B45AOL
  -OEChem-04042104523D

 28 29  0     0  0  0  0  0  0999 V2000
    5.8011   -1.5353   -0.1235 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.0324    2.5802    0.1523 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8345   -1.6496   -0.1047 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2154    0.6082    0.0197 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1315   -1.4778   -0.1051 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8109    0.5287    0.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1364    0.4013    0.0395 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6212    1.1442    0.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0469    1.3554    0.0736 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8462   -0.9556   -0.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8233    1.0678    0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6384    0.4383    0.0362 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3168   -0.7675   -0.0675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2257   -0.9436    0.3610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2572    1.1319   -0.3209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4690   -1.5748    0.3209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5005    0.5008   -0.3609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6063   -0.8526   -0.0399 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5640    2.2276    0.1486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8532    2.1514    0.1813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7445   -0.6076   -0.1409 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0880    1.1283    0.0479 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2084   -2.4892   -0.1691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3792   -1.5431    0.6801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1906    2.1864   -0.5748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5535   -2.6267    0.5781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3863    1.0630   -0.6418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5747   -1.3435   -0.0694 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  2  0  0  0  0
  2  9  2  0  0  0  0
  3 10  2  0  0  0  0
  4  9  1  0  0  0  0
  4 13  1  0  0  0  0
  4 22  1  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
  5 23  1  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 14  2  0  0  0  0
  7 15  1  0  0  0  0
  8 12  1  0  0  0  0
  8 19  1  0  0  0  0
 11 12  2  0  0  0  0
 11 20  1  0  0  0  0
 12 21  1  0  0  0  0
 14 16  1  0  0  0  0
 14 24  1  0  0  0  0
 15 17  2  0  0  0  0
 15 25  1  0  0  0  0
 16 18  2  0  0  0  0
 16 26  1  0  0  0  0
 17 18  1  0  0  0  0
 17 27  1  0  0  0  0
 18 28  1  0  0  0  0
M  END

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