NCI:171571
BBtclserve11129918052D 0   0.00000     0.00000126925
999-99-9
 18 19  0  0  0  0  0  0  0  0  2 V2000
    3.7601    0.9806    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.7601    0.9806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7601    0.9806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    1.9806    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601   -0.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9511    2.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5691    2.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8940   -0.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -0.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.2594    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2601    3.5194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2601    3.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8940   -1.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -1.5194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601   -2.0194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601   -3.0194    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8940   -3.5194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -3.5194    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 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
 16 18  1  0  0  0  0
 11 12  1  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  2  16   1  18  -1
M  END