54

C         -8.48440        8.12870        2.39380
O         -7.13020        8.54310        2.20290
C         -6.25790        7.60800        1.74300
C         -4.92740        7.94160        1.53490
C         -4.04400        6.99100        1.06140
C         -4.48240        5.70490        0.80540
C         -5.80780        5.36970        1.01240
C         -6.69640        6.31830        1.48030
S         -3.35170        4.49280        0.20800
O         -2.04810        5.02750        0.39270
O         -3.75250        3.25110        0.77070
N         -3.58520        4.36900       -1.42680
C         -4.52000        3.37410       -1.98400
C         -5.32410        4.06740       -3.05520
C         -5.03500        5.29070       -3.54850
N         -5.95000        5.58390       -4.47790
C         -6.79540        4.59170       -4.57680
N         -6.43650        3.62470       -3.70080
C         -7.11630        2.34450       -3.48850
C         -8.07950        2.47210       -2.33660
C         -7.65870        2.19240       -1.04980
C         -8.54020        2.31470        0.00770
C         -9.84690        2.70630       -0.22300
C        -10.26900        2.98070       -1.51170
C         -9.38510        2.86350       -2.56780
Cl       -10.95640        2.85390        1.10400
C         -3.87500        6.14040       -3.09280
C         -2.87000        5.25240       -2.35990
H         -2.32370        4.64990       -3.08560
C         -1.90380        6.11820       -1.59310
O         -2.31940        6.97060       -0.84440
O         -0.58140        5.94230       -1.74200
C          0.29000        6.81200       -0.97220
H         -9.07280        8.96880        2.76270
H         -8.89650        7.78540        1.44490
H         -8.51680        7.31590        3.11930
H         -4.58360        8.94500        1.73860
H         -3.00930        7.25150        0.89460
H         -6.14860        4.36550        0.80780
H         -7.73170        6.05620        1.64120
H         -3.96300        2.54340       -2.41730
H         -5.18250        3.00760       -1.19990
H         -7.64130        4.55060       -5.24710
H         -7.66290        2.06940       -4.39050
H         -6.37870        1.57460       -3.26170
H         -6.63990        1.88240       -0.87040
H         -8.21020        2.10040        1.01350
H        -11.28880        3.28680       -1.69240
H         -9.71430        3.07800       -3.57380
H         -3.39690        6.59990       -3.95780
H         -4.23440        6.91760       -2.41840
H          1.33010        6.56500       -1.18510
H          0.10010        7.85020       -1.24470
H          0.09400        6.67390        0.09110