cxy0322
     RDKit          3D

 52 57  0  0  1  0  0  0  0  0999 V2000
   10.8248    0.5051    2.1490 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8396    1.5854    4.7489 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.0600   -0.4726    1.0822 C   0  0  0  0  0  2  0  0  0  0  0  0
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   10.3253    1.0745    3.4813 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.8320    1.6393    2.4248 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5849   -0.7135    1.4759 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3542   -0.6498    0.9002 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6517   -0.3606   -1.2494 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.1979   -1.0766    0.8870 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4208   -1.3003   -0.5679 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.9942   -0.4676    0.6839 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9848    2.3486    0.0216 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.1137    0.1611    0.0468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6783   -1.8863   -0.1371 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1004    1.5400   -0.2572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9881    3.7027   -0.2819 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2533   -0.5367   -0.2659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7406   -3.2744   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1122    4.2632   -0.8687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2539    2.1284   -0.8606 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3309    0.1385   -0.8470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3870   -0.8635   -1.0356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2272    3.4816   -1.1504 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.1200   -3.0611   -1.2597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0921   -4.0381   -1.4900 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5850   -0.8381   -1.5122 C   0  0  0  0  0  3  0  0  0  0  0  0
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   -9.9861   -1.6995   -2.2635 C   0  0  2  0  0  0  0  0  0  0  0  0
  -10.8222   -3.0733   -2.5377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8943   -1.0114   -3.5779 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.7505   -0.3409   -4.9842 C   0  0  0  0  0  1  0  0  0  0  0  0
   10.6948    1.8379    5.5890 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2909    1.3886   -0.6329 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9827    1.7050    0.9629 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3232   -0.9680    1.8236 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6062   -0.1050   -0.1777 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5212    1.7032    4.9265 N   0  0  0  0  0  2  0  0  0  0  0  0
   11.2840   -0.0213    0.9806 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6657   -0.2841    0.5801 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8313   -1.0370    1.3835 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.7435   -1.7021    1.7860 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8154    4.5205    0.0240 N   0  0  0  0  0  1  0  0  0  0  0  0
   -6.3837   -4.4006   -0.3190 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9381   -2.1219   -0.5863 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1462    5.5719   -1.1667 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3722    1.4435   -1.1582 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2854   -4.2422   -2.0106 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6909   -0.9706   -1.4025 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.8744   -3.1380   -3.1834 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4665   -2.1903   -1.2557 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  6  1  0
  1 40  1  0
  2  6  1  0
  2 34  2  0
  2 39  1  0
  3  7  1  0
  3 39  1  0
  4  8  1  0
  4 41  1  0
  5 10  1  0
  5 35  2  0
  5 40  1  0
  7 36  1  0
  8 37  1  0
  9 37  1  0
  9 38  2  0
  9 42  1  0
 10 12  1  0
 11 12  1  0
 11 40  1  0
 11 43  2  0
 13 15  1  0
 13 42  1  0
 14 17  2  0
 14 18  1  0
 15 17  1  0
 15 19  2  0
 16 19  1  0
 16 46  1  0
 17 22  1  0
 18 21  2  0
 18 44  1  0
 19 23  1  0
 20 26  1  0
 20 45  2  0
 20 46  1  0
 21 25  1  0
 21 47  1  0
 22 25  2  0
 22 48  1  0
 23 24  1  0
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 24 28  2  0
 24 46  1  0
 26 27  1  0
 26 29  2  0
 27 49  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 30 32  1  0
 30 50  1  1
 31 49  1  0
 31 51  2  0
 32 33  1  0
 36 41  1  0
 52 12  1  0
M  RAD  8   1   3   3   3   4   3   6   3   7   3   8   3  10   3  12   2
M  RAD  8  13   3  14   2  16   3  25   2  27   3  28   2  32   3  33   2
M  RAD  5  39   2  42   2  44   3  50   2  52   2
M  END
$$$$
