45

C         -0.01840        1.50280        0.01030
C          0.00210       -0.00410        0.00200
C          0.00590       -0.69890       -1.19500
C          0.02490       -2.08610       -1.15530
C          0.03930       -2.72740        0.06790
N          0.03520       -2.03850        1.19280
C          0.02310       -0.71480        1.19630
N          0.02570       -0.02730        2.40910
C          0.04600       -0.71030        3.57080
O          0.06200       -1.92300        3.56110
C          0.04890        0.03280        4.88190
C          0.07340       -0.97050        6.03670
C          0.07630       -0.21600        7.36780
C          0.10080       -1.21930        8.52270
C          0.10370       -0.46480        9.85370
H         -0.73200        0.23290        9.90730
C          0.08480       -1.44490       11.04640
H         -0.93710       -1.58550       11.39860
C          0.98710       -1.01780       12.20800
H          0.40440       -0.94290       13.12620
C          1.74410        0.30310       11.95200
S          1.71020        0.40370       10.11950
N          1.96670       -2.11010       12.31990
C          1.69900       -3.03380       11.38660
O          2.35390       -4.04920       11.25130
N          0.65280       -2.73330       10.61910
H          1.00420        1.88010        0.00260
H         -0.54550        1.86390       -0.87280
H         -0.52860        1.85430        0.90710
H         -0.00590       -0.17350       -2.13850
H          0.02810       -2.65820       -2.07130
H          0.05370       -3.80670        0.10380
H          0.01290        0.94250        2.41690
H          0.93110        0.67070        4.93600
H         -0.84870        0.64710        4.95330
H         -0.80880       -1.60840        5.98260
H          0.97090       -1.58480        5.96540
H          0.95840        0.42190        7.42190
H         -0.82130        0.39830        7.43920
H         -0.78140       -1.85720        8.46850
H          0.99830       -1.83370        8.45130
H          1.21070        1.14990       12.38400
H          2.76400        0.24980       12.33280
H          2.68980       -2.15430       12.96490
H          0.31860       -3.28320        9.89320