NCI:310105
BBtclserve11129918562D 0   0.00000     0.00000170630
999-99-9
 18 20  0  0  0  0  0  0  0  0  1 V2000
    5.2158    1.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4727    0.4798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5772   -0.5148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4945    0.6877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6637   -0.9215    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.4432   -1.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0878    1.6012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945   -0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3092   -0.5148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4432   -2.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6810    2.5148    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.2829    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1753   -1.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3093   -2.5148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1753   -2.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1263   -0.7057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1263   -2.3238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7141   -1.5147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  4  8  2  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  3  0  0  0  0
  8 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  2  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
  5  8  1  0  0  0  0
 14 15  1  0  0  0  0
 17 18  1  0  0  0  0
M  END