   39
E(RHF/6-31G(d,p))=  -988.511528
 O     3.107740    -1.393665     1.899702
 O     2.622082    -2.494485    -0.600445
 O     0.335315    -0.537436     1.896289
 O     1.002692     1.977329     0.740504
 O     0.695608     0.866215    -1.883828
 O    -0.144038    -1.600252    -0.708162
 O    -2.893145    -0.869270    -0.517294
 O    -2.443214     0.364591     1.993356
 O     3.455750    -0.027695    -2.000313
 O     3.783302     1.121235     0.507854
 O    -1.727920     2.920159     0.667191
 O    -2.123293     1.640617    -1.764798
 H     0.172115    -1.001962     1.078041
 H     1.165854    -0.865537     2.220278
 H     3.027898     1.676397     0.659039
 H     3.702859     0.399636     1.120690
 H     0.862845     1.329359    -1.066610
 H     1.549338     0.658219    -2.244541
 H     2.944840    -1.851995    -1.221419
 H     1.678990    -2.513026    -0.712683
 H     2.996620    -1.860472     1.067983
 H     3.658384    -1.929269     2.447000
 H     0.758437     1.192479     1.225821
 H     0.080855    -0.815400    -1.201582
 H     3.664628     0.408071    -1.170952
 H     4.192337     0.101535    -2.575070
 H    -1.268722     1.459237    -2.135599
 H    -2.488954     0.794930    -1.525667
 H    -1.898323     2.557936    -0.205957
 H    -2.294072     1.271499     1.753996
 H    -1.602848     0.033935     2.285775
 H    -2.821701    -0.512110     0.366877
 H    -1.092684    -1.665856    -0.751011
 H     0.267106     2.572277     0.826796
 H    -3.735419    -1.304755    -0.568649
 H    -2.183790     3.744217     0.718085
 O    -5.581846    -1.996888    -0.283749
 H    -5.761921    -2.197953     0.620859
 H    -6.286943    -1.445023    -0.581952
