YF00356
     RDKit          3D

118123  0  0  1  0  0  0  0  0999 V2000
    7.6814   -2.3708    4.5603 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5746   -1.6386    5.0215 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.4896   -1.6104    3.7003 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.3728   -0.2591    4.7346 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.2234   -0.2536    3.3994 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.1743    0.5046    3.9164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3258    0.0612   -7.5177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2338   -0.8309   -5.5968 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.5863    1.5616    3.1681 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.2486    3.0867    1.3908 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3996    1.3674   -7.6270 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.6078   -2.8161   -1.2353 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.2727    2.7583    2.4581 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.4923   -1.2389   -4.5327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1297   -3.7150    0.7530 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7412   -1.6960   -2.2057 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4379   -2.3040    5.0818 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4436   -4.0205    2.2833 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7633   -0.8146    6.0234 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3357    1.5416   -6.1474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3896    2.2774   -6.9042 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8323   -3.4394    4.1943 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8231    2.9988    3.6581 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5997    4.1979    2.4402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8011    0.2858    5.7761 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3387    4.0147    1.7303 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3847    2.1429    4.7449 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4797    6.6370    1.0487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1848    6.8752    1.0550 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1125    5.4665    1.5497 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.5569    5.7505    1.3369 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1775    3.6685    2.6986 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.4719    2.1413    3.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3222    6.4728    0.7021 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3819    4.4530    1.8286 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0160    0.8279    5.2855 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.8692   -1.8776    6.0340 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8833    1.4996    4.6451 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.9051   -3.8314    5.3823 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9372   -0.2563    5.9871 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4183    1.2226    4.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9659   -3.4450   -6.0192 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.7155   -5.3297    0.6957 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.6666    0.4423    3.0922 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5547   -0.8151    1.9508 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7048   -3.8581   -3.3599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5807   -1.5314    1.8091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7276   -5.6505   -5.9097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2565   -3.7222    0.6141 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1002   -4.7008   -4.8921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0721   -1.3029    1.9660 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6292   -2.8300   -2.8220 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3759   -6.5342   -5.7866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6341   -3.4183   -0.6951 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3213   -2.0267   -1.9232 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.1613   -4.6116   -3.8421 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.5270   -3.2254    1.5669 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.3063   -6.3615   -4.8070 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.0594   -5.3238   -3.8318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5386   -0.5592   -2.2281 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3387    0.1851   -2.4435 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.2571    2.6038   -2.0990 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.0058   -0.0817   -1.8437 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9432    1.5051   -2.2130 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.3172   -3.5281   -3.8822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6351    2.0042   -1.8481 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.1036   -2.2776   -3.5665 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.3973    1.5465   -2.3429 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.9144   -0.8123   -3.3930 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.3280    2.8650   -0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9110    1.9365   -2.0025 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5026    0.1809   -2.8893 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.9237    0.9038   -1.7754 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.5148   -0.2803   -0.3615 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.9554   -3.6624    4.8555 O   0  0  0  0  0  1  0  0  0  0  0  0
    0.1788   -0.9439   -8.0314 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3927    3.5261    1.8376 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2711   -1.1494   -3.4168 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2798    0.1564   -6.5439 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1228    2.5496    0.2081 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3379   -4.4933    3.5169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0669    7.5568    0.4483 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6348   -3.9818   -0.5090 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8212    5.0485    1.5602 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2623    1.6195    2.2313 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4624    3.5146    3.2106 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8938    0.9647    5.3086 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6101   -1.7816   -4.7539 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5442   -1.4380    6.0994 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2740    2.0766   -5.4358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1921    2.8427    2.4365 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3759    6.8456    1.8398 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.6972   -3.3566    4.2948 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5327    3.0230    3.7240 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.4170   -3.1280    6.4811 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.4091   -5.1742    5.7072 N   0  0  0  0  0  1  0  0  0  0  0  0
   -0.2682    0.8250    4.8886 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2734    1.9928    4.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2992   -0.6515    2.3126 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9028   -6.2204   -7.1464 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8514   -4.9018   -2.7501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2008   -3.8443   -4.7219 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1891    0.0323    1.5764 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4399   -7.5869   -6.6360 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6255   -2.5499   -0.6435 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0898   -2.7324    1.2565 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9883   -3.9511   -1.7405 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1886    0.0625   -3.4994 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6989   -3.6018   -5.3918 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.5531    2.5469   -0.5291 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3490    3.4698    1.0485 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8064    2.6540   -0.7660 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.2892    2.8370   -2.9506 O   0  0  0  0  0  1  0  0  0  0  0  0
    2.2022    0.3887   -0.4680 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7188   -7.8391   -7.1520 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.2622   -4.4664   -3.5613 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0760    1.3244   -7.5565 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5126    2.9287   -8.2709 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  1 75  1  0
  2  4  1  0
  3  5  2  0
  4  6  2  0
  5  6  1  0
  6  9  1  0
  7 11  1  0
  7 76  2  0
  7 79  1  0
  8 14  1  0
  8 79  1  0
 10 13  1  0
 10 77  2  0
 10 80  1  0
 11 21  1  0
 11117  1  0
 12 16  1  0
 12 83  1  0
 13  9  1  0
 13 86  1  0
 14 78  1  0
 14 88  2  0
 15 18  1  0
 15 83  1  0
 16 78  1  0
 17 22  1  0
 17 89  1  0
 18 81  1  0
 19 25  1  0
 19 89  1  0
 20 21  1  0
 20 79  1  0
 20 90  2  0
 22 81  1  0
 23 27  1  0
 23 91  1  0
 24 32  1  0
 24 84  2  0
 24 86  1  0
 25 87  1  0
 26 30  1  0
 26 91  1  0
 27 87  1  0
 28 30  1  0
 28 82  2  0
 28 92  1  0
 29 34  1  0
 29 92  1  0
 31 34  1  0
 31 35  1  0
 32 35  1  0
 32 94  1  0
 33 38  1  0
 33 85  2  0
 33 94  1  0
 36 40  1  0
 37 40  1  0
 37 95  1  0
 38 36  1  0
 38 97  1  0
 39 93  2  0
 39 95  1  0
 39 96  1  0
 41 44  1  0
 41 97  1  0
 41 98  2  0
 42102  1  0
 44103  1  0
 45 51  1  0
 45103  1  0
 46101  2  0
 46102  1  0
 46 52  1  0
 47 51  1  0
 47 99  2  0
 47106  1  0
 48 50  2  0
 48 53  1  0
 48100  1  0
 49 43  1  0
 49 54  1  0
 49106  1  0
 50 56  1  0
 50102  1  0
 52 55  1  0
 53 58  2  0
 53104  1  0
 54105  1  0
 54107  2  0
 55 60  1  0
 55105  1  0
 56 59  2  0
 57106  1  0
 58 59  1  0
 60 61  1  0
 60 63  1  1
 60108  1  0
 61 64  1  0
 61108  1  0
 64 62  1  0
 64 66  1  0
 65 67  2  0
 65109  1  0
 65116  1  0
 66 68  1  0
 66110  1  0
 67 69  1  0
 68 71  1  0
 69 72  2  0
 70111  2  0
 70112  1  0
 70110  1  0
 71112  1  0
 71113  1  6
 71 73  1  0
 72 73  1  0
 73114  1  0
 74114  1  0
104115  1  0
116 59  1  0
117118  1  0
M  RAD  8   2   2   3   2   4   2   5   2   8   3   9   3  11   2  12   3
M  RAD  8  13   2  15   3  16   3  17   3  18   3  19   3  21   3  22   3
M  RAD  8  23   3  25   3  26   3  27   3  29   3  30   3  31   3  32   2
M  RAD  8  34   3  35   3  36   3  37   3  38   2  40   3  42   2  43   2
M  RAD  8  44   3  45   3  49   2  51   3  52   3  55   2  56   2  57   2
M  RAD  8  58   2  61   2  62   2  63   2  64   2  66   2  67   2  68   3
M  RAD  8  69   2  72   2  73   2  74   2  75   2  78   2  80   2  86   2
M  RAD  8  92   2  94   2  95   2  96   3  97   2 109   2 112   2 113   2
M  RAD  3 115   2 116   3 118   2
M  END
$$$$
