NCI:329112
BBtclserve11129919062D 0   0.00000     0.00000175435
999-99-9
 13 13  0  0  0  0  0  0  0  0  2 V2000
    3.7601    2.7420    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.6261    3.2420    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8941    3.2420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    1.7420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9511    1.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5691    1.1542    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.4632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2601    0.2031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2601    0.2031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6723   -0.6059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790   -1.5194    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4912   -2.3284    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8980   -3.2420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  8  9  2  0  0  0  0
M  CHG  2   1   1   2  -1
M  END