graphkit-learn/datasets/Alkane/molecule054.ct

molecule053.ct
9 8
   -3.5490   -0.0000    0.0000 C
   -2.2500   -0.7500    0.0000 C
   -0.9510   -0.0000    0.0000 C
   -0.2010   -1.2990    0.0000 C
    1.2990   -1.2990    0.0000 C
    2.0490    0.0000    0.0000 C
    3.5490    0.0000    0.0000 C
   -1.7010    1.2990    0.0000 C
    0.3481    0.7500    0.0000 C
1 2  1  1
2 3  1  1
3 4  1  1
4 5  1  1
5 6  1  1
6 7  1  1
3 8  1  1
3 9  1  1