B3SGE9
  -OEChem-04012117282D

 20 20  0     1  0  0  0  0  0999 V2000
    4.5032   -0.8242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4154    1.5236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0064    0.1237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4712   -1.5236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942   -0.2365    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.0032    0.7146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1064   -1.0455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122   -0.2365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0032    0.7146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7431    0.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -0.5455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6048   -0.6810    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7420   -1.5471    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6080   -1.4099    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3676    1.2162    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6142    0.6790    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4103   -0.4050    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1289   -1.2030    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5961   -0.0679    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  8  1  0  0  0  0
  2  6  2  0  0  0  0
  3 11  1  0  0  0  0
  3 20  1  0  0  0  0
  4 11  2  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  6  9  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  2  0  0  0  0
  8 11  1  0  0  0  0
  9 16  1  0  0  0  0
 10 12  2  0  0  0  0
 10 17  1  0  0  0  0
 12 18  1  0  0  0  0
 12 19  1  0  0  0  0
M  END

$$$$