LJ2M7W
  -OEChem-05022321282D

 28 29  0     0  0  0  0  0  0999 V2000
    5.2152   -1.4832    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8580    1.8211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5044    1.2831    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7988   -2.4105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7988   -2.4105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7988   -0.6784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369   -1.1784    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7988   -0.6784    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030    0.3216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -1.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369   -0.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030   -1.6784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2152    0.1263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7988   -0.6784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5259    1.0768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2988   -1.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2988   -1.5444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8015    0.7965    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0044    0.7965    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3249    0.4042    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9264   -0.2861    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0044   -2.1534    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8015   -2.1534    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.4884    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1088   -0.1415    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0506    2.4105    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4188   -2.4105    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 11  1  0  0  0  0
  1 15  1  0  0  0  0
  2 16  1  0  0  0  0
  2 27  1  0  0  0  0
  3 16  2  0  0  0  0
  4 17  2  0  0  0  0
  5 18  1  0  0  0  0
  5 28  1  0  0  0  0
  6 18  2  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7 25  1  0  0  0  0
  8 15  1  0  0  0  0
  8 17  1  0  0  0  0
  8 26  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 12  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 11 13  1  0  0  0  0
 12 21  1  0  0  0  0
 12 22  1  0  0  0  0
 13 23  1  0  0  0  0
 13 24  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 17 18  1  0  0  0  0
M  END

$$$$