NCI:652557
BBtclserve11129920052D 0   0.00000     0.00000227590
999-99-9
 20 22  0  0  0  0  0  0  0  0  2 V2000
    7.9307   -0.9337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8261    0.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9126    0.4676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1036   -0.1202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2081   -1.1147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1217   -1.5214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6036    1.4187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6036    1.4187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2946    0.4676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.5380    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691    0.7949    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6473    1.0028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    1.9539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3164    0.2597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9344    2.1618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2872    2.6970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3991   -1.7025    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    5.5036   -2.6970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3601   -0.1562    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.4855   -1.2958    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  1  6  2  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  4  9  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
  9 14  2  0  0  0  0
  8 15  2  0  0  0  0
 13 16  1  0  0  0  0
  5 17  1  0  0  0  0
 17 18  2  0  0  0  0
 11 19  1  0  0  0  0
 17 20  1  0  0  0  0
  5  6  1  0  0  0  0
  8  9  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  4  11   1  17   1  19  -1  20  -1
M  END