YF00538
     RDKit          3D

 92101  0  0  1  0  0  0  0  0999 V2000
    7.1362   -1.3328    0.2571 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.9939   -0.8317    0.8672 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.1600   -2.6522   -0.1666 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.9931    2.2895    3.4321 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5779    0.2115    2.1104 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8679   -1.6463    1.0728 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0507   -3.4757    0.0306 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.7139   -1.1526    1.7105 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3787    3.5925    3.2285 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9647    2.7766   -9.1456 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8988   -3.0094    0.6493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5110    1.0309    7.1043 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.5968    2.7110   -7.7420 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5628    2.2529    1.6868 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3788    3.7261    2.0585 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.6764   -2.0317    1.8983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5394    3.1878    6.2321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0610    0.5776    5.9584 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8025   -3.3377    1.4362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5237   -0.7432    5.4877 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3774   -1.9380    2.4573 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1571    2.5073   -6.3239 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6241    2.1830   -4.8949 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1120    5.5946    5.2972 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0414    6.2569    4.2665 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3125    1.5120    4.9820 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5129   -3.9832    1.7101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7542   -2.0494    1.9080 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9857   -2.6713   -0.9577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9093    0.8394    3.8944 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.0745   -0.5964   -5.5480 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3776    1.4630   -6.0397 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4660    4.9863   -3.6588 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7839    4.8339   -2.0494 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8249    3.5602   -2.6747 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9654    1.7694   -3.5706 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.4758   -1.4685   -1.7819 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.4181   -1.2971    3.2072 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9243   -2.5294    0.4524 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9841   -5.1003    1.3487 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.7222   -3.3343    2.5040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7877   -1.6604   -1.8579 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6896   -2.6142   -1.8908 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.9845   -1.5208   -4.3229 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.6385    2.8502   -5.4160 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.7788    4.4599   -4.2866 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7279    3.8516   -2.2766 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.3953    3.2677   -2.5560 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.6955    0.4310   -3.4356 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6823   -1.3415   -2.4674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3645   -5.5280    1.3374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2028   -4.6479    1.9279 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0783   -2.4135   -3.2744 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.1243   -3.6717   -2.6806 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9180   -6.7378    0.5588 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4089   -4.9085   -2.6461 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.2484   -5.9388   -1.5302 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3138   -3.5736   -3.3880 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.5303   -5.0508    1.7234 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6823   -7.9248    1.4311 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5005   -6.7572    0.2833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4559   -9.1604    2.3448 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.7928    2.0323    4.3157 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3207    2.7360  -10.4565 N   0  0  0  0  0  1  0  0  0  0  0  0
    3.4196    1.5106    2.4342 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2502    2.3486    7.2633 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4702   -1.7722    6.1364 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8746   -3.8737    0.8519 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1355    4.9090    6.5000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2958   -3.8316   -1.5985 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2686   -3.5779   -2.9119 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2125    4.9855   -0.9076 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1824    4.7214   -2.8875 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1035    2.8213    5.0694 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6383   -3.0651    2.3137 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0216   -0.4772    4.1998 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4313   -0.2314   -2.2962 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9569   -2.2698   -3.0704 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8998    4.0217   -4.8546 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1283    2.8495   -2.4696 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5057   -2.5722    3.0630 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1821    5.4792   -3.1477 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.6161    2.4995   -2.4711 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.1844    0.2565   -6.5635 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4052    0.0241   -4.3622 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7715   -6.0568   -2.4225 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1679   -6.9746   -0.6466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2741   -5.9202    1.0643 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0344   -5.0079   -1.4233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0109   -7.5380   -0.5217 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0338    6.9931    3.3573 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.1193    7.7841    2.5938 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  6  1  0
  3  7  2  0
  4  9  1  0
  4 63  2  0
  4 65  1  0
  5  8  1  0
  5 65  1  0
  6  8  2  0
  6 11  1  0
  7 11  1  0
  8 16  1  0
  9 15  1  0
 10 13  1  0
 10 64  1  0
 11 68  2  0
 12 18  2  0
 12 66  1  0
 13 22  1  0
 14 15  1  0
 14 65  1  0
 16 19  2  0
 16 21  1  0
 17 66  2  0
 17 69  1  0
 17 74  1  0
 18 20  1  0
 18 26  1  0
 19 27  1  0
 19 68  1  0
 20 67  2  0
 20 76  1  0
 21 75  1  0
 22 23  1  0
 24 25  1  0
 24 69  1  0
 25 91  1  0
 26 30  1  0
 26 74  2  0
 27 40  2  0
 27 75  1  0
 28 38  1  0
 28 39  1  0
 29 39  1  0
 29 42  2  0
 29 70  1  0
 30 76  1  0
 31 44  1  0
 31 84  1  0
 32 45  1  0
 32 84  1  0
 33 46  1  0
 33 82  1  0
 34 47  1  0
 34 72  2  0
 34 82  1  0
 35 48  1  0
 35 73  2  0
 35 83  1  0
 36 23  1  0
 36 49  1  0
 36 83  1  0
 37 43  2  0
 37 50  1  0
 38 76  1  0
 40 51  1  0
 41 52  1  0
 41 75  1  0
 41 81  2  0
 42 78  1  0
 43 54  1  0
 44 78  1  0
 45 79  1  0
 46 79  1  0
 47 80  1  0
 48 80  1  0
 49 77  1  0
 49 85  2  0
 50 53  2  0
 50 77  1  0
 51 52  2  0
 51 55  1  0
 52 59  1  0
 53 58  1  0
 54 56  1  0
 54 58  2  0
 55 60  1  1
 55 61  1  0
 55 87  1  0
 56 86  1  0
 57 86  1  0
 57 87  1  0
 57 89  2  0
 59 88  1  0
 60 62  1  0
 61 88  1  0
 61 90  2  0
 70 71  2  0
 71 78  1  0
 91 92  1  0
M  RAD  8   1   2   2   2   3   2   5   3   7   2   9   3  10   3  12   2
M  RAD  8  13   3  14   3  15   3  21   3  22   3  23   3  24   3  25   3
M  RAD  8  28   3  30   3  31   3  32   3  33   3  36   2  37   2  38   3
M  RAD  8  39   3  40   2  42   2  43   2  44   3  45   3  46   3  47   3
M  RAD  8  48   3  53   2  56   3  58   2  59   3  60   3  62   2  64   3
M  RAD  5  77   2  82   2  83   2  91   3  92   2
M  END
$$$$
