NCI:53264
BBtclserve11129917042D 0   0.00000     0.00000 45043
721-71-1
 16 16  0  0  0  0  0  0  0  0  2 V2000
    3.6310    4.0078    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.4970    4.5078    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.7649    4.5078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6310    3.0078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8219    2.4200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4400    2.4200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1310    1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1310    1.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5432    0.6599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9499   -0.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3621   -1.0626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7688   -1.9762    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1811   -2.7852    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5878   -3.6988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -4.5078    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -3.8033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  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  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
  7  8  2  0  0  0  0
M  CHG  2   1   1   2  -1
M  END