49

C         -1.12500       -0.89990       -5.53710
C         -1.20500       -0.09040       -4.26850
O         -0.72250       -0.52150       -3.24270
N         -1.81260        1.11260       -4.27390
C         -2.28100        1.71520       -5.53220
C         -3.80560        1.86740       -5.47640
C         -4.19720        2.44840       -4.14230
C         -5.43660        3.10040       -3.77230
C         -6.60520        3.38810       -4.48430
C         -7.60470        4.03540       -3.80080
C         -7.47370        4.39240       -2.46860
C         -6.32940        4.11860       -1.73970
C         -5.29800        3.46130       -2.40750
N         -4.06270        3.04630       -2.00070
H         -3.70190        3.16070       -1.10760
C         -3.40950        2.44460       -3.04260
C         -2.02380        1.85350       -3.02650
C         -0.98420        2.90880       -2.83570
C         -0.65000        4.01340       -3.58940
C          0.38920        4.80920       -3.11770
C          1.05390        4.50360       -1.94660
C          0.72390        3.39420       -1.18410
C         -0.31690        2.58750       -1.64650
N         -0.84820        1.43550       -1.09280
C         -1.85410        0.93240       -1.84000
O         -2.49990       -0.06650       -1.60290
C         -0.37140        0.83020        0.15320
C         -1.13810        1.40470        1.31640
C         -1.76370        0.60740        2.14650
Br         0.90160        6.34140       -4.10040
H         -1.69420       -0.40210       -6.32220
H         -0.08340       -0.99050       -5.84530
H         -1.53960       -1.89250       -5.36150
H         -2.00910        1.07110       -6.36850
H         -1.82120        2.69490       -5.66200
H         -4.27380        0.89090       -5.59990
H         -4.13540        2.53290       -6.27430
H         -6.71660        3.11370       -5.52290
H         -8.52210        4.27420       -4.31820
H         -8.29260        4.90140       -1.98220
H         -6.23990        4.40160       -0.70130
H         -1.17160        4.25060       -4.50480
H          1.85450        5.14810       -1.61500
H          1.25000        3.16380       -0.26950
H         -0.52380       -0.24840        0.11470
H          0.69040        1.04280        0.27730
H         -1.17190        2.47380        1.46560
H         -2.31320        1.01920        2.98010
H         -1.72990       -0.46170        1.99720