
     RDKit          3D

 57 60  0  0  0  0  0  0  0  0999 V2000
    5.1774   -2.0510   -1.3052 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8314   -1.3226   -2.2156 S   0  0  0  0  0  6  0  0  0  0  0  0
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    3.2025    0.0704   -1.3817 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6631   -0.2850   -0.0493 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6619    0.1770    1.0369 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4957    1.6494    1.4696 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3387    1.8146    0.2880 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1448    2.6246    0.2516 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0140    3.5729    1.0722 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9611    2.3730   -0.7342 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8833    1.4141   -0.2121 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1938    1.2010   -0.6813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8265    2.0817   -1.5810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1357    1.8402   -1.9973 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.1807   -0.1465   -0.6849 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9120    0.0681   -0.2413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2752   -0.9464    0.5467 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8883   -0.6847    1.9387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8078   -1.6724    2.4511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8018   -2.1972    1.3681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3409   -2.2379   -0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8580   -2.1837   -0.1075 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5082   -1.6389    1.4258 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5482   -0.2202    1.4273 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2548    0.3443    0.1744 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9645   -1.2884   -1.1331 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6051   -2.8930   -1.8878 H   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4605    0.4697   -2.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7009    0.0204    0.6754 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4955    2.1258    1.5663 H   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5134    3.4891    0.9190 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1642    2.5741   -0.4735 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.6241    2.5182   -2.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2579   -1.2202    3.3043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3477   -2.5504    2.8709 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2122   -2.2195   -1.1620 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4388    0.2560    1.4932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0981    0.1021    2.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6401    0.0937   -0.7118 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
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 28 29  1  0
 29  6  1  0
 29 10  1  0
 20 15  1  0
 26 21  1  0
  1 30  1  0
  1 31  1  0
  1 32  1  0
  5 33  1  0
  6 34  1  6
  7 35  1  0
  7 36  1  0
  8 37  1  0
  8 38  1  0
  9 39  1  0
  9 40  1  0
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 22 46  1  0
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 25 52  1  0
 26 53  1  0
 26 54  1  0
 28 55  1  0
 28 56  1  0
 29 57  1  0
M  END
$$$$
