 111
Energy of minimum      0=    -751.2771112081
  O       3.8195848309      2.8290544675      2.4402370836
  H       3.7228352315      3.1426814196      1.5410655267
  H       3.2563108104      3.4049890401      2.9572028318
  O       6.6019236433      2.7357116980      2.1571033231
  H       5.6804495252      2.7739427017      2.4133369642
  H       6.8246947470      1.8058064452      2.2004749162
  O       6.5441180535      4.1156513378     -0.1626120948
  H       7.0957756229      4.8914118265     -0.0621062286
  H       6.6601460931      3.6311345162      0.6547083947
  O       6.6654368011     -2.7147658363      2.4648743533
  H       6.8211862098     -1.7792985048      2.3349711886
  H       7.2364424238     -2.9540223019      3.1949022715
  O       3.8367200758      2.0814061465     -2.3766069914
  H       4.7789240166      2.1943724877     -2.5019951027
  H       3.5780958803      1.4548378860     -3.0524454184
  O       6.8098618409     -2.4407220538     -2.0792675731
  H       6.7318244036     -3.0403358606     -1.3372397569
  H       7.4376768339     -2.8639984848     -2.6648589292
  O       3.8910828347     -2.6035599765      2.3029420733
  H       3.7788208910     -1.6543029771      2.3533429052
  H       4.8163017617     -2.7467163516      2.5022108070
  O       4.1243767003      0.1363400704      2.0795157746
  H       4.0278775251      0.1228511655      1.1272879671
  H       3.9035495131      1.0332847294      2.3304290483
  O       3.2188853312     -0.1047994660     -3.9395615451
  H       2.9060333991     -0.4374772307     -4.7807993309
  H       3.4490173901     -0.8893512728     -3.4418170959
  O       6.3300429915     -4.0138071231      0.0363351569
  H       5.3762728068     -4.0926666295      0.0180198147
  H       6.5225149873     -3.6270808180      0.8905184713
  O       6.5456505773      2.2785349411     -2.2251253758
  H       6.6457345529      2.9693145195     -1.5701149859
  H       6.8534031097      1.4854063402     -1.7864144915
  O       4.0638378642     -2.1257455617     -2.2281910290
  H       5.0070524450     -2.2669661610     -2.3096455301
  H       3.7819558622     -2.7612807681     -1.5702629348
  O       3.8015586070      3.7103534760     -0.1136537401
  H       3.6237162945      3.2450541619     -0.9310278889
  H       4.7134218023      3.9910419420     -0.1907986485
  O       3.5615850790     -3.8039923193     -0.0872778092
  H       2.8889740075     -4.4781231969      0.0095402945
  H       3.5764575819     -3.3565625056      0.7587820051
  O       4.1969069824      0.0624246331     -0.6229172408
  H       4.0450849350     -0.7102484735     -1.1671214076
  H       3.9896301418      0.8024041394     -1.1936172325
  O       6.8214893217     -0.0367165541      1.9985399248
  H       5.8698245665      0.0249387316      2.0807874676
  H       6.9820908502     -0.0249043093      1.0549831121
  O       6.8799711640     -0.0258412203     -0.7363219935
  H       7.0405646645     -0.8288271329     -1.2319581409
  H       5.9262463397      0.0472370305     -0.7002613825
  C      -2.1050422525     -0.9924566147      3.4343670764
  C      -1.6592445857     -2.1560715563      2.7961934913
  C      -0.3604949251     -2.1767428802      2.1496166761
  C      -0.0151629303      0.1728838178      2.8253112385
  C      -1.2683122203      0.1928293434      3.4491861055
  C      -2.1300285378      1.3517502618      3.3092330223
  C      -3.4993285341      0.8827168204      3.2079182319
  C      -3.4838861644     -0.5660827098      3.2852553303
  C      -2.2809506097      0.9930650240     -3.3800845104
  C      -2.7267482765      2.1566799656     -2.7419109252
  C      -4.0254979371      2.1773512895     -2.0953341101
  C      -3.1176806419     -0.1922209341     -3.3949035394
  C      -4.8328495604      1.0336818736     -2.1096328283
  C      -2.2559643245     -1.3511418525     -3.2549504563
  C      -0.8866643282     -0.8821084111     -3.1536356659
  C      -0.9021066979      0.5666911191     -3.2309727643
  C      -2.5760688691     -2.9356549334      1.9856859010
  C       1.1694338852     -0.6401464589      0.9686203908
  C       0.4468566981     -1.0330734643      2.1639153943
  C      -0.4095901959      2.4293634809      1.9037421474
  C      -3.9618290553      2.6666857249      1.5647167445
  C      -5.3007865154     -0.6490780058      1.6153607690
  C      -1.8099239931      2.9362633427     -1.9314033349
  C      -5.5554267475      0.6407548682     -0.9143378248
  C      -3.9065002276     -2.5242514282      1.8418096134
  C      -3.8468074453     -3.0851956365     -0.5620084506
  C       0.2225590149     -2.5899708859     -0.2138243832
  C       1.0289465077      1.4420453710     -0.3509641698
  C      -2.5420450863      3.4387436869     -0.7839052864
  C      -0.5391854169      3.0858040458      0.6162910166
  C      -0.4241638069     -2.6660773157     -1.5104341785
  C      -4.6085518772      2.5905792952      0.2681069492
  C      -5.4149393699     -1.4414369617      0.4052467358
  C      -1.8439477759     -3.4381352776      0.8381878525
  C       0.9147936532      0.6496864151     -1.5610782030
  C      -3.9764026663     -2.4287550716     -1.8494595814
  C      -0.4746477796     -2.9691018362      0.9395026429
  C      -0.0174730062      1.3189025555     -2.4489228916
  C      -4.3685198560     -1.3182941462      2.5032054577
  C      -1.7083398565      2.4500348049      2.5503189626
  C      -4.3988624017      1.5284361399      2.3512466420
  C      -2.4679635303     -3.5115695508     -0.4128967037
  C       0.0128695395     -1.5278277306     -2.2969640760
  C      -1.9180293320      3.5121779601      0.4671792697
  C      -5.4452819062      1.4052933276      0.2532879209
  C      -4.5532230557     -2.6003578707      0.5451998181
  C       1.1539915187      0.8086530618      0.8912832932
  C       1.0592890439     -1.4046849183     -0.1990053549
  C       0.1672301934      2.6009662800     -0.4909172521
  C      -3.9113450826      2.9697102455     -0.8852200768
  C      -5.5399843809     -0.8080446526     -0.8370007272
  C       0.9296938229     -0.7482443535     -1.4864564857
  C      -2.6776530057     -2.4494263956     -2.4960363966
  C      -0.4794926346      2.5248598375     -1.7875270474
  C      -4.3708299319     -0.1722754085     -2.7710286725
  C       0.4218704255      1.3111334060      2.0387813417
  C      -2.6406065064      3.1192509485      1.6624742747
  C      -5.3156866851      0.7488527628      1.5407390517
  C      -4.8078632878     -1.3105249967     -1.9844987757
  C      -1.7453863558     -3.1186425392     -1.6081917086
