YLPLIN0176
     RDKit          3D

 45 47  0  0  1  0  0  0  0  0999 V2000
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   -6.8832   -1.9793    3.0339 C   0  0  0  0  0  3  0  0  0  0  0  0
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    7.3941   -1.3809   -0.0789 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8989   -1.0755    4.0508 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.1066   -2.5760    2.0520 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.1124   -1.6667    3.0636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7248   -2.4238    2.0715 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.0533   -1.5781   -0.6324 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.7612   -1.0771   -0.3877 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7501    0.8721    0.8439 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3518    2.8233    0.6477 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7336    3.1052   -1.9966 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0408    1.8246   -3.6316 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.5947   -0.8213   -1.6903 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4449   -1.4572    0.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0237    3.0401   -0.6188 C   0  0  0  0  0  2  0  0  0  0  0  0
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    0.2316   -0.9053   -2.9856 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0702   -0.7273    1.6157 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.8800    3.7389   -0.3294 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.4645   -2.2998    0.8898 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4367   -0.0889    0.4035 O   0  0  0  0  0  1  0  0  0  0  0  0
    3.2390   -1.9075   -1.1233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5729    3.5836    0.9200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3657   -2.6747    0.4732 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9417   -3.7507   -1.7076 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0005   -0.8087   -4.0676 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0361   -0.9161    0.0054 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.7333    1.7913    1.4085 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.3298    3.0389   -3.1926 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2286   -0.5672   -0.5174 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3499   -1.4720    3.1349 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.0225   -1.8978   -3.0427 O   0  0  0  0  0  1  0  0  0  0  0  0
   -2.3974    1.3726   -1.0658 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2513    1.7249    1.9890 S   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  5  1  0
  2  6  1  0
  3  4  1  0
  3 31  2  0
  3 32  1  0
  5  7  2  0
  6  8  2  0
  7  8  1  0
  7 42  1  0
  9  4  1  0
  9 17  1  0
  9 38  1  0
 10 18  1  0
 10 33  2  0
 10 38  1  0
 11 18  1  0
 11 39  1  0
 12 19  1  0
 12 34  2  0
 12 39  1  0
 13 19  1  0
 13 40  1  0
 14 20  1  0
 14 40  1  0
 15 21  1  0
 15 41  1  0
 16 22  1  0
 16 35  2  0
 16 41  1  0
 17 36  2  0
 17 43  1  0
 20 37  1  0
 21 37  1  0
 22 24  2  0
 22 42  1  0
 23 24  1  0
 23 41  1  0
 23 44  2  0
 24 45  1  0
 25 26  2  0
 25 27  1  0
 26 28  1  0
 27 29  2  0
 27 45  1  0
 28 30  2  0
 29 30  1  0
M  RAD  8   1   2   2   2   4   3   5   2   6   2   8   2   9   2  11   3
M  RAD  8  13   3  14   3  15   3  18   3  19   3  20   3  21   3  25   2
M  RAD  8  26   2  28   2  29   2  30   2  32   2  38   2  39   2  43   2
M  END
$$$$
