NCI:116847
BBtclserve11129917322D 0   0.00000     0.00000 89023
10439-50-6
 18 19  0  0  0  0  0  0  0  0  2 V2000
    6.7242    1.0085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0550    1.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4152    0.0574    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0029   -0.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.2484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0029   -0.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4152   -1.5606    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5029   -1.6176    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5029    0.1144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.2484    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    9.5029   -1.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.2516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.2484    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
  8 13  2  0  0  0  0
 10 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 15 17  2  0  0  0  0
 15 18  1  0  0  0  0
  6  9  1  0  0  0  0
 11 14  1  0  0  0  0
M  CHG  2  15   1  18  -1
M  END