
     RDKit          3D

 59 62  0  0  0  0  0  0  0  0999 V2000
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    4.3874   -0.5833   -2.1073 S   0  0  0  0  0  6  0  0  0  0  0  0
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    4.4443   -0.0615   -3.5141 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8106    0.6825   -1.0595 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3377    0.1439    0.2323 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6637    1.1252    1.3920 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8256    2.4107    1.3242 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0751    1.1600    0.1706 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4236    1.6294   -1.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9991    1.4997   -2.1402 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.8578    1.1997   -0.4945 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2181    1.0753   -0.8297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9174    2.1246   -1.4578 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.9224    0.7763   -1.5431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6093    0.5912   -1.9930 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1441   -2.7978    0.2565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0010   -1.8355   -0.5782 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8091   -0.1200    0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7015   -0.2099   -1.6312 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9913   -1.5003   -0.5823 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3994   -1.8595   -2.3060 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6236    1.3235   -0.9169 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7569    3.0269    1.1606 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3914    0.1305    1.6888 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3682   -2.3751   -1.4782 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7733   -0.8339    2.2279 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5898   -0.6415   -0.8127 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
 18 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 25 28  1  0
 28 29  1  0
 29 30  1  0
 30  6  1  0
 30 10  1  0
 21 15  1  0
 27 22  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  5 34  1  0
  6 35  1  1
  7 36  1  0
  7 37  1  0
  8 38  1  0
  8 39  1  0
  9 40  1  0
  9 41  1  0
 13 42  1  0
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 16 44  1  0
 17 45  1  0
 20 46  1  0
 22 47  1  0
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 26 54  1  0
 27 55  1  0
 27 56  1  0
 29 57  1  0
 29 58  1  0
 30 59  1  0
M  END
$$$$
