44

C         -2.57630       -3.01130        1.75920
C         -1.55760       -3.94220        1.84060
C         -0.32970       -3.67530        1.26440
C         -0.12070       -2.47760        0.60650
C         -1.13950       -1.54690        0.52470
C         -2.36720       -1.81370        1.10130
C          1.21780       -2.18680       -0.02200
C          1.22180       -2.67990       -1.44610
N          1.10330       -1.83950       -2.42150
O          1.08670       -0.44810       -2.15920
S          0.94170        0.41490       -3.40450
O          1.15150        1.75890       -2.99380
O          1.72170       -0.20220       -4.41940
S          1.38800       -4.40160       -1.78180
C          1.32600       -4.37660       -3.59050
H          2.09020       -3.69880       -3.97110
C          1.58000       -5.78670       -4.12970
H          0.84100       -6.47320       -3.71640
C          1.46640       -5.76910       -5.65710
H          2.23810       -5.12110       -6.07270
C          0.08460       -5.23700       -6.04920
H         -0.68530       -5.91210       -5.67570
C         -0.11160       -3.84800       -5.43600
H          0.63360       -3.16330       -5.84080
O          0.03730       -3.92990       -4.01710
C         -1.51300       -3.33470       -5.77310
O         -1.65520       -1.99340       -5.30130
O         -0.00650       -5.14770       -7.47250
O          1.62940       -7.09530       -6.16390
O          2.89090       -6.21300       -3.75320
H         -3.53570       -3.22000        2.20910
H         -1.72240       -4.87990        2.35040
H          0.46620       -4.40250        1.32800
H         -0.97620       -0.61120        0.01070
H         -3.16310       -1.08640        1.03770
H          1.39940       -1.11210       -0.00910
H          2.00130       -2.69450        0.54050
H         -1.65810       -3.35730       -6.85320
H         -2.25770       -3.96960       -5.29310
H         -2.52150       -1.60300       -5.48110
H          0.11320       -5.99230       -7.92800
H          2.48140       -7.49750       -5.94640
H          3.03540       -6.24310       -2.79750
O         -0.50980        0.31840       -3.85240