NCI:643759
BBtclserve11129920002D 0   0.00000     0.00000223538
999-99-9
 20 21  0  0  0  0  0  0  0  0  1 V2000
    6.7524    1.3559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1646    0.5469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1646    0.5469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5768    1.3559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9836    2.2694    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823    1.2514    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945    2.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.9558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8556   -0.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9045   -0.7132    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6646   -0.9920    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6646   -1.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7986   -2.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4736   -0.4042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7986   -3.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6646   -3.9920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5306   -3.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5306   -2.4920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3958    3.0784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8025    3.9920    0.0000 C   0  0  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  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  3  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  2 14  2  0  0  0  0
 13 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 12 18  2  0  0  0  0
  5 19  1  0  0  0  0
 19 20  1  0  0  0  0
 11 14  1  0  0  0  0
 17 18  1  0  0  0  0
M  END