
     RDKit          3D

 58 61  0  0  0  0  0  0  0  0999 V2000
    5.8832   -0.8277    0.6999 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5565   -2.1418    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9421   -1.8503   -1.6510 S   0  0  0  0  0  6  0  0  0  0  0  0
    6.0536   -1.2742   -2.4824 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4962   -3.1429   -2.2744 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6221   -0.7227   -1.6226 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4228   -0.9022   -0.8487 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0551   -2.1522   -0.3274 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8903   -2.2869    0.4284 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0471   -1.1936    0.6540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4020    0.0737    0.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5953    0.2029   -0.6082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3369    1.3077    0.4499 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0681    2.0361    1.5784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5962    3.1664    1.9653 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1628    3.8811    3.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6918    3.5989    1.2666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3294    4.6218    1.6393 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1222    2.9080    0.1327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4449    1.7665   -0.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9681    1.0890   -1.4066 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2213    0.6246   -2.5271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2314   -0.9083   -2.6315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6079   -1.5482   -2.3561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7638   -2.1111   -0.9247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1432   -1.0716    0.1097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3911   -0.4294   -0.0019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8237    0.4671    0.9794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3700    1.2765    0.8079 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.0334    0.7061    2.1043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8049    0.0606    2.2438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3382   -0.8063    1.2472 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0961   -1.4190    1.4373 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2857   -1.0361    1.7134 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9678   -0.2077    0.8033 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6465   -0.2640    0.1228 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7954   -2.6927    0.5920 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4727   -2.7662   -0.0588 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7732    0.1869   -2.1137 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6564   -3.0317   -0.5006 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6291   -3.2576    0.8310 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8884    1.1769   -0.9829 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9151    1.6796    2.1549 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8421    3.5461    3.5095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8898    3.7016    3.9926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0996    4.9720    2.9706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9940    3.2508   -0.4118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1815    1.0112   -2.5100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6984    1.0376   -3.4411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9274   -1.1653   -3.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4542   -1.3541   -1.9861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4310   -0.8464   -2.6098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7177   -2.4085   -3.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5792   -2.8670   -0.9428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8538   -2.6741   -0.6341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0361   -0.6357   -0.8469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3694    1.3921    2.8713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1972    0.2536    3.1188 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  2  0
  3  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  2  0
 17 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
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 12  7  1  0
 20 13  1  0
 32 26  1  0
 33 10  1  0
  1 34  1  0
  1 35  1  0
  1 36  1  0
  2 37  1  0
  2 38  1  0
  6 39  1  0
  8 40  1  0
  9 41  1  0
 12 42  1  0
 14 43  1  0
 16 44  1  0
 16 45  1  0
 16 46  1  0
 19 47  1  0
 22 48  1  0
 22 49  1  0
 23 50  1  0
 23 51  1  0
 24 52  1  0
 24 53  1  0
 25 54  1  0
 25 55  1  0
 27 56  1  0
 30 57  1  0
 31 58  1  0
M  END
$$$$
