NCI:53262
BBtclserve11129917042D 0   0.00000     0.00000 45041
3318-78-3
 18 19  0  0  0  0  0  0  0  0  2 V2000
    3.9499    0.5681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3566   -0.3455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5377    1.3771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7688   -1.1545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2287    2.3281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5377    1.3771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1756   -2.0681    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0377    2.9159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8467    2.3281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5878   -2.8771    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0377    3.9159    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.5878   -2.8771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8968   -3.8281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9037    4.4159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1717    4.4159    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.0680    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2788   -3.8281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0878   -4.4159    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  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
  8  9  2  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  2  11   1  15  -1
M  END