NCI:333334
BBtclserve11129919062D 0   0.00000     0.00000176483
999-99-9
 17 18  0  0  0  0  0  0  0  0  2 V2000
    2.6723    0.1987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790   -0.7148    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2601    1.0077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4912   -1.5239    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9511    1.9588    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2601    1.0077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8980   -2.4374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.2678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    2.5466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5691    1.9588    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8761   -2.6453    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3980   -3.3034    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    3.5466    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.9806   -3.6398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0671   -4.0466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261    4.0466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8941    4.0466    0.0000 O   0  5  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
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  2  0  0  0  0
  7 12  1  0  0  0  0
  9 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
  9 10  2  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  2  13   1  17  -1
M  END