58

C         -2.90130       -2.57880       -0.40250
C         -2.82190       -1.11470        0.03440
C         -1.94720       -1.01880        1.26180
C         -0.68940       -0.52410        1.23600
C         -0.17860       -0.59790        2.58960
C          1.04660       -0.24010        3.16060
C          1.18760       -0.45230        4.50980
C          0.17220       -0.99580        5.27950
C         -1.04920       -1.36040        4.74020
C         -1.22130       -1.15660        3.37250
N         -2.27290       -1.39870        2.53600
H         -3.12270       -1.78170        2.80420
C          0.00210       -0.00410        0.00200
H          1.03410       -0.35440       -0.01230
C         -0.73330       -0.51990       -1.24060
N         -2.18480       -0.35090       -1.03800
C         -2.85940        0.49600       -1.82020
O         -2.27760        0.97780       -2.76900
C         -4.28480        0.88760       -1.60200
N         -4.84640        0.27290       -0.41060
C         -4.19980       -0.62460        0.33300
O         -4.76450       -1.06960        1.30960
C         -6.19930        0.66130       -0.00460
C         -6.12300        1.85950        0.94380
C         -7.53590        2.26510        1.36790
O         -7.46460        3.38420        2.25370
C         -8.73740        3.84500        2.71170
C         -0.01840        1.50280        0.01030
C         -1.22490        2.17740        0.01970
C         -1.24410        3.55940        0.03210
C         -0.05590        4.26750        0.02460
C          1.15120        3.59200        0.00990
C          1.16940        2.21000        0.00280
Br        -0.08150        6.15830        0.03500
H         -3.32910       -3.17570        0.40300
H         -3.53090       -2.65990       -1.28860
H         -1.90050       -2.94400       -0.63320
H          1.84410        0.18390        2.56850
H          2.12010       -0.18740        4.98600
H          0.33920       -1.13960        6.33680
H         -1.83300       -1.78300        5.35130
H         -0.41780        0.05000       -2.11460
H         -0.50500       -1.57540       -1.38830
H         -4.87210        0.58230       -2.46800
H         -4.34110        1.97140       -1.50100
H         -6.77960        0.93240       -0.88650
H         -6.68010       -0.17450        0.50390
H         -5.54260        1.58830        1.82580
H         -5.64220        2.69520        0.43540
H         -8.11620        2.53620        0.48600
H         -8.01670        1.42930        1.87640
H         -9.24300        3.04200        3.24800
H         -8.59730        4.69550        3.37880
H         -9.34260        4.14890        1.85760
H         -2.15270        1.62450        0.02140
H         -2.18680        4.08640        0.04320
H          2.07920        4.14450        0.00440
H          2.11180        1.68250       -0.00910