42
E = -960.142245928
O         -2.09747       -3.13681       -0.63904
C         -1.51796       -2.11403       -0.34928
O         -0.33244       -1.84509       -0.97907
C         -1.98504       -1.16021        0.74195
C          0.34221       -0.55760       -0.94130
H         -1.46658       -1.53186        1.64354
C         -3.49078       -1.27150        0.97248
C         -1.49569        0.27691        0.52310
H         -0.00255       -0.02234       -1.83696
O          1.70236       -0.80092       -1.13319
C          0.02078        0.27587        0.30728
H         -4.06195       -0.94981        0.09078
H         -3.76832       -2.31071        1.18261
H         -3.78986       -0.64556        1.82594
H         -1.67327        0.83466        1.45805
C         -2.22650        1.00179       -0.63422
C          2.46659       -0.74944        0.09684
O          0.60733       -0.33261        1.49269
C          0.57240        1.72468        0.26960
H         -3.15698        1.42715       -0.23317
H         -2.54141        0.26111       -1.38733
C         -1.39765        2.10084       -1.32893
O          1.68320       -1.28479        1.14290
C          3.61306       -1.73284       -0.05232
C          2.92646        0.70463        0.35116
H          0.61447        1.97898        1.34249
C         -0.36497        2.76719       -0.41024
C          2.00895        1.77090       -0.25690
H         -2.07294        2.86932       -1.73548
H         -0.87663        1.68225       -2.20369
H          4.13268       -1.52128       -0.99565
H          3.22385       -2.75782       -0.08362
H          4.31672       -1.62794        0.78303
H          3.93178        0.81683       -0.08122
H          3.02348        0.84018        1.43880
H          0.26852        3.41061       -1.04456
C         -1.03926        3.67622        0.62434
H          2.42981        2.76660       -0.04514
H          2.00851        1.65962       -1.35287
H         -1.64413        4.45200        0.13152
H         -0.29094        4.18005        1.25378
H         -1.70355        3.10924        1.29358
