BA39YM
  -OEChem-04022113543D

 31 32  0     0  0  0  0  0  0999 V2000
   -2.2517   -3.1065   -0.9685 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0043    1.2557   -0.4889 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3054    2.8797    0.5257 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8189   -0.5522   -0.3431 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2616    1.4970   -1.2992 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7896    0.3355   -0.4926 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0787    2.1820   -0.6234 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7924    0.5430    0.4544 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2749   -0.9450   -0.6942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1285    0.6868    0.1635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1246    1.7467    0.1019 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2806   -0.5301    1.2000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7629   -2.0182    0.0512 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7659   -1.8107    0.9983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3264    0.9327    0.7078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7009   -1.6210   -0.3309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3053   -0.1266    0.7607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0405   -1.3488    0.2772 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9602    1.1306   -2.2889 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0648    2.2240   -1.4698 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7516    3.0290   -1.2375 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3650    2.5501    0.3693 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1999    1.5365    0.6217 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948   -1.1212   -1.4300 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0611   -0.3685    1.9378 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3620   -3.0153   -0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1457   -2.6463    1.5788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8960   -0.6867   -0.7456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6070    1.8964    1.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2689    0.0951    1.2061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7790   -2.1414    0.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 16  2  0  0  0  0
  2  7  1  0  0  0  0
  2 11  1  0  0  0  0
  3 11  2  0  0  0  0
  4 10  1  0  0  0  0
  4 16  1  0  0  0  0
  4 28  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 19  1  0  0  0  0
  5 20  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 21  1  0  0  0  0
  7 22  1  0  0  0  0
  8 12  1  0  0  0  0
  8 23  1  0  0  0  0
  9 13  2  0  0  0  0
  9 24  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  2  0  0  0  0
 12 14  2  0  0  0  0
 12 25  1  0  0  0  0
 13 14  1  0  0  0  0
 13 26  1  0  0  0  0
 14 27  1  0  0  0  0
 15 17  1  0  0  0  0
 15 29  1  0  0  0  0
 16 18  1  0  0  0  0
 17 18  2  0  0  0  0
 17 30  1  0  0  0  0
 18 31  1  0  0  0  0
M  END

$$$$