465
O             0.7507543967       -3.1783616956        0.5560068462
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O             3.0478004183        2.0261005434        3.0779009011
O             2.2804675266        0.6936829225        3.0310613367
    18
 Energy=    -41.2749177317683
O            -0.2129310678       -3.0954605666        0.1926933548
O             0.6974631630       -3.2234139581        0.4824281751
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O             3.2148031592       -2.8969209152        2.0727474806
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O             3.0242879026       -0.9092661626        0.4508454336
O             3.0961416746        0.5371851561        0.9096530620
O             3.1031009025        1.1461175993        2.7380465778
O             3.0476407052        2.0432493635        3.0679978179
O             2.3040794887        0.6984140248        3.0466765850
    18
 Energy=    -41.1405014761329
O            -0.2402691734       -3.0940032704        0.1759596375
O             0.6714007120       -3.2339761361        0.4463177277
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O             3.2257792909       -2.8809463548        2.0771999184
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O             3.0384982042       -0.9053283419        0.4556594353
O             3.0727003914        0.5430140290        0.9118980765
O             3.1178356457        1.1514107704        2.7493752351
O             3.0462144958        2.0519019067        3.0662706392
O             2.3147490760        0.7015720495        3.0444721661
    18
 Energy=    -39.3417587161039
O            -0.3286080386       -2.9211709817        0.0039005975
O             0.4067501325       -3.5257103631        0.0937637410
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O             1.1409327073        0.0935433545        0.1735980576
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O             3.1424271301        0.5701394733        0.8938423471
O             3.1269505726        1.1552399820        2.7478023643
O             3.0372355470        2.0652670870        3.0311555740
O             2.3351166624        0.7023586257        3.0674293388
    18
 Energy=    -39.0868063731053
O            -0.3124906753       -2.8676068183       -0.0179904370
O             0.3263021362       -3.5782078319        0.0124429054
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O             1.1356070716        0.1278429595        0.1736077082
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O             3.0368124856        2.0658986989        3.0259353165
O             2.3330054684        0.7047146757        3.0652029768
    18
 Energy=    -39.0355145086547
O            -0.3061214983       -2.8405633230       -0.0249553953
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O             2.9923610403       -0.8649497774        0.4416919681
O             3.1482815195        0.5735311369        0.8891164053
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O             3.0368354694        2.0662803306        3.0236802969
O             2.3315918341        0.7060541567        3.0636725101
    18
 Energy=    -39.1782621114275
O            -0.2933045044       -2.7962296381       -0.0296925651
O             0.2112760534       -3.6111743865       -0.0975225758
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O             2.9910338910       -0.8622105692        0.4401857278
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O             3.1318235220        1.1519480882        2.7550454950
O             3.0369963734        2.0668508497        3.0205290820
O             2.3294069848        0.7080804722        3.0613156965
    18
 Energy=    -42.2080803714843
O            -0.1105766887       -2.6642515415        0.0296942432
O            -0.1216279009       -3.5534013588       -0.3561135621
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O             3.0385172393        2.0690066227        3.0104786707
O             2.3183994777        0.7171517914        3.0488709618
    18
 Energy=    -44.1122227806920
O            -0.0506819515       -2.6367854818        0.1476120415
O            -0.2324744210       -3.3663917847       -0.4435801772
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O             3.0548593727        2.0795598176        3.0109068360
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    18
 Energy=    -44.2839050845263
O            -0.0753968597       -2.6650864958        0.1649641928
O            -0.2080586454       -3.3249689874       -0.5141539846
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    18
 Energy=    -44.3513278557497
O            -0.1124368398       -2.7092442696        0.1784424222
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    18
 Energy=    -44.3667425468904
O            -0.1143691754       -2.7116777047        0.1793919184
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    18
 Energy=    -44.4095199347421
O            -0.1008644532       -2.7213728389        0.1535629971
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    18
 Energy=    -44.4445051731733
O            -0.0839331156       -2.7385946128        0.0961411202
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    18
 Energy=    -44.4490241513609
O            -0.0815287136       -2.7400032386        0.0937591928
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    18
 Energy=    -44.4540680252025
O            -0.0758335764       -2.7384293073        0.0864978724
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    18
 Energy=    -44.4553608885811
O            -0.0742249737       -2.7392634451        0.0853355279
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    18
 Energy=    -44.4561120250198
O            -0.0743223399       -2.7393527613        0.0851103716
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    18
 Energy=    -44.4606331683544
O            -0.0656011649       -2.7348644947        0.0781936698
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    18
 Energy=    -44.4620403523790
O            -0.0630887041       -2.7330937792        0.0754828714
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    18
 Energy=    -44.4625206646511
O            -0.0620835277       -2.7329813798        0.0736274533
O             0.0291491265       -3.1806991534       -0.7674964867
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    18
 Energy=    -44.4626473013121
O            -0.0614264194       -2.7328956160        0.0726905374
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    18
 Energy=    -44.4630755157728
O            -0.0598500530       -2.7330878700        0.0696230662
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    18
 Energy=    -44.4631618207027
O            -0.0598880117       -2.7335516607        0.0689720246
O             0.0376207684       -3.1723040516       -0.7761518604
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    18
 Energy=    -44.4632921879272
O            -0.0594396463       -2.7348136806        0.0652852312
O             0.0405438717       -3.1716475759       -0.7805482242
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    18
 Energy=    -44.4632981580893
O            -0.0593972799       -2.7348576194        0.0649709882
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    18
 Energy=    -44.4633099781402
O            -0.0593241707       -2.7347136208        0.0648185570
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    18
 Energy=    -44.4633179036099
O            -0.0592346937       -2.7345989536        0.0644988067
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    18
 Energy=    -44.4633374313613
O            -0.0591669842       -2.7344007519        0.0642481505
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    18
 Energy=    -44.4633443525033
O            -0.0591389542       -2.7343105516        0.0641807361
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    18
 Energy=    -44.4633580535795
O            -0.0589346735       -2.7339708444        0.0639588072
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    18
 Energy=    -44.4633626933697
O            -0.0587832999       -2.7338051550        0.0637864798
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O             2.8498900672       -2.9990367583        2.1427534571
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O             2.9405019848       -0.8182735464        0.4085492324
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O             2.3886349320        0.7827399153        3.0344479115
    18
 Energy=    -44.4633628611663
O            -0.0587783044       -2.7337835310        0.0637664903
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O             0.9085891897       -0.4083344952        3.0216381439
O             0.2195847687       -0.4998059979        3.6793959011
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O             3.1424256766        2.1183480535        2.9844411228
O             2.3886178852        0.7827513564        3.0344316411
    18
 Energy=    -44.4633629278436
O            -0.0587737784       -2.7337709862        0.0637531501
O             0.0436492200       -3.1669074336       -0.7837037407
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O             0.2195887740       -0.4997916477        3.6794139383
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O             3.1423938476        2.1183720082        2.9844035936
O             2.3886071632        0.7827590081        3.0344229267
    18
 Energy=    -44.4633637050738
O            -0.0588101063       -2.7336838687        0.0636627779
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O             3.1418765389        2.1186887930        2.9840612108
O             2.3886015917        0.7828324629        3.0344084886
    18
 Energy=    -44.4633638005509
O            -0.0588365070       -2.7336822038        0.0636603208
O             0.0436458368       -3.1667021814       -0.7838493450
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O             2.2726632617       -2.4168368943        1.6491418845
O             1.8594924380       -1.8281173192        2.3051112663
O             2.8497022651       -2.9993768768        2.1426823951
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O             2.9406106122       -0.8184475065        0.4086690753
O             3.1291147287        0.6040688952        0.8892403319
O             3.2096243306        1.1977150595        2.7325505584
O             3.1418171691        2.1187442211        2.9839863542
O             2.3886068007        0.7828405318        3.0344041709
    18
 Energy=    -44.4633638605957
O            -0.0588462835       -2.7336690874        0.0636504450
O             0.0436487897       -3.1666686861       -0.7838681750
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O            -0.1853442759       -0.8123903787        0.2399078888
O             0.9087584231       -0.4084756504        3.0217618500
O             0.2197823261       -0.4999098950        3.6795544515
O             0.4578530847       -0.1908999426        2.1638458696
O             2.2726536959       -2.4168527852        1.6491374557
O             1.8594905152       -1.8281300186        2.3051100726
O             2.8496795900       -2.9994073342        2.1426749757
O             2.8303295930        0.0942105374        0.1223307184
O             2.9406230443       -0.8184595927        0.4086806744
O             3.1291362556        0.6040569494        0.8892488227
O             3.2096089189        1.1977498932        2.7325412399
O             3.1417568759        2.1187872998        2.9839336265
O             2.3886076666        0.7828555664        3.0344107399
    18
 Energy=    -44.4633639325144
O            -0.0588572138       -2.7336460454        0.0636459610
O             0.0436441222       -3.1666019893       -0.7838940345
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O             0.0531606672        0.0609824611        0.5825170506
O             0.9505565154        0.2084813484        0.2346504983
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O             0.9087849657       -0.4084889337        3.0217716712
O             0.2198015270       -0.4999398613        3.6795544722
O             0.4578825978       -0.1909121950        2.1638535253
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O             1.8594773029       -1.8281765885        2.3051130662
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O             2.9406543101       -0.8184692038        0.4086997930
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O             3.1416981541        2.1188542059        2.9838506293
O             2.3885966266        0.7828980428        3.0344086196
    18
 Energy=    -44.4633639378121
O            -0.0588601112       -2.7336443380        0.0636449713
O             0.0436406231       -3.1665865729       -0.7839020892
O             0.7840474005       -2.8559616292        0.5235620015
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O             0.9087906939       -0.4084910698        3.0217763522
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O             2.2726358603       -2.4169034419        1.6491354544
O             1.8594789931       -1.8281851002        2.3051148218
O             2.8496461523       -2.9994791300        2.1426685782
O             2.8303632468        0.0941963550        0.1223521188
O             2.9406623672       -0.8184713870        0.4087044918
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O             3.1416855232        2.1188687542        2.9838338530
O             2.3885953290        0.7829087378        3.0344088969
    18
 Energy=    -44.4633639506603
O            -0.0588643035       -2.7336450256        0.0636433925
O             0.0436361745       -3.1665740413       -0.7839108391
O             0.7840447711       -2.8559662020        0.5235557159
O             0.0531657525        0.0609846944        0.5825215723
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O             0.9087943887       -0.4084969373        3.0217760092
O             0.2198084665       -0.4999440331        3.6795578470
O             0.4578920102       -0.1909251030        2.1638571483
O             2.2726416140       -2.4169078437        1.6491377224
O             1.8594876490       -1.8281891083        2.3051194777
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O             2.8303597661        0.0941919405        0.1223569871
O             2.9406672364       -0.8184756163        0.4087089210
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O             3.2095812994        1.1978254610        2.7325177539
O             3.1416765382        2.1188828857        2.9838238729
O             2.3885958280        0.7829168195        3.0344091514
    18
 Energy=    -44.4633639567786
O            -0.0588640671       -2.7336410867        0.0636335839
O             0.0436391580       -3.1665708195       -0.7839194602
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O             0.0531678859        0.0609867925        0.5825261490
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O            -0.1853394023       -0.8123869875        0.2399431428
O             0.9088034899       -0.4084982696        3.0217790943
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O             1.8594923880       -1.8281961238        2.3051203390
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O             2.8303604396        0.0941839160        0.1223585532
O             2.9406666606       -0.8184817949        0.4087167784
O             3.1291355236        0.6040454968        0.8892796217
O             3.2095748856        1.1978431969        2.7325135789
O             3.1416578186        2.1188990304        2.9838203666
O             2.3885942303        0.7829231921        3.0344040722
    18
 Energy=    -44.4633639574679
O            -0.0588638158       -2.7336410776        0.0636322747
O             0.0436403133       -3.1665709745       -0.7839208228
O             0.7840431357       -2.8559633270        0.5235484961
O             0.0531673912        0.0609872907        0.5825266746
O             0.9505680793        0.2084812157        0.2346698596
O            -0.1853399055       -0.8123860680        0.2399437867
O             0.9088049607       -0.4084979225        3.0217798971
O             0.2198250418       -0.4999397659        3.6795682391
O             0.4578970138       -0.1909279805        2.1638635127
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O             1.8594916922       -1.8281972429        2.3051208276
O             2.8496185539       -2.9995247343        2.1426701915
O             2.8303611376        0.0941826357        0.1223585740
O             2.9406673066       -0.8184828541        0.4087179082
O             3.1291355768        0.6040453493        0.8892792777
O             3.2095742626        1.1978455333        2.7325128074
O             3.1416552569        2.1189013636        2.9838198497
O             2.3885948245        0.7829235132        3.0344033576
    18
 Energy=    -44.4633639579508
O            -0.0588630801       -2.7336404689        0.0636293756
O             0.0436421359       -3.1665707290       -0.7839234749
O             0.7840432638       -2.8559619344        0.5235469243
O             0.0531681253        0.0609870490        0.5825293724
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O            -0.1853411825       -0.8123850249        0.2399445961
O             0.9088072670       -0.4084990654        3.0217808199
O             0.2198284621       -0.4999380666        3.6795706693
O             0.4578983783       -0.1909284234        2.1638650254
O             2.2726394247       -2.4169192036        1.6491375839
O             1.8594908192       -1.8281994289        2.3051214603
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O             2.8303618383        0.0941807579        0.1223591026
O             2.9406679973       -0.8184841257        0.4087201607
O             3.1291362723        0.6040448992        0.8892787196
O             3.2095734968        1.1978497980        2.7325114148
O             3.1416503140        2.1189054911        2.9838181504
O             2.3885956376        0.7829248819        3.0344020048
    18
 Energy=    -44.4633639583413
O            -0.0588626703       -2.7336393189        0.0636273947
O             0.0436442420       -3.1665697262       -0.7839251196
O             0.7840431650       -2.8559611765        0.5235457374
O             0.0531684153        0.0609864127        0.5825302285
O             0.9505684595        0.2084787188        0.2346710214
O            -0.1853417968       -0.8123857387        0.2399464862
O             0.9088080988       -0.4084989831        3.0217822454
O             0.2198291413       -0.4999376127        3.6795719852
O             0.4578992700       -0.1909281398        2.1638665635
O             2.2726376411       -2.4169207267        1.6491374426
O             1.8594890609       -1.8282012933        2.3051215423
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O             2.8303622391        0.0941809933        0.1223598944
O             2.9406677429       -0.8184840391        0.4087211400
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O             3.2095738105        1.1978510903        2.7325111406
O             3.1416484676        2.1189076381        2.9838141691
O             2.3885963540        0.7829252521        3.0344017876
    18
 Energy=    -44.4633639585765
O            -0.0588622725       -2.7336392677        0.0636261487
O             0.0436451782       -3.1665686354       -0.7839268252
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O             0.0531686650        0.0609857785        0.5825309571
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O            -0.1853421132       -0.8123862831        0.2399471266
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O             0.4578998357       -0.1909281065        2.1638674112
O             2.2726364852       -2.4169214698        1.6491375178
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O             3.1416471068        2.1189087699        2.9838112548
O             2.3885970183        0.7829258442        3.0344020458
    18
 Energy=    -44.4633639590251
O            -0.0588627530       -2.7336408763        0.0636231520
O             0.0436483915       -3.1665638206       -0.7839326993
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O             2.2726345176       -2.4169215364        1.6491382902
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O             2.8303625990        0.0941803686        0.1223615041
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O             2.3885990916        0.7829268691        3.0344031088
    18
 Energy=    -44.4633639590766
O            -0.0588627301       -2.7336408438        0.0636221307
O             0.0436493647       -3.1665623876       -0.7839343235
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O             3.1416437192        2.1189128025        2.9838011085
O             2.3885990405        0.7829271330        3.0344030382
    18
 Energy=    -44.4633639592523
O            -0.0588621622       -2.7336405709        0.0636198271
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O             0.2198327065       -0.4999351690        3.6795790125
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O             2.8303624780        0.0941779529        0.1223614209
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O             3.1416417160        2.1189145761        2.9837985179
O             2.3885984072        0.7829283412        3.0344023112
    18
 Energy=    -44.4633639592661
O            -0.0588621087       -2.7336405524        0.0636198110
O             0.0436527109       -3.1665584051       -0.7839382086
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O             0.9088103714       -0.4084978453        3.0217875062
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O             0.4578999501       -0.1909287011        2.1638722542
O             2.2726335358       -2.4169228626        1.6491390466
O             1.8594870136       -1.8282023571        2.3051234613
O             2.8496074672       -2.9995348738        2.1426706273
O             2.8303625166        0.0941777748        0.1223613606
O             2.9406672277       -0.8184874768        0.4087217494
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O             3.2095743390        1.1978549452        2.7325087797
O             3.1416416936        2.1189146098        2.9837985630
O             2.3885983719        0.7829283742        3.0344022842
    18
 Energy=    -44.4633639593931
O            -0.0588612941       -2.7336397700        0.0636191932
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O             3.2095737652        1.1978556942        2.7325074797
O             3.1416414151        2.1189149680        2.9837987350
O             2.3885983190        0.7829285778        3.0344016255
    18
 Energy=    -44.4633639593630
O            -0.0588610012       -2.7336394989        0.0636189347
O             0.0436549464       -3.1665563040       -0.7839395118
O             0.7840425682       -2.8559615651        0.5235413960
O             0.0531689760        0.0609839037        0.5825367212
O             0.9505686735        0.2084761105        0.2346764770
O            -0.1853424649       -0.8123872935        0.2399512060
O             0.9088106212       -0.4084989412        3.0217880164
O             0.2198329893       -0.4999346629        3.6795796264
O             0.4579004180       -0.1909290386        2.1638728487
O             2.2726336008       -2.4169232469        1.6491398929
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O             2.8303617857        0.0941759179        0.1223609477
O             2.9406667865       -0.8184887396        0.4087231875
O             3.1291367549        0.6040409501        0.8892798930
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O             3.1416413387        2.1189151143        2.9837987591
O             2.3885983843        0.7829285752        3.0344011806
    18
 Energy=    -44.4633639594545
O            -0.0588607302       -2.7336393369        0.0636186592
O             0.0436558989       -3.1665552714       -0.7839401386
O             0.7840428239       -2.8559611565        0.5235412253
O             0.0531689198        0.0609840265        0.5825371531
O             0.9505685279        0.2084761966        0.2346767054
O            -0.1853426475       -0.8123870166        0.2399512993
O             0.9088106442       -0.4084989951        3.0217881204
O             0.2198330737       -0.4999346125        3.6795798358
O             0.4579003356       -0.1909291518        2.1638729872
O             2.2726337010       -2.4169235381        1.6491403655
O             1.8594869499       -1.8282038099        2.3051253319
O             2.8496069380       -2.9995367251        2.1426713867
O             2.8303614149        0.0941752541        0.1223607569
O             2.9406662347       -0.8184891865        0.4087237764
O             3.1291365827        0.6040409797        0.8892791615
O             3.2095734871        1.1978561904        2.7325063151
O             3.1416412245        2.1189152037        2.9837985830
O             2.3885984019        0.7829286154        3.0344008128
    18
 Energy=    -44.4633639594034
O            -0.0588606416       -2.7336392959        0.0636185488
O             0.0436561798       -3.1665549815       -0.7839403510
O             0.7840428340       -2.8559612044        0.5235412389
O             0.0531687199        0.0609840968        0.5825370574
O             0.9505684787        0.2084762133        0.2346769744
O            -0.1853425731       -0.8123871006        0.2399513941
O             0.9088107432       -0.4084989009        3.0217881079
O             0.2198332576       -0.4999346522        3.6795798882
O             0.4579002923       -0.1909291282        2.1638730432
O             2.2726335800       -2.4169235734        1.6491404841
O             1.8594869186       -1.8282038325        2.3051255028
O             2.8496068672       -2.9995367578        2.1426714245
O             2.8303613540        0.0941751513        0.1223606927
O             2.9406662576       -0.8184892728        0.4087237208
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O             3.2095734835        1.1978561313        2.7325063609
O             3.1416412140        2.1189152222        2.9837983340
O             2.3885983295        0.7829286656        3.0344008177
    18
 Energy=    -44.4633639594231
O            -0.0588605204       -2.7336392964        0.0636183201
O             0.0436567899       -3.1665543271       -0.7839408462
O             0.7840427598       -2.8559614193        0.5235413295
O             0.0531686283        0.0609839157        0.5825372396
O             0.9505683142        0.2084763357        0.2346771088
O            -0.1853424708       -0.8123873186        0.2399515028
O             0.9088108028       -0.4084986678        3.0217881355
O             0.2198334919       -0.4999347293        3.6795800586
O             0.4579001426       -0.1909290543        2.1638731299
O             2.2726334193       -2.4169236672        1.6491406685
O             1.8594869491       -1.8282036774        2.3051255812
O             2.8496066937       -2.9995367929        2.1426717009
O             2.8303611945        0.0941751967        0.1223607161
O             2.9406660648       -0.8184893235        0.4087234287
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O             3.1416412598        2.1189152381        2.9837976262
O             2.3885982940        0.7829287130        3.0344008417
    18
 Energy=    -44.4633639594671
O            -0.0588603479       -2.7336394662        0.0636179801
O             0.0436578241       -3.1665534624       -0.7839416465
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O            -0.1853425761       -0.8123875523        0.2399517867
O             0.9088107986       -0.4084986349        3.0217884146
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O             3.2095738778        1.1978557849        2.7325062503
O             3.1416413247        2.1189153208        2.9837966915
O             2.3885985947        0.7829287265        3.0344009396
    18
 Energy=    -44.4633639594479
O            -0.0588598459       -2.7336395408        0.0636170544
O             0.0436591997       -3.1665527229       -0.7839428608
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O             0.0531681281        0.0609834736        0.5825379763
O             0.9505676902        0.2084760110        0.2346775822
O            -0.1853429396       -0.8123877224        0.2399521220
O             0.9088108484       -0.4084983692        3.0217888423
O             0.2198337293       -0.4999337733        3.6795810564
O             0.4578999877       -0.1909290246        2.1638738866
O             2.2726329350       -2.4169238206        1.6491412358
O             1.8594864849       -1.8282036914        2.3051260249
O             2.8496060353       -2.9995369862        2.1426724317
O             2.8303605726        0.0941747423        0.1223606416
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O             3.1416417218        2.1189153484        2.9837965907
O             2.3885987582        0.7829288794        3.0344006254
