NCI:34864
BBtclserve11129916552D 0   0.00000     0.00000 30446
6277-55-0
 19 20  0  0  0  0  0  0  0  0  2 V2000
    3.7321    1.8988    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5116    1.9920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7026    3.3933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1808    2.7352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6808    3.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1753    2.6307    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.1012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7631    3.4397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5820    1.7171    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.1012    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.1012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
 10 13  2  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
  8  9  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  2  12   1  15  -1
M  END