NCI:621266
BBtclserve11129919392D 0   0.00000     0.00000211695
999-99-9
 19 21  0  0  0  0  0  0  0  0  1 V2000
    3.2872    3.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090    3.0350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.0839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6691    1.3408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6473    1.5487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    2.4997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9563    2.4997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2653    1.5487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4563    0.9609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5608   -0.0336    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.4744   -0.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2834    0.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1789    1.1419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9879    1.7297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5789   -1.4349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7699   -2.0227    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925   -1.8416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5970   -2.8361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5105   -3.2429    0.0000 C   0  0  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
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 11 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  5  6  1  0  0  0  0
  8  9  2  0  0  0  0
 12 13  1  0  0  0  0
M  END