graphkit-learn/datasets/Alkane/molecule060.ct

molecule059.ct
9 8
   -3.2476   -0.3750    0.0000 C
   -1.9486    0.3750    0.0000 C
   -0.6495   -0.3750    0.0000 C
    0.6495    0.3750    0.0000 C
    1.9486   -0.3750    0.0000 C
    3.2476    0.3750    0.0000 C
    1.9486   -1.8750    0.0000 C
   -0.6495   -1.8750    0.0000 C
   -1.9486    1.8750    0.0000 C
1 2  1  1
2 3  1  1
3 4  1  1
4 5  1  1
5 6  1  1
5 7  1  1
3 8  1  1
2 9  1  1