HMLIN0285
     RDKit          3D

 49 49  0  0  1  0  0  0  0  0999 V2000
   -6.4776    4.9938   -2.2830 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4703    2.5515   -1.5792 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3642    1.1553    0.7910 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.0510   -0.3269    2.9153 C   0  0  0  0  0  1  0  0  0  0  0  0
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   -5.7249    1.4268   -1.1229 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.8912   -0.2779    1.3254 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.4612    3.8563   -1.5867 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3277    1.4911   -0.8832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7367   -0.7977   -0.5384 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0319   -1.4847    0.5094 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.3729   -1.5933    0.6027 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8462    1.3360    0.3575 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8199    0.7855    0.9775 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.0745   -0.5370   -0.4670 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7460    2.7482   -1.1173 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.6013   -1.7277    0.0295 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2706   -2.1897    0.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9611   -0.5695   -0.2474 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8479   -0.3687    0.9506 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.7811   -0.9768    0.2508 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.5895    0.8213   -0.3798 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9962   -3.0101    0.5832 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4821   -4.3747    1.2137 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0103   -5.7489    1.7998 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5932   -7.2805    3.5636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8084    3.3210   -0.7732 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2637    2.4115   -1.7856 S   0  0  0  0  0  0  0  0  0  0  0  0
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   -8.6139    1.0112   -1.5456 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1389    6.0792   -2.7207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7154   -1.3403   -1.0668 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0599   -1.9968    1.5435 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2903   -1.3241   -0.0432 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.5086    0.3776   -1.0103 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7080   -1.3823    0.9290 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1857   -0.5987   -0.3897 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4979    0.5243   -0.3842 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.2231   -2.0983    0.1620 N   0  0  0  0  0  2  0  0  0  0  0  0
   14.2233   -0.1845   -1.0584 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9274    1.7731    0.9992 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2351   -3.3999   -0.1652 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5365   -7.0660    2.2484 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8858   -8.3468    4.1059 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3305   -6.1886    4.5194 N   0  0  0  0  0  1  0  0  0  0  0  0
   16.0814   -0.9714    0.2116 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4999    7.2680   -2.8534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2014    8.2161   -3.3549 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.2900    7.4084   -2.4819 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0
  1 31  1  0
  2  5  2  0
  2  6  1  0
  2 28  1  0
  3  7  1  0
  4  7  1  0
  5  8  1  0
  6  9  2  0
  8 16  2  0
  9 16  1  0
  9 38  1  0
 10 17  1  0
 10 32  2  0
 10 38  1  0
 11  7  1  0
 11 18  1  0
 11 39  1  0
 12 19  1  0
 12 33  2  0
 12 39  1  0
 13 22  1  0
 13 41  1  0
 14 20  1  0
 14 41  1  0
 15 21  1  0
 15 40  1  0
 17 34  1  0
 17 23  1  0
 18 34  1  0
 18 42  2  0
 19 35  1  0
 20 36  1  0
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 22 35  1  0
 23 24  1  0
 24 25  1  0
 25 43  1  0
 26 43  1  0
 26 44  2  0
 26 45  1  0
 27 28  2  0
 28 29  1  0
 28 30  2  0
 31 47  1  0
 37 40  2  0
 37 46  2  0
 47 48  1  0
 47 49  2  0
M  RAD  8   1   3   3   2   4   2   6   2   7   2   8   2  11   2  13   3
M  RAD  8  14   3  15   3  16   2  17   2  19   3  20   3  21   3  22   3
M  RAD  8  23   3  24   3  25   3  34   2  38   2  39   2  43   2  45   3
M  CHG  3  29  -1  37   1  46  -1
M  RAD  1  48   2
M  END
$$$$
