
     RDKit          3D

 45 48  0  0  0  0  0  0  0  0999 V2000
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   -1.1238    2.6780   -0.6072 C   0  0  2  0  0  0  0  0  0  0  0  0
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    1.2727    1.7373   -0.2018 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1360    1.1679    0.8357 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7484    1.8617    1.8138 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5341    1.0654    2.5609 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4339   -0.1574    2.0625 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5820   -0.0968    1.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2490   -1.2778    0.1931 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1708   -2.3293    0.0752 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8526   -3.4392   -0.7066 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6186   -3.5036   -1.3513 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7025   -2.4576   -1.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0418   -1.3762   -0.4311 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5703   -2.5195   -1.8515 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7009   -1.7163   -1.4847 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5263   -1.3850   -2.3779 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6793   -0.7655    2.5814 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9489    0.1612    1.5732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5692   -0.0980    0.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1281    2.9867    1.1391 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7855    2.6223   -0.6353 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1257    1.0190   -1.0287 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6403    2.9270    1.9718 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1340   -2.2846    0.5684 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5632   -4.2485   -0.8141 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3719   -4.3655   -1.9584 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6633   -3.1321   -2.6933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2573   -3.2210    0.7253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8443   -2.6902    3.0532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9581   -0.5485    3.6044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4251    1.1006    1.8239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9989    0.8242   -1.7949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2312    1.9789   -2.3514 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
 17 18  2  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 26  2  1  0
  9  5  1  0
 15 10  2  0
 24 19  1  0
  1 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  1
  3 31  1  0
  3 32  1  0
  4 33  1  0
  4 34  1  0
  6 35  1  0
 11 36  1  0
 12 37  1  0
 13 38  1  0
 16 39  1  0
 20 40  1  0
 21 41  1  0
 22 42  1  0
 23 43  1  0
 26 44  1  0
 26 45  1  0
M  END
$$$$
