NCI:166656
BBtclserve11129918012D 0   0.00000     0.00000122862
4888-40-8
 16 17  0  0  0  0  0  0  0  0  2 V2000
    4.0823    0.6113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483    1.1113    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2163    1.1113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823   -0.3887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483    2.1113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2733   -0.9765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8913   -0.9765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1393    2.6991    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7574    2.6991    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -1.9276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5823   -1.9276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4484    3.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4484    3.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945   -2.7366    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.4013   -3.6501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.6320    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 10 11  2  0  0  0  0
 12 13  2  0  0  0  0
M  CHG  2  14   1  16  -1
M  END