45

C         -2.04050       -0.36190       -1.85650
C         -2.09540        1.09960       -1.40710
C         -2.83590        1.16180       -0.09230
C         -2.22140        1.37510        1.09260
C         -3.25190        1.36290        2.11080
C         -3.21430        1.52460        3.49920
C         -4.41320        1.45430        4.16470
C         -5.61040        1.23400        3.50350
C         -5.67660        1.06950        2.13080
C         -4.47480        1.13530        1.42870
N         -4.18350        1.01840        0.10000
H         -4.83350        0.85790       -0.60180
C         -0.73560        1.58290        1.26550
C         -0.01270        1.08580        0.00800
N         -0.73080        1.57680       -1.18260
C         -0.12130        2.43000       -2.00970
O          1.05480        2.65930       -1.82230
C         -0.79490        3.12110       -3.15050
N         -2.21080        2.80100       -3.22690
C         -2.80700        1.89840       -2.44800
O         -3.99690        1.71510       -2.59400
C         -3.02810        3.51030       -4.21440
C         -3.58820        4.76480       -3.59500
C         -3.05390        6.01000       -3.55710
C         -3.75610        7.02180       -2.92940
C         -4.95310        6.73660       -2.36110
S         -5.12380        4.99490       -2.71400
H         -1.56250       -0.96230       -1.08250
H         -3.05300       -0.72790       -2.02680
H         -1.46690       -0.43660       -2.78030
H         -2.28580        1.69630        4.02350
H         -4.42320        1.57510        5.23790
H         -6.52320        1.18860        4.07880
H         -6.61640        0.89780        1.62720
H         -0.38520        1.02300        2.13250
H         -0.53030        2.64380        1.40840
H          0.00210       -0.00410        0.00200
H          1.00920        1.46500        0.00030
H         -0.31330        2.81950       -4.08070
H         -0.68170        4.19820       -3.02700
H         -2.41210        3.77340       -5.07430
H         -3.84720        2.86760       -4.53720
H         -2.09540        6.20920       -4.01300
H         -3.35470        8.02370       -2.88850
H         -5.62860        7.39280       -1.83240