NCI:168873
BBtclserve11129918032D 0   0.00000     0.00000124580
999-99-9
 20 21  0  0  0  0  0  0  0  0  2 V2000
    3.7321    0.1900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7026    1.6845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5116    0.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9595    2.3537    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6808    1.8925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1808    1.0264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1674    3.3318    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.0875    2.8060    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    7.1753    0.9219    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3753    4.3100    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    2.8660   -4.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  8 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  2  0  0  0  0
 10 15  1  0  0  0  0
 11 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  2  0  0  0  0
 14 19  2  0  0  0  0
 17 20  2  0  0  0  0
 10 11  1  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  2  14   1  19  -1
M  END