48

C         -0.01680        1.38970        0.00970
C          1.17010        2.09340        0.00210
C          2.37820        1.41760       -0.01350
C          2.40240        0.03340       -0.02120
C          1.22110       -0.67970       -0.01370
C          0.00210       -0.00410        0.00200
C         -1.27070       -0.76560        0.01060
C         -1.25670       -2.13260        0.00830
S         -3.01020       -2.48240        0.02110
C         -3.57600       -0.78690        0.02820
N         -2.43120       -0.12740        0.02600
N         -4.87070       -0.29500        0.03890
C         -6.09570       -1.11020        0.05340
H         -6.15360       -1.73130       -0.84050
C         -7.22720       -0.06330        0.06060
C         -6.49830        1.26130        0.04920
N         -5.22570        1.05230        0.04380
C         -7.14230        2.58610        0.05040
C         -6.36160        3.74700        0.03320
N         -6.94490        4.92980        0.03400
C         -8.26470        5.01940        0.05090
C         -9.04220        3.87460        0.06850
N         -8.47100        2.68430        0.06230
C         -6.15030       -1.96330        1.29440
C         -5.71930       -1.45020        2.50370
C         -5.76790       -2.22870        3.64500
C         -6.24860       -3.52640        3.57910
C         -6.68260       -4.04340        2.36090
C         -6.63640       -3.25540        1.22230
O         -7.10470       -5.32660        2.55710
C         -6.54510       -5.72620        3.82220
O         -6.39880       -4.48570        4.53850
Cl         3.86790        2.30890       -0.02410
H         -0.95880        1.91780        0.02600
H          1.15650        3.17330        0.00810
H          3.34750       -0.48920       -0.03340
H          1.24110       -1.75950       -0.02040
H         -0.41820       -2.81320        0.00020
H         -7.84840       -0.16560       -0.82920
H         -7.83120       -0.15950        0.96280
H         -5.28410        3.67470        0.01970
H         -8.73760        5.99040        0.05150
H        -10.11910        3.95510        0.08260
H         -5.34360       -0.43900        2.55680
H         -5.43060       -1.82520        4.58830
H         -6.97650       -3.65210        0.27720
H         -7.22670       -6.39430        4.34860
H         -5.57510       -6.20230        3.67870