57

C         -6.83770       -2.34310        1.29910
O         -6.58790       -1.20110        0.47720
C         -5.31440       -1.02450        0.03700
C         -4.97710        0.11830       -0.67360
C         -3.68170        0.29580       -1.11960
C         -2.72170       -0.66440       -0.85820
C         -3.05670       -1.80680       -0.15510
C         -4.34930       -1.98630        0.29790
S         -1.07040       -0.43500       -1.42840
O         -1.12840        0.54210       -2.45850
O         -0.52940       -1.73210       -1.63840
N         -0.21190        0.24000       -0.18360
C          0.39000       -0.60290        0.85630
C          1.85560       -0.23790        1.04760
H          2.20870       -0.71980        1.95930
C          2.02710        1.27060        1.22900
C          1.47630        1.97310       -0.01440
H          1.66040        3.04630        0.03470
C         -0.03510        1.69840       -0.09570
C          2.11620        1.39210       -1.25420
C          2.16430        2.18180       -2.35910
C          2.61870        1.67240       -3.58030
C          3.00140        0.36000       -3.64680
C          2.95160       -0.42610       -2.47930
O          3.24730       -1.60900       -2.53390
N          2.57850        0.11890       -1.29500
C          2.71760       -0.72040       -0.10480
N          3.43640       -0.19280       -4.85760
C          4.67130       -0.72480       -4.95040
O          5.37430       -0.80510       -3.96210
C          5.17160       -1.21160       -6.25660
C          6.40430       -1.85920       -6.33610
N          6.84590       -2.29190       -7.50320
C          6.12140       -2.11160       -8.59350
C          4.89480       -1.46830       -8.51780
N          4.44420       -1.03740       -7.35650
H         -6.16150       -2.33050        2.15380
H         -7.86900       -2.31880        1.65120
H         -6.67330       -3.25120        0.71900
H         -5.72650        0.86870       -0.87770
H         -3.41850        1.18540       -1.67250
H         -2.30610       -2.55750        0.04370
H         -4.60940       -2.87680        0.85100
H         -0.14430       -0.45530        1.79480
H          0.31420       -1.64950        0.56130
H          1.47640        1.59910        2.11040
H          3.08440        1.50820        1.34670
H         -0.45160        2.17640       -0.98230
H         -0.52950        2.07850        0.79830
H          1.84920        3.21270       -2.29370
H          2.66710        2.30390       -4.45510
H          3.76130       -0.71690        0.20950
H          2.43030       -1.74110       -0.35720
H          2.84910       -0.19280       -5.62950
H          6.99670       -2.00630       -5.44510
H          6.48530       -2.46660       -9.54640
H          4.30600       -1.32360       -9.41160