YMQ0456
     RDKit          3D

 49 52  0  0  1  0  0  0  0  0999 V2000
   -8.2290    1.5413    1.6568 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.1612    0.5519    1.3830 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.9659    1.4881    1.0661 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.8344   -0.4455    0.4690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5945    0.4422    0.2055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7044   -0.8676   -0.7722 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8825   -2.8671   -1.8945 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5588   -0.5269   -0.0874 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.2310    0.3550   -0.3279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3809   -1.0302   -1.2056 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9574    0.1058   -1.4950 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7398   -2.0146   -1.9544 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3932    1.4721   -0.3616 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.5757    0.1373   -1.2085 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6646    1.3193   -1.0895 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.1889   -0.7175   -1.8622 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8297   -0.0309   -0.5633 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0758    1.3710   -0.7992 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1998    0.0408   -1.5679 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.6626    2.0031   -1.8289 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2105   -0.3240   -1.5710 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3395   -1.9876    0.2548 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1619   -0.7994   -0.2070 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.7636   -3.1106    1.1426 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1242   -4.2560    1.9686 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.6270   -0.6894    0.2480 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.1003   -0.7062    0.6913 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.0961    0.3909    1.3292 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3021    2.9469    1.7376 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.0411    2.0369    0.9030 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2164    2.4076    1.8343 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2263    1.2424    1.5889 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.7179    2.4851    1.3209 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7475   -4.2763   -2.2155 N   0  0  0  0  0  1  0  0  0  0  0  0
   -9.2511   -2.8038   -0.5009 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0302   -2.3710   -1.5581 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9931   -1.7421    0.1558 S   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1390   -1.1454   -0.9677 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6563   -2.0151    1.4193 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7107    0.5777   -2.2419 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6797    2.6594   -2.5427 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.8591   -1.0154   -0.5468 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5152   -0.7870    1.0608 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.0630    1.1755    0.0241 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4478    0.1749    1.4128 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0932    3.3776    2.0893 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5751    1.4941    1.4803 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.1366    2.5820    1.4542 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.9988    3.6420    2.4735 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  8  2  0
  4 37  1  0
  5  8  1  0
  5  9  1  0
  6  9  2  0
  6 10  1  0
  7 12  1  0
  7 34  1  0
  7 36  2  0
  9 13  1  0
 10 14  2  0
 10 36  1  0
 11 15  1  0
 11 38  1  0
 12 16  1  0
 13 18  2  0
 14 18  1  0
 14 19  1  0
 15 17  1  0
 15 20  1  0
 16 19  2  0
 16 21  1  0
 17 38  1  0
 20 41  1  0
 21 40  2  0
 21 42  1  0
 22 24  1  0
 22 42  1  0
 23 26  1  0
 23 42  1  0
 24 25  1  0
 26 27  1  0
 27 43  1  0
 28 43  1  0
 28 45  1  0
 28 47  2  0
 29 33  1  0
 29 46  1  0
 30 33  1  0
 30 44  2  0
 30 48  1  0
 31 32  1  0
 31 46  1  0
 32 45  1  0
 35 37  2  0
 37 38  1  0
 37 39  2  0
 49 48  1  0
M  RAD  8   1   2   2   2   3   2   6   2   8   2  11   3  12   3  13   2
M  RAD  8  15   2  17   3  18   2  19   2  20   3  22   3  23   3  24   3
M  RAD  8  25   2  26   3  27   3  29   3  31   3  32   3  33   3  34   3
M  RAD  4  41   2  43   2  48   2  49   2
M  END
$$$$
