NCI:53258
BBtclserve11129917042D 0   0.00000     0.00000 45038
10598-87-5
 20 20  0  0  0  0  0  0  0  0  2 V2000
    3.7634    1.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1701    0.2031    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3512    1.9257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -0.6059    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0421    2.8768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3512    1.9257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9890   -1.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878   -0.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8512    3.4645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6602    2.8768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4013   -2.3284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.3104    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1811    0.4122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8512    4.4645    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.8080   -3.2420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4067   -2.2239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7172    4.9645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9851    4.9645    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.2202   -4.0510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6269   -4.9645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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  2  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 11 16  2  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 19 20  1  0  0  0  0
  9 10  2  0  0  0  0
M  CHG  2  14   1  18  -1
M  END