NCI:692414
BBtclserve11129920262D 0   0.00000     0.00000245600
999-99-9
 20 21  0  0  0  0  0  0  0  0  2 V2000
    2.0000   -2.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -0.9891    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2709   -1.7982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -2.6072    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.9921   -0.0381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3230    0.7051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6320    1.6561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6101    1.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2793    1.1209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9703    0.1698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9192    2.8151    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.8973    3.0230    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2500    3.5582    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.4921   -3.1950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3741   -3.5582    0.0000 I   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
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  5  9  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 10 15  2  0  0  0  0
 13 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
  9 19  1  0  0  0  0
  5  6  1  0  0  0  0
  8  9  2  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  4   9   1  16   1  18  -1  20  -1
M  END