YMQLIN0078
     RDKit          3D

 45 46  0  0  1  0  0  0  0  0999 V2000
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   -5.9226   -0.6603    5.2470 C   0  0  0  0  0  2  0  0  0  0  0  0
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   -6.6702   -1.9585    5.6208 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9804    0.8485    6.9269 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6917    0.4998    3.6033 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1484    0.4120    2.1683 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6309    0.3384    0.7243 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1361    0.2767   -0.7299 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4377   -0.0346   -1.4717 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.1383    0.7642   -4.9331 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.8932    0.0607    0.5595 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2174   -0.8458   -0.6993 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.0303   -1.3966   -1.3314 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6703    0.0242    2.1103 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.6540   -1.8066   -2.9744 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.5245    1.2370   -4.9861 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6507    0.9431    2.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3136    1.0588   -2.8958 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.1608   -3.3030   -2.7704 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.3334   -1.5780   -4.3942 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.7550    1.4624   -5.7047 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.5108    1.2742   -3.5963 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.1159    1.4525    3.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9869    2.1435    2.7222 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.2357    0.5990    4.9547 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4141    0.5896   -0.4057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9497   -0.6414   -1.1501 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9954    0.6055   -2.7436 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4023   -0.0521   -2.4132 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.9749    1.6871   -6.3924 O   0  0  0  0  0  1  0  0  0  0  0  0
   12.9104    0.2426    2.5879 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1770   -2.4728   -1.8993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4123    0.2676   -4.4170 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7557    1.7902    3.7844 S   0  0  0  0  0  1  0  0  0  0  0  0
   12.2044    2.4318    3.2214 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.3545    0.6714    1.6204 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2724    0.4211    1.1602 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0
  2  5  1  0
  2 33  1  0
  3  6  1  0
  3 33  1  0
  4  6  1  0
  7  8  1  0
  7 33  1  0
  8  9  1  0
  9 10  1  0
 11 34  2  0
 11 37  1  0
 12 10  1  0
 12 18  1  0
 12 37  1  0
 13 19  2  0
 13 20  1  0
 14 21  1  0
 15 16  1  0
 15 21  1  0
 16 35  1  0
 16 40  2  0
 17 11  1  0
 17 23  1  0
 17 35  1  0
 18 36  1  0
 18 41  2  0
 19 26  1  0
 19 36  1  0
 20 24  2  0
 22 25  2  0
 22 39  1  0
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 24 29  1  0
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 26 30  2  0
 29 38  1  0
 31 39  2  0
 31 42  1  0
 31 43  1  0
 32 43  2  0
 44 45  3  0
 45 14  1  0
M  RAD  8   1   2   2   3   3   3   4   2   5   3   6   3   7   3   8   3
M  RAD  8   9   3  10   3  12   2  13   2  14   3  15   3  17   2  20   2
M  RAD  8  21   3  22   2  23   2  26   2  27   2  28   2  29   3  30   2
M  RAD  6  32   2  35   2  36   2  37   2  38   2  42   2
M  END
$$$$
