graphkit-learn/datasets/MAO/molecule12.ct

Untitled Document-1
12 13
   -0.4465   -1.2135    0.0000 N
   -1.3282   -0.0000    0.0000 C
   -0.4465    1.2135    0.0000 C
    0.9801    0.7500    0.0000 C
    2.2791    1.5000    0.0000 C
    3.5782    0.7500    0.0000 C
    3.5782   -0.7500    0.0000 C
    2.2791   -1.5000    0.0000 C
    0.9801   -0.7500    0.0000 C
   -2.8282   -0.0000    0.0000 C
    0.0000    0.0000    0.0000 N
   0.0000 0.0000 0.0000 C
1 2  1  1
2 3  2  1
3 4  1  1
4 5  1  1
5 6  2  1
6 7  1  1
7 8  2  1
8 9  1  1
1 9  1  1
4 9  2  0
2 10  1  1
10 11 1	 1
1 12 1 1