BL6S3Z
  -OEChem-04022114033D

 20 19  0     1  0  0  0  0  0999 V2000
    0.2590   -1.7064   -1.2373 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6082   -1.7094    1.0037 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7997   -0.7181    0.2652 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.8144    1.2654   -0.6941 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3206    0.4091    0.0582 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1140    0.4053   -0.1022 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3678    1.1660    0.3717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0822    0.7685    0.7756 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3612   -1.0980   -0.0283 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5802    0.8452   -0.4572 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7265    0.3726    0.0447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0820    0.6755   -1.1491 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5605    0.9450    1.4297 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1852    2.2455    0.3021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0907    0.2427    1.7363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1361    1.8457    0.9693 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5166    1.0291   -1.5265 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5690    0.1693   -0.6073 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8450    0.1800    1.1052 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4118   -2.6733   -1.1742 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 20  1  0  0  0  0
  2  9  2  0  0  0  0
  3  5  1  0  0  0  0
  4  5  2  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 12  1  0  0  0  0
  7 10  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 15  1  0  0  0  0
  8 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
M  CHG  2   3  -1   5   1
M  END

$$$$