NCI:85229
BBtclserve11129917172D 0   0.00000     0.00000 67258
999-99-9
 20 21  0  0  0  0  0  0  0  0  2 V2000
    6.7242    0.4290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7023    0.6369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4152   -0.5221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0113    1.5880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3715   -0.1062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0029   -1.3311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9895    1.7959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3422    2.3311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3496    0.1017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0624   -1.0573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.3311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4152   -2.1401    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -2.3311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.3311    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.6689    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
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 15 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 12 14  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  2  18   1  20  -1
M  END