NCI:681445
BBtclserve11129920192D 0   0.00000     0.00000240770
999-99-9
 20 21  0  0  0  0  0  0  0  0  1 V2000
    4.7989    0.7051    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.1079    1.6561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8479    1.0141    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0861    1.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6399    1.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4899   -1.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0777   -1.0550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4899   -0.2460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.0550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878   -0.2460    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5388   -0.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5388   -1.5550    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878   -1.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0777   -1.0550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2788   -2.8151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3951    2.8151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7552    1.1209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6889    2.3012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3831    2.6614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7500    0.3960    0.0000 O   0  0  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
  3  5  1  0  0  0  0
  6  7  2  0  0  0  0
  1  8  1  0  0  0  0
  9 10  1  0  0  0  0
  8 11  2  0  0  0  0
  6 12  1  0  0  0  0
  9 13  2  0  0  0  0
  7 14  1  0  0  0  0
 13 15  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
  5 18  1  0  0  0  0
  5 19  1  0  0  0  0
  1 20  2  0  0  0  0
  7  8  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END