NCI:678532
BBtclserve11129920182D 0   0.00000     0.00000239694
51034-68-5
 19 20  0  0  0  0  0  0  0  0  2 V2000
    3.2733    1.4139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823    2.3649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5823    2.3649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8913    1.4139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823    0.8261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -0.1739    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483   -0.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483   -1.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -2.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2163   -1.6739    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2163   -0.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1701    3.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3502   -0.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945    3.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    3.0694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -3.1739    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8424    1.1048    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5855    1.7740    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.3287    2.4431    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  6 11  1  0  0  0  0
  3 12  1  0  0  0  0
 11 13  2  0  0  0  0
  2 14  1  0  0  0  0
 14 15  1  0  0  0  0
  9 16  2  0  0  0  0
  4 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  2  0  0  0  0
  4  5  1  0  0  0  0
 10 11  1  0  0  0  0
M  CHG  2  18   1  19  -1
M  END