
     RDKit          3D

 58 61  0  0  0  0  0  0  0  0999 V2000
    3.9173    3.5553    1.6558 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4490    2.3675    2.2931 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3359    1.1245    1.6531 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5094   -0.3117   -0.3042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0523   -1.4076    0.4466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8438   -2.7481   -0.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4476   -3.1922   -0.1191 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4055   -2.5883   -0.6239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8946   -3.1430   -0.3822 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7817   -3.5496   -1.4778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4861   -2.3517   -2.1317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3969   -1.5964   -1.1515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9036   -0.2588   -1.7484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8533    0.8711   -0.7203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4929    1.0949   -0.3567 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0833    1.4369    0.9333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7590    2.4176    1.6733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3582    2.7092    2.9803 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2952    2.0154    3.5597 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9938    0.7573    1.5073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3028   -0.2394    0.8024 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1490   -0.1093   -0.5173 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2834    1.1210   -1.0837 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7570    1.2806   -2.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1312    0.1671   -3.1012 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0088   -1.1061   -2.5472 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5155   -1.2541   -1.2452 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7536   -1.2300    1.8079 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8949    0.0271    2.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9339    4.3858    2.3919 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2341    3.8336    0.8244 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9493    3.3982    1.2724 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9513    1.7799   -0.3248 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7333   -0.4189   -1.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1545   -2.7260   -1.2805 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4838   -3.4969    0.2984 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.1018   -2.7115   -2.9832 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8449   -1.4216   -0.2019 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.9484   -0.3834   -2.1123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2839    1.8035   -1.1402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4498    0.5755    0.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5839    2.9610    1.2332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8782    3.4655    3.5491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9958    2.2354    4.5762 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1928    0.4938    3.2866 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8491    2.2737   -2.7621 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5157    0.2915   -4.1018 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3017   -1.9734   -3.1272 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3951   -2.0599    2.4012 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6544    0.1517    3.4537 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  2  3
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
  6 30  1  0
 30 31  2  0
 31  3  1  0
 29  9  1  0
 22 17  1  0
 29 24  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  4 35  1  0
  5 36  1  0
  7 37  1  0
  7 38  1  0
 10 39  1  0
 11 40  1  0
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 12 42  1  0
 12 43  1  0
 13 44  1  0
 13 45  1  0
 14 46  1  0
 14 47  1  0
 15 48  1  0
 15 49  1  0
 18 50  1  0
 19 51  1  0
 20 52  1  0
 21 53  1  0
 26 54  1  0
 27 55  1  0
 28 56  1  0
 30 57  1  0
 31 58  1  0
M  END
$$$$
