NCI:688021
BBtclserve11129920232D 0   0.00000     0.00000243854
999-99-9
 20 20  0  0  0  0  0  0  0  0  2 V2000
    5.6244    2.4200    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.4335    3.0078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2425    2.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9335    1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9335    1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3457    0.6599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7524   -0.2536    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1646   -1.0626    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.3556   -0.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5768   -1.8717    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9736   -1.6504    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4335    4.0078    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.2995    4.5078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5674    4.5078    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.9836   -2.7852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -1.7671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3958   -3.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8025   -4.5078    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.9945   -2.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.4716    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  2 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
  4  5  2  0  0  0  0
M  CHG  2  12   1  14  -1
M  END