54

C          0.62900       -2.85040       -3.68800
C         -0.53820       -2.21070       -4.06130
C         -0.72640       -0.87760       -3.74790
C          0.25270       -0.18410       -3.06110
C          1.42210       -0.82250       -2.69240
C          1.60780       -2.15710       -3.00080
S          0.01300        1.51530       -2.66210
O         -0.92590        2.02410       -3.59950
O          1.30650        2.07980       -2.49640
N         -0.72130        1.57110       -1.17890
C         -0.01270        1.08580        0.00800
C         -0.72880        1.57920        1.26680
H         -0.86520        2.65990        1.22600
C          0.06970        1.18530        2.52920
H          0.70000        0.31920        2.32750
C         -1.01900        0.83270        3.56730
H         -0.92690       -0.20770        3.87890
C         -2.34650        1.05530        2.80940
H         -2.73370        2.05480        3.00760
O         -2.00270        0.91470        1.41370
C         -3.37470       -0.00300        3.21390
C         -4.69640        0.30420        2.55820
O         -4.80520        1.27420        1.83830
N         -5.75740       -0.49890        2.77190
C         -7.09050       -0.30040        2.19660
C         -7.93760       -1.46730        2.73000
C         -6.98960       -2.25810        3.60320
C         -5.74910       -1.64010        3.57980
C         -4.70210       -2.19400        4.31830
C         -4.90350       -3.33930        5.05930
C         -6.14470       -3.94810        5.07590
C         -7.18680       -3.40530        4.34700
O         -0.93500        1.70430        4.69660
O          0.85940        2.28540        2.98560
H          0.77600       -3.89200       -3.93280
H         -1.30290       -2.75240       -4.59810
H         -1.63810       -0.37770       -4.03980
H          2.18880       -0.27950       -2.15980
H          2.51950       -2.65700       -2.70890
H         -1.62050        1.92520       -1.09590
H          0.00210       -0.00410        0.00200
H          1.00990        1.46310        0.00030
H         -3.02980       -0.98600        2.89310
H         -3.49620        0.00380        4.29710
H         -7.50600        0.65230        2.52490
H         -7.04200       -0.33770        1.10830
H         -8.30190       -2.08420        1.90850
H         -8.77260       -1.08970        3.32010
H         -3.73000       -1.72350        4.30930
H         -4.08880       -3.76260        5.62800
H         -6.29980       -4.84540        5.65650
H         -8.15700       -3.87960        4.35890
H         -0.09600        1.64920        5.17440
H          1.38160        2.09320        3.77650