52
E = -780.578535961
H         -3.04718        1.46887       -0.88854
C         -2.47856        0.57643       -0.59070
C         -3.30565       -0.62875       -0.46760
C         -1.14983        0.75082       -0.43002
C         -3.01015       -1.73416        0.25431
C         -4.62308       -0.54803       -1.20286
H         -0.49866       -0.09501       -0.19956
C         -0.49575        2.09553       -0.57701
H         -3.75000       -2.54116        0.24792
C         -1.75743       -1.99366        1.03837
H         -4.46457       -0.41010       -2.28466
H         -5.22445       -1.45472       -1.05625
H         -5.21353        0.31699       -0.85867
H         -1.24881        2.74760       -1.05350
C         -0.20079        2.75190        0.80730
C          0.71842        2.10170       -1.55675
H         -1.97280       -2.73231        1.82971
H         -1.44618       -1.06647        1.55231
C         -0.62573       -2.48739        0.16064
C         -1.47377        3.36935        1.39209
C          0.42048        1.78708        1.82377
H          0.51493        3.57333        0.62354
H         -1.88805        4.14364        0.72911
H         -2.24626        2.59804        1.53601
H         -1.27369        3.83074        2.37081
H          1.27446        1.23236        1.41433
H         -0.32345        1.04402        2.14941
H          0.75708        2.33237        2.71795
H          0.69145        3.07712       -2.06919
H          0.53633        1.35649       -2.34749
C          2.14471        1.96032       -1.00894
H         -0.91230       -2.75395       -0.86210
C          0.67350       -2.57830        0.48954
H          2.83279        2.37381       -1.77125
H          2.26775        2.64142       -0.14960
C          2.70699        0.60904       -0.61721
C          1.20703       -2.23381        1.85061
C          1.68557       -2.99452       -0.54751
C          2.22646       -0.56331       -1.06603
C          3.92948        0.73148        0.25400
H          1.83991       -1.33191        1.80794
H          1.84156       -3.04778        2.23863
H          0.40825       -2.04831        2.57887
H          2.17960       -3.93509       -0.24382
H          1.16088       -3.20100       -1.49356
C          2.78064       -1.93269       -0.78774
H          1.34344       -0.54453       -1.71385
H          4.69484        1.34738       -0.24788
H          4.39023       -0.23093        0.50345
H          3.68608        1.25273        1.19522
H          3.39618       -2.26897       -1.64196
H          3.45904       -1.90869        0.07697
