YF00086
     RDKit          3D

 99111  0  0  1  0  0  0  0  0999 V2000
  -17.2014    1.9982    4.4026 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.9420    1.4158    4.3558 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.1085    1.7441    3.3657 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.5886    0.5989    3.2858 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.7787    0.8973    2.2952 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8485    0.5466    1.3573 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5118    0.3450    2.2687 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8386    0.0853    0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1210   -0.5073    1.2092 C   0  0  0  0  0  2  0  0  0  0  0  0
  -17.8561   -0.1962   -1.0760 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.6323   -0.9295   -1.0487 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.2311    0.3195   -2.3308 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7882    0.0115   -1.0524 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.4662   -0.7248    0.1071 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9101    0.9896   -1.5492 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.2536   -3.5958   -1.9416 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8910   -1.8743   -1.0734 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5129   -1.7103   -0.1352 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4130   -3.5033   -0.7157 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.7403   -3.1466   -1.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2994   -2.3520   -1.8655 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8781    0.7303   -0.2138 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.4652    0.0111   -1.3916 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.1908    2.4801    0.3817 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2854    1.4803    2.0643 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7523   -0.4743    4.3843 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5143   -1.2108    3.6889 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4640   -1.6284    0.7657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3878    0.9535   -0.0074 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.0752   -1.3353   -2.2857 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.6246   -0.0207   -3.5428 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.6450   -2.8852   -0.5022 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.0375   -2.7134   -2.1612 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7595   -2.1275   -1.9879 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0090   -1.6533   -2.1680 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.4851   -2.8893   -1.5540 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5599    0.9939   -2.1499 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3687    2.3684   -1.1536 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1745    0.4384    2.3173 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.5473   -0.3799    3.3870 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6419   -1.6445    2.2086 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.7242    0.6143   -0.0637 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.7591    1.6910   -0.5450 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5823   -0.9160   -3.5077 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.0101    2.2539   -0.1312 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.3971    2.5141    0.2999 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9411   -1.6844   -1.1266 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.7559   -1.6529   -2.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3330   -1.3939   -2.6726 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0931   -0.7182   -2.3548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7638    0.7950    0.9523 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.6101   -0.3087   -2.2376 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9001    1.8065    0.6760 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5172    2.9357   -0.8450 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.0482    3.2222   -0.6037 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.0067   -1.0479   -1.9567 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7527   -1.1494   -3.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4171   -0.2989   -2.7084 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9310    0.2895   -2.2134 C   0  0  0  0  0  3  0  0  0  0  0  0
   17.5762    0.5923   -2.5799 C   0  0  0  0  0  1  0  0  0  0  0  0
    9.5159    1.2312   -0.0818 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.6021    0.4027    0.2695 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.6362    1.9011    2.2271 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.4131    0.2498    1.4092 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.5087    0.7719    0.2399 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.8830    1.1645    2.4088 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.3682    2.0088    0.3395 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.1251    1.2699    2.5190 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.2633    2.2040    2.5356 C   0  0  0  0  0  3  0  0  0  0  0  0
  -20.1486    0.6717    1.8083 N   0  0  0  0  0  0  0  0  0  0  0  0
  -20.9744    0.4448    0.7970 N   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2176   -0.0356   -0.1959 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3584   -4.8172   -2.0709 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5076   -4.3021   -1.2694 O   0  0  0  0  0  1  0  0  0  0  0  0
    5.5288   -2.9996   -0.6816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4793   -2.6807    0.1456 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8201   -1.2463    0.1261 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2332    1.9082   -0.5549 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.6439    1.9394   -2.3921 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7499   -0.5155    2.3334 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3684   -0.7667   -0.5084 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.6121   -2.0124   -3.3940 O   0  0  0  0  0  1  0  0  0  0  0  0
    2.2124    2.3717    1.7192 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9919   -0.7715    4.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4106   -0.3149    0.2352 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2587   -2.7884   -0.6746 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6932    3.3955    1.1067 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2300    0.1538   -2.6048 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7773    0.9238   -2.9687 O   0  0  0  0  0  1  0  0  0  0  0  0
   14.1769   -0.6415   -4.0962 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0851    1.4088   -1.3937 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0678    2.0639    0.9516 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8882    0.2140    1.4409 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9526    1.7632    3.0927 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7465    2.8013    1.3335 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6761    2.5831    3.7890 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7105    3.5423    3.7972 C   0  0  0  0  0  1  0  0  0  0  0  0
    8.9575    2.6690    3.4053 C   0  0  0  0  0  1  0  0  0  0  0  0
  -20.9097   -0.6585   -1.3358 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  4  1  0
  3  5  2  0
  4  7  2  0
  5  6  1  0
  5  7  1  0
  6  8  2  0
  6 70  1  0
  7  9  1  0
  8 10  1  0
  8 72  1  0
  9 77  1  0
 10 11  2  0
 10 12  1  0
 11 30  1  0
 12 31  2  0
 13 15  1  0
 13 85  1  0
 14 18  1  0
 14 42  1  0
 15 43  1  0
 16 33  1  0
 16 36  1  0
 16 73  2  0
 17 35  1  0
 17 75  2  0
 17 81  1  0
 18 77  1  0
 18 86  2  0
 19 32  1  0
 19 36  2  0
 20 33  1  0
 20 34  2  0
 20 74  1  0
 21 34  1  0
 21 35  1  0
 22 29  1  0
 22 43  1  0
 23 37  1  0
 23 81  1  0
 24 38  1  0
 24 83  1  0
 25 39  1  0
 25 83  1  0
 26 40  1  0
 26 84  1  0
 27 41  1  0
 27 84  1  0
 28 41  1  0
 28 76  2  0
 28 85  1  0
 29 45  1  0
 30 44  2  0
 31 44  1  0
 32 47  2  0
 33 49  2  0
 34 50  1  0
 35 52  1  0
 35 82  1  6
 36 48  1  0
 37 79  1  0
 38 79  1  0
 39 80  1  0
 40 80  1  0
 42 78  1  0
 43 53  1  0
 43 54  1  0
 45 55  1  0
 45 46  1  0
 46 78  1  0
 46 87  2  0
 47 56  1  0
 48 56  2  0
 48 57  1  0
 49 57  1  0
 49 58  1  0
 50 58  2  0
 50 59  1  0
 51 53  1  0
 51 85  1  0
 52 59  1  0
 54 55  1  0
 56 88  1  0
 57 90  2  0
 58 89  1  0
 59 91  1  0
 60 88  1  0
 61 62  1  0
 61 91  1  0
 62 64  1  0
 63 66  1  0
 63 92  1  0
 63 98  1  0
 64 66  1  0
 65 67  1  0
 66 94  1  0
 67 95  1  0
 68 69  1  0
 68 93  1  0
 68 94  1  0
 69 96  1  0
 69 95  1  0
 70 71  2  0
 71 72  1  0
 72 99  1  0
 77 11  1  0
 92 61  1  0
 93 64  1  0
 93 65  1  0
 96 97  1  0
M  RAD  8   1   2   2   2   3   2   4   2   9   3  12   2  13   3  14   3
M  RAD  8  15   3  19   2  21   3  22   3  23   3  24   3  25   3  26   3
M  RAD  8  27   3  29   3  30   2  31   2  32   2  37   3  38   3  39   3
M  RAD  8  40   3  41   3  42   3  44   2  45   2  47   2  51   3  52   3
M  RAD  8  53   3  54   3  55   3  59   2  60   2  61   2  62   3  63   2
M  RAD  8  64   2  65   3  66   2  67   3  68   2  69   2  74   2  78   2
M  RAD  6  81   2  82   2  89   2  97   2  98   2  99   2
M  END
$$$$
