BDE9W0
  -OEChem-04042101483D

 40 42  0     0  0  0  0  0  0999 V2000
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    4.5096   -0.6544   -0.0058 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0277    1.6906    0.0141 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2665    0.8959   -0.0121 O   0  5  0  0  0  0  0  0  0  0  0  0
   -9.2186   -1.1203   -0.0321 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2148   -2.3539    0.0071 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2673   -0.3356   -0.0177 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.4879   -0.0929    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1036   -1.3564    0.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0290    1.2331    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1491   -0.3831    0.0106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5674   -0.5927    0.0225 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5546   -1.6212   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2850    1.8765   -1.2089 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3004    1.8810    1.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1312   -2.8701   -0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8278    3.1723    1.2012 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.7091   -1.2932   -0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4779   -1.2648   -0.8406 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4855    1.0445   -0.8733 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0798    1.3856   -2.1573 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1073    1.3936    2.1597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9959    0.7201   -0.8850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0151    0.7134    0.9087 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6237   -3.8249   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0120    3.6688   -2.1576 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0394    3.6768    2.1394 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4947    4.8211   -0.0142 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3065   -3.4094   -0.0121 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 27  1  0  0  0  0
  2  9  1  0  0  0  0
  2 14  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  4 16  1  0  0  0  0
  4 27  1  0  0  0  0
  5 10  1  0  0  0  0
  5 21  1  0  0  0  0
  6 18  2  0  0  0  0
  7 10  1  0  0  0  0
  8 10  2  0  0  0  0
  9 12  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 11 14  2  0  0  0  0
 12 16  1  0  0  0  0
 13 19  2  0  0  0  0
 13 20  1  0  0  0  0
 14 18  1  0  0  0  0
 15 17  1  0  0  0  0
 15 21  1  0  0  0  0
 15 28  1  0  0  0  0
 15 29  1  0  0  0  0
 16 22  2  0  0  0  0
 17 30  1  0  0  0  0
 17 31  1  0  0  0  0
 19 23  1  0  0  0  0
 19 32  1  0  0  0  0
 20 24  2  0  0  0  0
 20 33  1  0  0  0  0
 21 34  1  0  0  0  0
 21 35  1  0  0  0  0
 22 26  1  0  0  0  0
 22 36  1  0  0  0  0
 23 25  2  0  0  0  0
 23 37  1  0  0  0  0
 24 25  1  0  0  0  0
 24 38  1  0  0  0  0
 25 39  1  0  0  0  0
 26 27  2  0  0  0  0
 26 40  1  0  0  0  0
M  CHG  2   7  -1  10   1
M  END

$$$$