graphkit-learn/datasets/PAH/phenanthrene.ct

C14H10
 14 16
    2.9061   -1.8020    0.0000 C
    2.0000   -1.2881    0.0000 C
    2.0000   -0.2465    0.0000 C
    2.9061    0.2674    0.0000 C
    3.8000   -0.2673    0.0000 C
    4.6660    0.2327    0.0000 C
    4.6500    1.2742    0.0000 C
    5.5480    1.8020    0.0000 C
    6.4501    1.2811    0.0000 C
    6.4421    0.2395    0.0000 C
    5.5321   -0.2673    0.0000 C
    5.5321   -1.2673    0.0000 C
    4.6660   -1.7673    0.0000 C
    3.8000   -1.2673    0.0000 C
   1    2    5    5
   2    3    5    5
   3    4    5    5
   4    5    5    5
   5    6    5    5
   6    7    5    5
   7    8    5    5
   8    9    5    5
   9   10    5    5
  10   11    5    5
   6   11    5    5
  11   12    5    5
  12   13    5    5
  13   14    5    5
   1   14    5    5
   5   14    5    5