NCI:53256
BBtclserve11129917042D 0   0.00000     0.00000 45036
999-99-9
 18 18  0  0  0  0  0  0  0  0  2 V2000
    4.7579    0.2554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1646   -0.6581    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3457    1.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5768   -1.4672    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0367    2.0155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3457    1.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9836   -2.3807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -1.3626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8457    2.6033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6547    2.0155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3958   -3.1897    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9781   -2.4852    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945   -2.1716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8457    3.6033    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.8025   -4.1033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.0671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7117    4.1033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9797    4.1033    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
  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
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  1  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
  9 10  2  0  0  0  0
M  CHG  2  14   1  18  -1
M  END