NCI:56863
BBtclserve11129917072D 0   0.00000     0.00000 47699
7597-31-1
 12 12  0  0  0  0  0  0  0  0  2 V2000
    3.2321    1.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.2321    1.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7321    1.8660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2321    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2321    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.3660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.3660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.8660    0.0000 C   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  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  2   1   1   2  -1
M  END