BJX98W
  -OEChem-04012116352D

 21 22  0     0  0  0  0  0  0999 V2000
    3.2601    3.3294    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.2601    3.3294    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    2.0694    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -2.7094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8940   -2.7094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    0.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    1.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261    0.2906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8940    0.2906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601   -1.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -0.7094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8940   -0.7094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9511    2.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5691    2.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601   -2.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1630    0.6006    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3571    0.6006    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1630   -1.0194    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3571   -1.0194    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1588    2.1868    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6261   -3.3294    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3 13  2  0  0  0  0
  4 15  1  0  0  0  0
  4 21  1  0  0  0  0
  5 15  2  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  2  0  0  0  0
  8 11  1  0  0  0  0
  8 16  1  0  0  0  0
  9 12  2  0  0  0  0
  9 17  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 10 15  1  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
 14 20  1  0  0  0  0
M  END

$$$$