Created by AJB

14 atoms
3 atom types

-5000.0 5000.0 xlo xhi
-5000.0 5000.0 ylo yhi
-5000.0 5000.0 zlo zhi

Masses

1 12.01070 # C nuclei mass
2 1.000794 # H nuclei mass
3 1.000000 # electron mass

Atoms

1  1  6.000000  0  0.0  0.000000  -0.000000  0.000000
2  2  1.000000  0  0.0  1.247211  1.247211  1.247211
3  2  1.000000  0  0.0  -1.247211  -1.247211  1.247211
4  2  1.000000  0  0.0  1.247211  -1.247211  -1.247211
5  2  1.000000  0  0.0  -1.247211  1.247211  -1.247211
6  3  0.000000  -1  0.329128  -0.000000  0.000000  -0.000000
7  3  0.000000  -1  1.486181  0.979221  0.979221  0.979221
8  3  0.000000  -1  1.486181  -0.979221  -0.979221  0.979221
9  3  0.000000  -1  1.486181  0.979221  -0.979221  -0.979221
10  3  0.000000  -1  1.486181  -0.979221  0.979221  -0.979221
11  3  0.000000  1  0.329128  -0.000000  0.000000  0.000000
12  3  0.000000  1  1.486181  -0.979221  -0.979221  0.979221
13  3  0.000000  1  1.486181  0.979221  -0.979221  -0.979221
14  3  0.000000  1  1.486181  -0.979221  0.979221  -0.979221