40

C          0.87400       -4.16930       -0.18310
O          0.68550       -2.75340       -0.14400
C         -0.59510       -2.30090       -0.16770
C         -1.64870       -3.19820       -0.22760
C         -2.95140       -2.73670       -0.25250
C         -3.21280       -1.37790       -0.21790
C         -2.17470       -0.47180       -0.15140
C         -0.85530       -0.92550       -0.13200
C          0.26130        0.04020       -0.06810
N          1.53660       -0.25470       -0.03930
N          2.23540        0.82340        0.01570
C          1.44420        1.85580        0.02460
N          0.14610        1.42940       -0.02770
N         -0.86410        2.33660       -0.02450
C         -0.49210        3.76510        0.02700
H         -0.87790        4.23800        0.93010
S          1.33800        3.62990        0.07750
C         -0.95110        4.49840       -1.20700
C         -0.94370        3.86100       -2.43280
C         -1.36470        4.53310       -3.56520
C         -1.79460        5.84430       -3.47410
C         -1.80390        6.48590       -2.25100
C         -1.38680        5.81180       -1.11210
O         -1.40030        6.43910        0.09340
C         -1.86150        7.79150        0.11590
H          0.38650       -4.62470        0.67890
H          0.43910       -4.56870       -1.09940
H          1.94020       -4.39470       -0.15870
H         -1.45200       -4.25980       -0.25520
H         -3.76960       -3.44010       -0.29960
H         -4.23360       -1.02590       -0.23800
H         -2.38280        0.58750       -0.11960
H         -1.51120        2.15980       -0.77820
H         -0.60850        2.83700       -2.50660
H         -1.35820        4.03320       -4.52250
H         -2.12300        6.36720       -4.36020
H         -2.13940        7.51010       -2.18050
H         -1.82120        8.17210        1.13650
H         -1.22630        8.40270       -0.52520
H         -2.88880        7.83110       -0.24640