File: dummyArom.mol

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file content (15 lines) | stat: -rw-r--r-- 542 bytes parent folder | download | duplicates (8)
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  Marvin  10270805572D          

  5  5  0  0  0  0            999 V2000
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   -1.5514    0.7177    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2964   -0.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4714   -0.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2165    0.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
M  END