21

C         -6.05490       -2.19850       -1.25650
O         -5.56170       -1.77800        0.01700
C         -4.54070       -0.88080        0.01770
C         -4.02400       -0.41520       -1.18260
C         -2.98950        0.50030       -1.17930
C         -2.46150        0.94500        0.01890
C         -2.97420        0.48300        1.21670
C         -4.01290       -0.42910        1.21920
Br        -4.71350       -1.06130        2.85790
C         -1.32950        1.93970        0.01890
C         -0.01430        1.20410        0.00870
O          0.00210       -0.00410        0.00200
H         -6.86600       -2.91270       -1.11420
H         -6.42500       -1.33330       -1.80660
H         -5.25000       -2.67040       -1.82010
H         -4.43300       -0.76520       -2.11890
H         -2.59010        0.86620       -2.11370
H         -2.56310        0.83530        2.15130
H         -1.39150        2.56070        0.91260
H         -1.40000        2.57040       -0.86730
O          1.13890        1.89100        0.00130