47

C         -3.59640       -0.93060        0.03270
C         -2.35200       -0.08060        0.02490
C         -2.48600        1.26060        0.03290
C         -1.32310        2.08250        0.03200
O         -1.40530        3.29940        0.04000
C         -0.01700        1.40190        0.00970
C          1.17850        2.12220        0.00220
C          2.37030        1.45590       -0.01210
C          2.39890        0.06260       -0.02030
C          1.22190       -0.66630       -0.01310
C          0.00210       -0.00410        0.00200
O         -1.15900       -0.68940        0.00980
O          3.59150       -0.58580       -0.03510
C          4.76960        0.22300       -0.04190
C          5.98780       -0.66400       -0.05820
C          6.56120       -1.07260        1.13140
C          7.67600       -1.88980        1.11640
C          8.22320       -2.29060       -0.08810
C          7.65260       -1.87800       -1.27770
C          6.53520       -1.06440       -1.26280
N          9.41970       -3.16180       -0.10410
O          9.90150       -3.51530       -1.16550
O          9.92240       -3.52530        0.94400
O         -3.72430        1.82540        0.04730
C         -4.29360        2.08400        1.25380
C         -3.61720        1.76820        2.42350
C         -4.19580        2.03700        3.64870
C         -5.45250        2.61070        3.71070
C         -6.13160        2.92140        2.54720
C         -5.55530        2.65950        1.31840
Br        -6.48420        3.08520       -0.27270
H         -3.31680       -1.98410        0.02420
H         -4.17740       -0.71600        0.92960
H         -4.19500       -0.70650       -0.85020
H          1.16100        3.20200        0.00780
H          3.29620        2.01190       -0.01720
H          1.25260       -1.74580       -0.01960
H          4.76990        0.85700       -0.92860
H          4.78680        0.84750        0.85130
H          6.13620       -0.75620        2.07240
H          8.12160       -2.21240        2.04580
H          8.08000       -2.19110       -2.21880
H          6.08960       -0.74180       -2.19220
H         -2.63760        1.31610        2.37600
H         -3.66780        1.79510        4.55920
H         -5.90450        2.81610        4.66980
H         -7.11330        3.36870        2.59850