44

C         -1.10930        0.71420        2.15760
C         -0.71810        1.57180        1.24790
C         -0.01270        1.08580        0.00800
N         -0.72130        1.57110       -1.17890
C         -0.44580        2.77340       -1.80690
C          0.50450        3.74380       -1.48530
C          0.56470        4.86620       -2.29620
C         -0.27510        5.03070       -3.38000
C         -1.22660        4.07090       -3.71100
C         -1.29140        2.95180       -2.90900
C         -2.16870        1.74230       -2.96210
C         -1.71600        0.89600       -1.79260
O         -2.16370       -0.18310       -1.46670
C         -1.97290        0.98600       -4.24950
C         -3.00150        0.44030       -4.94080
C         -2.43980       -0.19960       -6.10870
C         -3.00860       -0.91390       -7.16800
C         -2.15050       -1.39080       -8.12760
C         -0.78270       -1.18130       -8.06180
C         -0.19260       -0.47870       -7.02560
C         -1.03900        0.01760       -6.03650
N         -0.79600        0.73660       -4.90100
H          0.15240        1.10680       -4.48450
C         -4.43920        0.53180       -4.49610
C         -4.45860        0.93980       -3.01700
N         -3.58240        2.10350       -2.81520
Br        -0.12940        6.59280       -4.43560
H         -1.62420        1.06890        3.06260
H         -0.92290       -0.36070        2.01650
H         -0.90450        2.64670        1.38900
H          1.01930        1.46660        0.00020
H          0.00230       -0.01410        0.00190
H          1.16610        3.62450       -0.64010
H          1.28950        5.63530       -2.07350
H         -1.88490        4.19730       -4.55780
H         -4.07370       -1.08230       -7.22840
H         -2.55470       -1.94730       -8.96030
H         -0.15570       -1.57950       -8.84580
H          0.87520       -0.32220       -6.98570
H         -4.96340        1.28480       -5.10280
H         -4.92580       -0.44630       -4.62480
H         -5.48580        1.20000       -2.72190
H         -4.10120        0.10170       -2.40070
H         -3.75640        2.49960       -1.80390