
     RDKit          3D

 56 59  0  0  0  0  0  0  0  0999 V2000
    5.2439    0.4132    2.2354 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2321   -0.0079   -0.5491 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6644    0.0595   -2.0253 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4335    0.5123   -2.7958 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3093    0.2258   -1.9261 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0412    0.4863   -2.3385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5396   -0.2094   -3.2636 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8186    1.6645   -1.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2241    1.3955   -1.8931 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1410    1.5905   -0.8478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0058    2.6891   -0.9169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9717    2.8934    0.0701 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0892    1.9944    1.1307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2386    0.8896    1.2120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2531    0.6723    0.2309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3161   -0.5140    0.3413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4063   -0.4249    1.5840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5453   -1.6933    1.7856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5346   -2.6391    0.5574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9935   -3.0514    0.2307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0178   -1.8813    0.2915 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0278   -2.0288   -0.5982 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4206   -1.7984   -0.4963 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7159   -0.2858   -0.6186 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3483   -0.6048    1.8080 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0289    1.0726    1.8114 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3649    0.3600    3.3369 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3895    1.6807   -0.1900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7947   -0.8267   -0.0456 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9494   -0.9609   -2.3653 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5281    0.7350   -2.2058 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.9305    3.3843   -1.7434 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6761   -0.4879   -0.5456 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.0220   -0.2705    2.4965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4845   -1.4039    2.0731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9513   -2.2634    2.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0297   -3.5671    0.8080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3135   -3.8405    0.9462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0182   -3.5109   -0.7817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6575   -2.0018    1.1931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6821   -1.9271   -0.5993 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9168   -2.3325   -1.3347 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8759   -2.1959    0.4402 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1859    0.2572    0.1870 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 25 28  1  0
 28 29  1  0
 29 30  1  0
 30  6  1  0
 30  9  1  0
 21 16  1  0
 27 22  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  5 34  1  0
  6 35  1  0
  7 36  1  0
  7 37  1  0
  8 38  1  0
  8 39  1  0
 17 40  1  0
 18 41  1  0
 19 42  1  0
 20 43  1  0
 22 44  1  0
 23 45  1  0
 23 46  1  0
 24 47  1  0
 24 48  1  0
 25 49  1  0
 26 50  1  0
 26 51  1  0
 27 52  1  0
 27 53  1  0
 29 54  1  0
 29 55  1  0
 30 56  1  0
M  END
$$$$
