52

C         -2.90440        0.07740        0.28380
C         -2.66940        1.54670        0.04490
C         -3.64050        2.57700        0.10350
C         -5.01420        2.59680        0.37480
C         -5.69300        3.77920        0.35610
C         -5.02760        4.97160        0.06780
C         -3.66870        4.97120       -0.20300
C         -2.96290        3.77680       -0.18770
O         -1.66700        3.46940       -0.40000
C         -1.48470        2.13710       -0.26760
C         -0.20610        1.43690       -0.42970
O         -0.12530        0.24970       -0.17230
C          0.98090        2.17010       -0.91040
C          0.86430        3.49860       -1.32800
C          1.98140        4.18070       -1.77210
C          3.21700        3.54560       -1.81470
C          3.34030        2.23170       -1.40900
C          2.23000        1.53570       -0.95600
O          2.35220        0.24370       -0.55830
C          3.65560       -0.33740       -0.63230
O          1.87020        5.47490       -2.17420
C          3.06290        6.11820       -2.62760
N         -5.73650        6.17370        0.05170
C         -5.14010        7.31320        0.45460
O         -4.02000        7.27930        0.92590
C         -5.84760        8.60360        0.32360
C         -7.13200        8.64710       -0.22250
C         -7.78880        9.85420       -0.33750
C         -7.17400       11.02300        0.07710
C         -5.90010       10.98900        0.61420
C         -5.23260        9.78650        0.74020
Br        -3.49040        9.74170        1.47420
H         -2.76200       -0.14620        1.34110
H         -3.92250       -0.17990       -0.00810
H         -2.19850       -0.50450       -0.30890
H         -5.53500        1.67730        0.59790
H         -6.75250        3.79300        0.56550
H         -3.16050        5.89780       -0.42560
H         -0.09580        3.99250       -1.29990
H          4.08520        4.08260       -2.16730
H          4.30360        1.74490       -1.44490
H          4.00560       -0.31430       -1.66430
H          4.34210        0.22900       -0.00300
H          3.61320       -1.37010       -0.28600
H          3.80060        6.12320       -1.82520
H          3.46320        5.57830       -3.48570
H          2.83480        7.14380       -2.91780
H         -6.65840        6.18910       -0.24950
H         -7.61170        7.73670       -0.55030
H         -8.78380        9.88830       -0.75600
H         -7.69140       11.96600       -0.01960
H         -5.42610       11.90470        0.93530