cxy0012
     RDKit          3D

 76 83  0  0  1  0  0  0  0  0999 V2000
    9.4807   -0.0589    0.0969 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4832    0.8401    3.2435 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2871    0.8406   -2.2398 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.6750   -1.8494   -3.5095 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.3863   -3.4728   -2.5027 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.9640    0.1952    1.9959 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.5232    0.8289    1.6504 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7556   -0.1581   -1.2437 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.5049    2.9662   -1.2593 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2893   -3.3800   -1.5602 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7267    0.5463    2.8011 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5480    0.2991    0.6638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7284   -0.6223   -2.2449 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1799   -0.4606   -3.1004 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.6423   -2.9498   -3.2483 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.0491   -1.1755   -0.7647 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.4504   -0.0934    2.4807 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7002    0.3631   -0.1817 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.8224    3.6335    0.0035 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.7920   -1.2538    1.9709 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.2453    1.8540   -0.2343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9947   -2.5289   -0.9304 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.9055    2.9807    0.6657 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.6641   -3.1647    0.4587 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.6264   -1.3202   -1.2532 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.7631   -3.7126   -0.5139 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1035   -2.4138    1.4935 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0071   -4.3463    0.0383 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.1001   -1.2576   -0.9051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1988   -6.3166    0.1918 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.1875   -3.7302   -0.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9287   -2.8197    2.1539 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.5998    1.2487   -1.2730 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8592   -4.8716    0.1742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8282   -2.4464   -0.4103 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8446   -0.1229   -1.0254 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8125   -4.7476    0.6635 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.2981   -3.9897    1.7180 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.7928    3.4294   -1.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2296   -4.7276    0.4248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2452   -2.3710   -0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2312   -0.1916   -0.6971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7289    1.1879   -0.6966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8838   -3.5161    0.2883 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.1814    3.9010   -0.5442 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5758    5.2008   -0.2623 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.8364    1.7234   -0.3779 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.2254    3.0689   -0.2793 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3642    2.0824    2.7451 C   0  0  0  0  0  1  0  0  0  0  0  0
  -12.5943    3.5920    0.1976 C   0  0  2  0  0  0  0  0  0  0  0  0
  -12.6491    5.1752    0.6080 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9537    2.8566    1.4196 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.1076    0.8689   -0.4363 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5893    0.9616    4.4769 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8852    3.4719   -2.1752 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6154   -2.2387   -1.7378 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.7735   -0.3880    2.7408 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7198    0.6965    0.8858 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3203   -1.1545   -3.2710 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2866    1.8151   -1.2553 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3030   -0.2765    1.4066 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.5929    1.5199    2.4776 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.9939   -0.3817   -0.2691 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0693   -4.3511   -0.8010 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7983    1.5680    3.4793 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0069   -0.3702   -1.9637 N   0  0  0  0  0  2  0  0  0  0  0  0
   15.2986    1.2291   -0.2008 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9104    4.2345   -1.2668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6691    2.0491   -1.0264 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9718   -5.7674    0.8975 F   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9736   -1.2713   -0.2781 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5684    5.9519    0.1711 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5195    3.4108   -0.7660 O   0  0  0  0  0  1  0  0  0  0  0  0
  -13.5496    5.7232    1.2845 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7556    3.2145    2.1091 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.0492    4.7398    2.7887 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 16  1  0
  1 53  2  0
  1 61  1  0
  2 17  1  0
  2 54  2  0
  2 62  1  0
  3 14  1  0
  3 60  1  0
  4 14  1  0
  4 15  1  0
  5 10  1  0
  5 15  1  0
  6 11  1  0
  6 61  1  0
  7 12  1  0
  7 62  1  0
  8 13  1  0
  8 18  1  0
  9 19  1  0
  9 55  2  0
  9 60  1  0
 10 56  1  0
 10 64  2  0
 11 57  1  0
 11 65  2  0
 12 58  1  0
 12 63  2  0
 13 59  2  0
 13 66  1  0
 16 56  1  0
 17 20  1  0
 17 57  1  0
 18 58  1  0
 19 23  1  0
 20 27  1  0
 21 23  1  0
 21 60  1  0
 21 67  2  0
 22 25  1  0
 22 26  1  0
 23 75  1  0
 24 27  2  0
 24 28  1  0
 25 29  1  0
 25 66  1  0
 26 31  1  0
 27 32  1  0
 28 37  2  0
 29 35  2  0
 29 36  1  0
 30 34  1  0
 31 34  2  0
 31 35  1  0
 32 38  2  0
 33 36  1  0
 33 69  1  0
 34 40  1  0
 35 41  1  0
 36 42  2  0
 37 38  1  0
 39 45  1  0
 39 68  2  0
 39 69  1  0
 40 44  2  0
 40 70  1  0
 41 44  1  0
 41 71  2  0
 42 43  1  0
 42 71  1  0
 43 47  2  0
 43 69  1  0
 45 46  1  0
 45 48  2  0
 46 72  1  0
 47 48  1  0
 48 50  1  0
 49 52  1  0
 50 51  1  0
 50 52  1  0
 50 73  1  6
 51 72  1  0
 51 74  2  0
 75 76  1  0
M  RAD  8   3   3   4   3   5   3   6   3   7   3   8   3  14   3  15   3
M  RAD  8  16   3  17   2  18   3  19   3  20   3  22   3  23   2  24   2
M  RAD  8  25   2  26   3  28   2  30   2  32   2  33   3  37   2  38   2
M  RAD  8  44   2  46   3  47   2  49   2  52   3  56   2  57   2  58   2
M  RAD  5  61   2  62   2  66   2  73   2  76   2
M  END
$$$$
