BBW4R3
  -OEChem-04012115243D

 20 21  0     0  0  0  0  0  0999 V2000
    1.2974    1.7351   -0.2784 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.5107   -0.8079    0.1337 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9740    1.0157    0.2507 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7904    0.0114   -0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6409    0.1673   -0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7882   -0.2884    0.0569 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8741    1.0706   -0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3789   -1.2298   -0.2270 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9307   -1.2104    0.2122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6246    1.0931    0.2209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7641   -1.3496   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5100   -0.2070    0.0371 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7561    1.6881   -0.2572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7784   -2.1158   -0.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0828   -1.7827   -0.7082 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8561   -0.6705    0.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7476   -1.9161    1.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2700    2.0977    0.4246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2449   -2.3068   -0.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5939   -0.2471    0.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3 10  1  0  0  0  0
  3 12  2  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  4 10  2  0  0  0  0
  6  7  2  0  0  0  0
  6  9  1  0  0  0  0
  7 13  1  0  0  0  0
  8 11  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
M  END

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