L1QSW0
  -OEChem-05022323223D

 52 54  0     1  0  0  0  0  0999 V2000
   -5.2013    1.6356    0.9341 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.7385   -3.4914    0.7253 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3860    1.7894    2.3712 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9216    2.8080    0.1162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2675    1.3427   -1.9859 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4958   -1.7458   -0.1611 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1546   -2.0654   -0.1396 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1114   -1.1266   -0.2372 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5660    0.8254    0.2852 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7946   -2.3882   -0.0558 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8970   -1.3810    0.1916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0545   -3.2503   -1.2895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1894   -0.4161   -0.7722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6208   -1.4183    1.3834 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9297    0.4744    0.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9089   -1.5605    0.0927 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7160   -2.3326    0.2385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2057    0.5116   -0.5442 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0615   -0.1969    0.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4377    0.0127   -0.0585 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1178    1.2770   -0.0917 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5140   -3.4571   -0.2831 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4450    2.4189   -0.5264 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4507    1.3634    0.3101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9267    0.8114   -1.0994 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1051    3.6474   -0.5593 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1108    2.5917    0.2773 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4380    3.7338   -0.1575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2080    0.0773   -1.3742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7446   -3.0699    0.8029 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5295   -0.8226   -0.5845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0320   -2.6623   -2.2139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2904   -4.0298   -1.3870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0312   -3.7426   -1.2272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6350   -0.3686   -1.7055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4058   -2.1646    2.1435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4169    1.2515   -1.3109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1927   -0.5413    2.5436 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2852    0.5341    0.3316 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8272   -3.9294   -0.9897 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5347   -3.5298   -0.6687 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4547   -3.9307    0.6997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1978    0.3727    0.9585 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4097    2.3825   -0.8560 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9995    0.4931    0.6618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5822    4.5363   -0.9000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1481    2.6599    0.5919 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9520    4.6901   -0.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0307    0.5577   -0.8380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1135   -0.9630   -1.0517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4226    0.0981   -2.4462 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  9  1  0  0  0  0
  1 15  1  0  0  0  0
  2 17  2  0  0  0  0
  5 26  2  0  0  0  0
  6 10  1  0  0  0  0
  6 17  1  0  0  0  0
  6 32  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  7 23  1  0  0  0  0
  8 21  2  0  0  0  0
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  9 44  1  0  0  0  0
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 10 31  1  0  0  0  0
 11 13  2  0  0  0  0
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 12 33  1  0  0  0  0
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 18 38  1  0  0  0  0
 19 39  1  0  0  0  0
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 21 22  1  0  0  0  0
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 26 30  1  0  0  0  0
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 30 51  1  0  0  0  0
 30 52  1  0  0  0  0
M  END

$$$$