
     RDKit          3D

 45 48  0  0  0  0  0  0  0  0999 V2000
    2.3654    0.7918   -2.5096 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0435    1.1991   -1.3612 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6119    2.5582   -1.2164 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4474    2.9434   -0.4727 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2803    4.2786   -0.0895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8724    4.6553    0.5965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8568    3.7079    0.8744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6744    2.3758    0.4668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5279    2.0339   -0.1874 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7515    1.3787    0.6897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9768    1.7207    1.1362 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7012    0.6148    1.1887 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9140   -0.3927    0.7731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6779    0.0472    0.4497 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5107   -0.7333    0.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8151   -2.2362   -0.1506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5479   -3.0621   -0.4121 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0207   -2.8762   -1.8338 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5539   -2.9517   -1.8730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1304   -1.6714   -1.5981 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5759   -1.8942    0.8036 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7059   -1.3146    2.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5934    0.0651    2.2151 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3662    0.8735    1.1011 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2194    0.3084   -0.1809 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1054    3.2870   -1.7802 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0385    5.0172   -0.3167 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7550    4.0172    1.3941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2487   -1.4191    0.7138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1601   -0.3290   -0.9586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6988   -0.6032    0.7607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5471   -2.3918   -0.9729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2611   -2.6158    0.7939 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1946   -2.8155    0.3680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7911   -4.1380   -0.2716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2967   -1.9148   -2.2879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3949   -3.6788   -2.4823 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9469   -3.7453   -1.2056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8530   -3.2330   -2.9048 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6936   -2.9643    0.7187 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9039   -1.9369    2.9288 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7047    0.5128    3.1943 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3326    1.9453    1.2443 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  1  0
 15 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  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26  2  1  0
  9  4  1  0
 14 10  1  0
 26 21  1  0
  3 27  1  0
  5 28  1  0
  6 29  1  0
  7 30  1  0
 13 31  1  0
 15 32  1  0
 15 33  1  0
 16 34  1  0
 16 35  1  0
 17 36  1  0
 17 37  1  0
 18 38  1  0
 18 39  1  0
 19 40  1  0
 19 41  1  0
 22 42  1  0
 23 43  1  0
 24 44  1  0
 25 45  1  0
M  END
$$$$
