B3P4BQ
  -OEChem-04042104573D

 20 20  0     0  0  0  0  0  0999 V2000
    2.7235   -0.3632    0.0423 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.1463   -0.4491   -1.5347 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7947    1.7211    0.0561 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5795    0.6409    0.6571 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6716   -1.7176    0.5703 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1011   -2.2833    0.5312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5065   -0.8705   -0.5621 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0876    0.2473    0.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0116   -0.6390   -0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2950   -0.1505   -0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8568    1.6220    0.0989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5256    1.2242    0.0519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4497    2.1105    0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4043   -1.0928   -0.0532 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1992   -1.7077   -0.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6792    2.3311    0.1313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6225    3.1825    0.1420 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1513    0.4103   -2.0184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4445    1.0007    0.0668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8531   -2.9119    0.4909 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  2  0  0  0  0
  1  5  2  0  0  0  0
  1  8  1  0  0  0  0
  2 18  1  0  0  0  0
  3 12  1  0  0  0  0
  3 19  1  0  0  0  0
  6 14  1  0  0  0  0
  6 20  1  0  0  0  0
  7 14  2  0  0  0  0
  8  9  2  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
  9 15  1  0  0  0  0
 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 11 13  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
 13 17  1  0  0  0  0
M  END

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