LBJ4D1
  -OEChem-05022322183D

 21 20  0     1  0  0  0  0  0999 V2000
   -0.6299    0.0079    1.1102 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4846    1.1532    1.0071 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0708   -0.5582   -0.6022 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0725    1.3447    0.1377 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7716   -1.6235   -0.4565 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5831    1.3127   -1.2825 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6418   -0.7013   -0.3143 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7599   -1.1414    0.8574 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2640    0.6742   -0.1030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7299   -0.6332   -0.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0019    0.1649   -0.1825 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0668   -0.7083   -1.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3751   -2.1568    0.7112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3373   -1.1499    1.7894 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2992   -1.3906   -1.2974 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4225   -2.5712   -0.5958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9651   -1.6769    0.0569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2726   -0.5605   -1.1613 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4082    0.8962   -2.1913 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0113    2.2326   -1.2778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8934   -0.0238   -0.6113 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 10  1  0  0  0  0
  2  9  2  0  0  0  0
  3 11  1  0  0  0  0
  3 21  1  0  0  0  0
  4 11  2  0  0  0  0
  5  7  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  9  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
M  END

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