NCI:622665
BBtclserve11129919402D 0   0.00000     0.00000212534
999-99-9
 20 22  0  0  0  0  0  0  0  0  2 V2000
    2.8660   -2.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.8257    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.3257    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -2.1347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2709   -1.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -0.5167    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9921    0.4344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9432    0.7434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9432    1.7434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9921    2.0524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4043    1.2434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4043    1.2434    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9043    2.1094    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.4043    2.9754    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    6.7522    2.3312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6477    3.3257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.3257    0.0000 N   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  2  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
 12 13  1  0  0  0  0
 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  2  0  0  0  0
 12 18  1  0  0  0  0
 18 19  1  0  0  0  0
  1 20  1  0  0  0  0
  5  6  1  0  0  0  0
  8  9  1  0  0  0  0
 13 14  1  0  0  0  0
M  CHG  2  16   1  17  -1
M  END