56

C         -5.31390       12.20750       -2.28710
C         -5.35580       12.38960       -0.76860
N         -4.08450       11.93950       -0.18620
C         -3.99260       12.31490        1.23170
C         -2.62490       11.89970        1.77890
N         -2.45140       10.45040        1.60850
C         -2.54330       10.07510        0.19070
C         -3.91100       10.49020       -0.35660
C         -1.18010       10.00030        2.19090
C         -1.14600        8.49400        2.21930
C         -1.62710        7.80860        3.32320
C         -1.60010        6.41680        3.35810
C         -1.09760        5.70910        2.30310
C         -0.60940        6.38500        1.18330
C         -0.63320        7.78940        1.14040
O         -0.15940        8.44020        0.05610
C          0.34310        7.78490       -1.00250
O          0.75630        8.42520       -1.95370
C          0.41020        6.38440       -1.04290
C         -0.06220        5.64760        0.03100
C         -0.01340        4.17350        0.02360
C          1.19930        3.50970        0.00890
C          1.20000        2.09120        0.00180
C          2.41280        1.38640       -0.01300
C          2.40590        0.02060       -0.01980
C          1.20510       -0.67710       -0.01260
C          0.00210       -0.00410        0.00200
C         -0.01680        1.38650        0.00970
O         -1.19680        2.04290        0.03010
C         -1.25150        3.38510        0.03130
O         -2.32990        3.94860        0.04380
Br         4.04240       -0.92670       -0.03860
O         -2.12850        8.49940        4.37900
H         -6.26590       12.54450       -2.72320
H         -5.15750       11.14490       -2.52480
H         -4.48820       12.80210       -2.70500
H         -5.51220       13.45220       -0.53090
H         -6.18150       11.79500       -0.35060
H         -4.11330       13.40370        1.33130
H         -4.78560       11.80470        1.79820
H         -1.83360       12.43170        1.23040
H         -2.56490       12.15400        2.84740
H         -1.75040       10.58540       -0.37580
H         -2.42250        8.98630        0.09100
H         -4.70300        9.95910        0.19170
H         -3.97170       10.23680       -1.42530
H         -0.34460       10.37460        1.58110
H         -1.08860       10.38850        3.21600
H         -1.97800        5.89390        4.22420
H         -1.07930        4.62970        2.33470
H          0.82390        5.88410       -1.90600
H          2.12830        4.06060        0.00330
H          3.35020        1.92270       -0.01910
H          1.21380       -1.75710       -0.01810
H         -0.92580       -0.55670        0.00790
H         -2.51160        7.95960        5.25760