 90
Energy of minimum    859=    -412.2175868543
  O      -7.4012967789      0.4220580707     -2.1875407172
  H      -6.4661889180      0.5000362133     -2.3765500736
  H      -7.5832192887      1.1367691277     -1.5773570200
  O      -4.6542354556      0.9762684784      2.1373760166
  H      -4.0204241987      1.0892790397      2.8457147368
  H      -4.6398576100      0.0377076130      1.9499497154
  O      -4.8719462607     -1.6421869023      1.5879105095
  H      -4.7121680091     -1.8188586860      0.6608237659
  H      -5.8105999423     -1.7908105657      1.7022438451
  O      -4.8712057571      2.2966603869     -0.2842789799
  H      -5.8114802982      2.4758666226     -0.2834121539
  H      -4.7014538576      1.9013417713      0.5707878735
  O      -4.8329477511     -1.9666250256     -1.1153043078
  H      -5.7748843929     -2.1099740523     -1.2071643006
  H      -4.6712052130     -1.1379488418     -1.5662665819
  O      -7.6108482894     -2.0571926551     -1.1864589706
  H      -7.6184208268     -1.1711504300     -1.5485413795
  H      -8.0407894947     -2.5926352249     -1.8533050197
  O      -4.6375725769      0.5318277849     -2.2975935019
  H      -4.6299193351      1.1741333266     -1.5879338244
  H      -4.0057139148      0.8685656157     -2.9328840679
  O      -7.6408497612     -1.7563379292      1.5420541590
  H      -8.2310778116     -2.4110823512      1.9151123707
  H      -7.7015973505     -1.8896897989      0.5961372239
  O      -7.4238455193      0.9646579067      2.0311079180
  H      -6.4856711049      1.0263235935      2.2107129017
  H      -7.5866711730      0.0274629245      1.9244064153
  O      -7.6354509698      2.3779901907     -0.2440822221
  H      -7.6488165068      1.8905295520      0.5795896343
  H      -8.2302766419      3.1134433032     -0.0973751054
  C      -0.4462629889      2.8655462176      0.6484737591
  C       0.7201437193      3.1712761083      1.3598284116
  C       1.9494713227      3.4630544441      0.6464851502
  C       0.7603786777      3.1220032891     -1.4904064567
  C      -0.4257860256      2.8404695766     -0.8021093681
  C      -1.2806409541      1.7545138606     -1.2438817146
  C      -1.8294473139      1.1084329647     -0.0663289169
  C      -1.3137733726      1.7950887233      1.1032110900
  C       3.5286341606     -2.8729718666     -0.6475174464
  C       2.3622274524     -3.1787017573     -1.3588720989
  C       1.1328998490     -3.4704800931     -0.6455288375
  C       3.5081571973     -2.8478952257      0.8030656808
  C       1.1131418538     -3.4462839148      0.7541229036
  C       4.3630121258     -1.7619395096      1.2448380273
  C       4.9118184856     -1.1158586137      0.0672852297
  C       4.3961445443     -1.8025143723     -1.1022547772
  C       1.0614839757      2.4176735907      2.5518056083
  C       3.0908127767      2.8405080408     -1.4526429101
  C       1.9692293178      3.4388582658     -0.7531665909
  C       0.3100112207      1.2799991650     -3.0717833531
  C      -1.6231873002     -1.0754338111     -1.1997951162
  C      -1.1587515980     -0.3723123503      2.2757740034
  C       2.0208871960     -2.4250992398     -2.5508492956
  C      -0.0084416050     -2.8479336898      1.4535992228
  C       0.2244327257      1.3848009006      2.9905766655
  C       2.1869273956     -0.0274954734      3.4911728508
  C       4.1327813815      2.3124392939      0.7226749482
  C       3.1400162780      0.9381602898     -3.0259245068
  C       0.5805997170     -2.2511256087     -2.5741884512
  C       0.8954437761      0.0200698243     -3.4902165380
  C       4.7055584719      1.0680081621      1.2007514289
  C      -1.0504102099     -2.3198649429     -0.7217186354
  C      -0.0576451063     -0.9455859389      3.0268808195
  C       2.5017714547      2.2436999597      2.5751447640
  C       4.2411227697      0.3648867013     -2.2748176907
  C       2.7723599510     -1.2874248141      3.0727396658
  C       3.0505778145      2.8897808556      1.3975919663
  C       4.0667890861     -1.0753715729     -2.2523804870
  C      -0.9844179144      1.0679459239      2.2533367997
  C      -0.9193163827      0.9882208293     -2.3584400916
  C      -1.9976599801     -0.2812564373     -0.0446795141
  C       3.0544377842      1.0429620273      3.0364355257
  C       5.0800311518      0.2738307882      0.0456358268
  C       0.0279333875     -1.0503876763     -3.0354792130
  C      -1.0708871682     -2.2947882955      0.7288644976
  C       0.7972098173      0.1403697708      3.4686531601
  C       2.5751388404      2.1538522886     -2.6221829112
  C       4.1532583399      2.2873626465     -0.7279081849
  C       2.2851613544     -0.1477954198     -3.4676968474
  C       0.0317933572     -2.8972065046     -1.3966356536
  C       0.5072323313     -2.1612779376      2.6231392239
  C       4.7386908953      1.0274333058     -1.1463413698
  C       4.0016875544     -0.9956464783      2.3593964044
  C       2.8579384459     -1.3922265496     -2.9896203527
  C       2.3219924940     -3.1294289381      1.4913627694
  C       1.1348513614      2.3278259197     -2.6455220669
  C      -1.0936500626     -0.4520374405     -2.3360028961
  C      -1.6563197236     -1.0348589548      1.1472976825
  C       1.9475198103     -2.3352515687      2.6464783796
  C       4.1760212343      0.4446117915      2.3369592088
