YF00536
     RDKit          3D

 85 93  0  0  1  0  0  0  0  0999 V2000
  -13.7325    7.2506   -0.1704 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.0487    6.2456   -1.0778 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.1405    6.9174    1.0429 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.7784    4.9110   -0.7722 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8833    5.5834    1.3606 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.1178    3.9180   -1.6963 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.8284   -5.4235   -2.9914 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.1843    4.5569    0.4777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0215   -4.1899   -2.6694 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.8214    2.6307   -1.3412 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2306    2.3659   -0.1059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8174   -2.9162   -2.3459 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.0706    1.3713   -1.9367 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.5446   -1.5923   -2.0321 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.1277    0.9047   -0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5129    6.8420    0.9478 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.9337    5.4393    1.4338 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6948    0.6725    1.7991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1334   -0.3095   -1.7839 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.6176   -3.4076   -1.6295 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.3253    0.6857    0.1488 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7358    0.0006    0.0698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9473   -1.0896   -0.8234 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.7458    0.0829    0.9002 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.8456   -1.0760   -1.3007 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7420   -1.9253   -2.0495 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6842    0.0154   -1.1889 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.4989    1.1327    1.0878 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.4464    0.8509    0.2774 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1038    0.2142   -2.7728 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.1468    0.0898   -1.5564 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8185   -1.4820    0.1944 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.7565   -1.3304    0.9540 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2808   -1.8937   -0.1603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9224   -0.6991    0.4835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2731    0.8552   -1.2247 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.8861   -1.1040    1.4556 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.9741   -1.9392    1.7686 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2727   -2.2110    2.1207 C   0  0  1  0  0  0  0  0  0  0  0  0
  -13.2791   -3.2856   -0.0334 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.1510    0.4760   -0.2170 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.2736   -2.0088    3.2063 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.2920   -3.8153    1.8977 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3708   -1.7809    4.2773 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.6493   -6.5838   -3.3254 N   0  0  0  0  0  1  0  0  0  0  0  0
  -12.9311    3.2795    0.8255 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.4485    3.9233    1.9756 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5729   -0.1229    2.7290 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8158   -1.0028    0.7838 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6868    0.3176   -1.1695 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4267    0.4598   -2.6373 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.9233   -0.6318   -2.3264 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4821    1.6838    0.4181 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4365   -1.6240   -2.2282 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500    1.2447    1.4225 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6172    0.5091   -0.8092 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8713   -1.3773    2.3125 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0142   -1.7547    2.6264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6810    0.4235   -3.9476 O   0  0  0  0  0  1  0  0  0  0  0  0
  -12.9303   -4.2768    0.7626 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0969   -2.4754    0.6757 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8324   -4.6010    2.7283 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1533    8.2717    0.4888 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.8218    9.7120    0.0467 C   0  0  0  0  0  1  0  0  0  0  0  0
   18.5761    1.9971   -0.9222 C   0  0  0  0  0  3  0  0  0  0  0  0
   19.2504    2.9578    1.0831 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5646    1.3801   -0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5430    0.3964   -0.6494 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4628    1.6147    1.0843 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6553   -1.6572    1.0201 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.3548   -3.4925    1.1607 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3887    0.8383    1.5823 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.8328   -0.6955    0.8003 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.4764   -2.6289    1.1452 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.7709   -4.7501   -0.4871 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.1029   -3.2185    0.6853 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.1263   -4.6783    0.2399 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.4363    2.8000   -0.2542 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.4049   -0.0501   -1.7689 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4450   -4.7919    1.5671 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.2732    2.3823    1.8101 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8701    0.1299    0.5525 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4481   -4.4227    0.8074 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6405   -4.6585   -1.1809 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2601   -5.3600    1.3476 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  4  1  0
  3  5  2  0
  4  6  2  0
  4  8  1  0
  5  8  1  0
  6 10  1  0
  7  9  1  0
  7 45  1  0
  8 46  2  0
  9 12  1  0
 10 11  2  0
 10 13  1  0
 11 15  1  0
 11 46  1  0
 12 14  1  0
 13 50  1  0
 15 24  2  0
 15 50  1  0
 16 17  1  0
 16 63  1  0
 17 47  1  0
 18 28  1  0
 18 48  2  0
 18 55  1  0
 19 14  1  0
 19 30  1  0
 19 56  1  0
 20 26  1  0
 21 27  1  0
 21 55  1  0
 22 29  1  0
 22 49  2  0
 22 56  1  0
 23 31  2  0
 23 32  1  0
 24 33  1  0
 25 34  1  0
 25 50  1  0
 25 54  2  0
 26 52  1  0
 27 52  1  0
 28 53  1  0
 29 53  1  0
 30 51  1  0
 30 59  1  0
 31 36  1  0
 31 51  1  0
 32 35  2  0
 33 34  2  0
 33 39  1  0
 34 40  1  0
 35 37  1  0
 35 41  1  0
 36 41  2  0
 37 57  1  0
 38 57  1  0
 38 58  1  0
 38 61  2  0
 39 42  1  1
 39 43  1  0
 39 58  1  0
 40 60  1  0
 42 44  1  0
 43 60  1  0
 43 62  2  0
 63 64  1  0
 65 67  2  0
 65 78  1  0
 66 78  2  0
 66 81  1  0
 66 47  1  0
 67 68  1  0
 67 69  1  0
 68 79  2  0
 68 82  1  0
 69 72  1  0
 69 81  2  0
 70 73  1  0
 70 74  1  0
 71 74  1  0
 71 76  2  0
 71 80  1  0
 72 82  1  0
 73 82  1  0
 75 77  1  0
 75 84  1  0
 76 83  1  0
 77 83  1  0
 80 85  2  0
 84 20  1  0
 85 83  1  0
M  RAD  8   1   2   2   2   3   2   5   2   6   2   7   3   9   3  12   3
M  RAD  8  13   3  14   3  16   3  17   3  19   2  20   3  21   3  23   2
M  RAD  8  24   2  26   3  27   3  28   3  29   3  30   2  32   2  36   2
M  RAD  8  37   3  40   3  41   2  42   3  44   2  45   3  51   2  55   2
M  RAD  8  56   2  59   2  63   3  64   2  65   2  70   3  72   3  73   3
M  RAD  4  74   3  75   3  76   2  77   3
M  END
$$$$
