NCI:85327
BBtclserve11129917172D 0   0.00000     0.00000 67356
999-99-9
 20 21  0  0  0  0  0  0  0  0  2 V2000
    4.6261    1.3548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3693    2.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6751    1.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3203    1.7149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1614    3.0021    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.0761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660    2.6149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0635    2.3841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0570    1.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.0761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9538    3.4239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    2.6149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.4239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.4239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.4239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.4239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.9239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.9239    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.4239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.4239    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  2  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  6  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
 10 13  2  0  0  0  0
 10 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
  9 12  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  2  18   1  20  -1
M  END