NCI:622647
BBtclserve11129919402D 0   0.00000     0.00000212516
999-99-9
 15 15  0  0  0  0  0  0  0  0  2 V2000
    4.5823    1.4081    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8913    0.4571    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
    4.0823   -0.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2733    0.4571    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823    1.4081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945    2.2172    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4013    3.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.1126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -1.1307    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2163   -1.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2163   -2.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -3.1307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483   -2.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483   -1.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8424    0.1481    0.0000 Br  0  5  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
  6  8  1  0  0  0  0
  3  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  9 14  1  0  0  0  0
  4  5  2  0  0  0  0
 13 14  1  0  0  0  0
M  CHG  2   2   1  15  -1
M  END