31

C         -0.01690        1.39150        0.00970
C          1.17020        2.09440        0.00210
C          2.37760        1.41900       -0.01300
C          2.40340        0.03570       -0.02120
C          1.22350       -0.67930       -0.01420
C          0.00210       -0.00410        0.00200
C         -1.26600       -0.76370        0.01050
N         -2.52260       -0.32810        0.01950
N         -3.50210       -1.12260        0.02600
C         -3.33520       -2.44200        0.02430
S         -1.54720       -2.53190        0.00380
C         -4.34020       -3.52600        0.03090
C         -3.93170       -4.86060        0.03380
C         -4.87470       -5.86750        0.03990
C         -6.22290       -5.55680        0.04260
C         -6.63470       -4.23590        0.03980
C         -5.70180       -3.21940        0.04000
N         -7.22930       -6.64230        0.04820
O         -6.87250       -7.79740        0.05030
O         -8.40810       -6.37380        0.05060
N          3.64750        2.17970       -0.02110
O          3.62800        3.38850       -0.01440
O          4.70400        1.59220       -0.03430
H         -0.95860        1.91990        0.02600
H          1.15700        3.17430        0.00770
H          3.34920       -0.48550       -0.03330
H          1.24490       -1.75900       -0.02090
H         -2.87960       -5.10450        0.03090
H         -4.55990       -6.90060        0.04210
H         -7.68860       -4.00000        0.04160
H         -6.02450       -2.18870        0.04230