File: chiral_flag.mol

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file content (14 lines) | stat: -rw-r--r-- 523 bytes parent folder | download | duplicates (7)
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  Mrv0541 07091305252D          

  5  4  0  0  1  0            999 V2000
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    0.8618    2.8580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5671    2.8580    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.1473    1.6205    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5671    2.0330    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  1  0  0  0
M  END