58

C         -0.01680        1.38950        0.00970
C          1.17010        2.09330        0.00210
C          2.37810        1.41760       -0.01350
C          2.40230        0.03370       -0.02160
C          1.22110       -0.67960       -0.01420
C          0.00210       -0.00410        0.00200
C         -1.27090       -0.76570        0.01060
C         -1.25660       -2.13610        0.00820
S         -3.01010       -2.48620        0.02110
C         -3.57560       -0.79050        0.02820
N         -2.42750       -0.12950        0.02600
C         -4.95470       -0.26630        0.03910
C         -6.04850       -1.11760        0.05200
C         -7.34430       -0.54130        0.02990
C         -8.47990       -1.33740        0.24260
C         -9.71730       -0.76450        0.26020
C         -9.86490        0.60710        0.06060
C         -8.75690        1.40670       -0.17080
C         -7.49260        0.84000       -0.19900
O         -6.40560        1.60410       -0.46650
C         -5.22280        1.18260        0.04310
O         -4.40830        1.97170        0.48490
C         -8.92640        2.88790       -0.39060
N         -8.85350        3.58590        0.89990
C         -9.99350        3.23010        1.75630
C         -9.83910        3.91390        3.11680
N         -9.76210        5.36890        2.92490
C         -8.62210        5.72470        2.06860
C         -8.77650        5.04090        0.70800
C         -9.68920        6.06690        4.21540
C         -9.86120        7.57070        3.99230
O        -11.17550        7.83130        3.49530
O        -11.10260        1.16350        0.09260
Br         4.00070        2.38850       -0.02440
H         -0.95870        1.91770        0.02600
H          1.15660        3.17320        0.00810
H          3.34750       -0.48880       -0.03420
H          1.24110       -1.75940       -0.02120
H         -0.41800       -2.81660        0.00040
H         -5.91770       -2.18940        0.07780
H         -8.37430       -2.40180        0.39160
H        -10.58960       -1.37830        0.42980
H         -8.13430        3.25100       -1.04540
H         -9.89530        3.07820       -0.85240
H        -10.91920        3.56150        1.28570
H        -10.02170        2.14920        1.89370
H        -10.69810        3.67470        3.74360
H         -8.92720        3.56200        3.59930
H         -8.59390        6.80560        1.93120
H         -7.69640        5.39330        2.53910
H         -7.91750        5.28010        0.08120
H         -9.68840        5.39280        0.22560
H        -10.48130        5.70380        4.87020
H         -8.72030        5.87660        4.67720
H         -9.71890        8.09680        4.93630
H         -9.12370        7.91740        3.26840
H        -11.35530        8.76700        3.33050
H        -11.37780        1.46010        0.97090