 63
*****   Energy =     -916.7074302940  kJ/mol
O    3.3875220   2.1306619  -1.4207335
H    3.7874876   1.7124579  -0.6582606
H    3.4152378   3.0668228  -1.2230804
O    0.8119021   2.1827746  -0.6630112
H    0.5599952   3.1002241  -0.7681845
H    1.7375032   2.1587094  -0.9057361
O   -0.3363116   0.7774775  -2.6214140
H   -0.3810567  -0.1026703  -2.2478238
H    0.0790909   1.3064474  -1.9403386
O   -2.4969297   1.4676219   1.4014399
H   -2.5635807   1.4582886   0.4466088
H   -2.7228275   0.5760267   1.6665063
O    0.0453447   4.7667412  -0.7250432
H   -0.8569861   4.7195050  -1.0409544
H   -0.0349904   4.7868088   0.2285687
O   -2.6515042   4.3013133  -1.1936116
H   -3.2905609   4.9102253  -1.5638342
H   -2.7961392   4.3468959  -0.2485005
O   -2.6293237   1.5297090  -1.3457426
H   -1.8934829   1.3113482  -1.9176595
H   -2.7315186   2.4770277  -1.4372605
O   -3.1317652  -1.2127032  -0.8793369
H   -2.2864298  -1.5188303  -1.2078583
H   -3.1876814  -0.3029628  -1.1717026
O    4.1872800   0.8052710   0.8558328
H    3.6783785  -0.0006167   0.7675360
H    5.0761798   0.5077577   1.0496753
O    2.6800238  -1.4088094   0.5640958
H    2.5776044  -1.7562262  -0.3219312
H    1.7995576  -1.4419775   0.9381429
O    0.0076516  -1.0524557   1.3266513
H    0.1295597  -0.1419533   1.5956420
H   -0.8719184  -1.2767336   1.6304407
O    2.6564360   4.9252809   2.1810229
H    3.2084112   5.4094861   2.7951082
H    2.7892556   4.0060121   2.4124008
O    2.1922272  -2.1871748  -2.0479669
H    2.3172163  -1.3533077  -2.5010403
H    2.6181450  -2.8328575  -2.6118108
O   -2.7344984  -1.2618289   1.7770099
H   -3.3505726  -1.8460821   2.2189745
H   -2.9605744  -1.3318626   0.8495311
O    2.8840373   4.6984825  -0.5828676
H    1.9975794   4.9524169  -0.8396589
H    2.9154034   4.8573661   0.3605328
O    0.1557576   1.6449697   1.8656184
H   -0.7984289   1.5898255   1.8134722
H    0.4366642   1.8024345   0.9642149
O    2.3385662   0.2337556  -3.2114198
H    2.7941890   0.9337456  -2.7438153
H    1.4263535   0.5218007  -3.2450370
O    2.7845653   2.2872957   2.6995893
H    1.9056866   1.9155452   2.6247172
H    3.3204182   1.7572116   2.1095854
O   -2.8121098   4.2376029   1.4919079
H   -1.9552524   4.4780189   1.8443673
H   -2.8788296   3.2951213   1.6452340
O   -0.0522315   4.4127133   1.9883779
H    0.0343291   3.4649404   2.0906810
H    0.8210576   4.7553769   2.1785876
O   -0.4059543  -1.6086085  -1.3259745
H    0.4152517  -1.9844713  -1.6431178
H   -0.2441013  -1.4245475  -0.4006869
