graphkit-learn/datasets/Alkane/molecule062.ct

molecule061.ct
9 8
    1.8750    0.6495    0.0000 C
    0.3750    0.6495    0.0000 C
   -0.3750   -0.6495    0.0000 C
    0.3750   -1.9486    0.0000 C
    1.8750   -1.9486    0.0000 C
    2.6250   -0.6495    0.0000 C
   -0.3750    1.9486    0.0000 C
   -1.8750   -0.6495    0.0000 C
   -2.6250   -1.9486    0.0000 C
1 2  1  1
2 3  1  1
3 4  1  1
4 5  1  1
5 6  1  1
2 7  1  1
8 9  1  1
3 8  1  1