
     RDKit          3D

 57 57  0  0  0  0  0  0  0  0999 V2000
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    3.6534    0.4247    0.8362 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6679    1.7874    0.3345 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7294    2.4167    1.4240 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0690    2.4621   -0.8765 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -0.7698    2.2132   -3.1294 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3579    2.8511    0.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3396    3.6396   -0.0669 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5478    1.5344    0.7387 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4798    1.8028    2.2479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8610    0.9374    0.4114 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.5116   -1.2952   -0.6828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6108   -2.5135   -0.4187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1621   -2.0928   -0.1294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2001   -3.2877   -0.1657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2634   -2.8393   -0.0508 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6202   -1.9562   -1.1620 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6944   -1.0116   -1.0775 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7139   -1.1997   -1.7934 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0698    1.4520   -0.4805 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4549   -0.2936   -0.1982 H   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4188   -0.5775    2.6171 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8735   -1.7041    1.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6683   -0.8186    2.3455 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4487   -1.6476   -1.1667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0118   -3.1158    0.4256 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9186   -3.7361   -0.0813 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4256   -2.3452    0.9259 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4052   -2.3148   -2.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
  8 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
 24  4  1  0
  1 26  1  0
  1 27  1  0
  1 28  1  0
  2 29  1  0
  3 30  1  0
  3 31  1  0
  3 32  1  0
  4 33  1  6
  5 34  1  0
  8 35  1  6
  9 36  1  0
  9 37  1  0
 10 38  1  0
 11 39  1  0
 14 40  1  6
 15 41  1  0
 15 42  1  0
 15 43  1  0
 16 44  1  0
 17 45  1  0
 17 46  1  0
 18 47  1  0
 18 48  1  0
 19 49  1  0
 19 50  1  0
 20 51  1  0
 20 52  1  0
 21 53  1  0
 21 54  1  0
 22 55  1  0
 22 56  1  0
 23 57  1  0
M  END
$$$$
