graphkit-learn/datasets/Monoterpenoides/170.ct

 12 12
    0.8259   -2.1437    0.0000 C
    0.1114   -2.5562    0.0000 C
    0.1114   -3.3813    0.0000 C
    0.8259   -3.7938    0.0000 C
    1.5404   -3.3813    0.0000 C
    1.5404   -2.5562    0.0000 C
    0.8259   -1.3187    0.0000 C
   -0.6031   -2.1437    0.0000 C
   -1.3175   -2.5562    0.0000 C
   -0.6031   -1.3187    0.0000 C
   -0.6031   -3.7938    0.0000 O
    2.2549   -2.1437    0.0000 O
   1    2    1    1
   1    6    1    1
   2    3    1    1
   3    4    1    1
   4    5    2    2
   5    6    1    1
   1    7    2    2
   2    8    1    1
   8    9    1    1
   8   10    2    2
   3   11    1    1
   6   12    1    1