LAMMPS INPUT FILE FOR co2_1                           
       3 atoms
       2 bonds
       1 angles
       0 dihedrals
       0 impropers
       2 atom types
       1 bond types
       1 angle types
       0 dihedral types
       0 improper types
  -0.500000000000000E+02   0.500000000000000E+02 xlo xhi
  -0.500000000000000E+02   0.500000000000000E+02 ylo yhi
  -0.500000000000000E+02   0.500000000000000E+02 zlo zhi
 
 Masses 
 
       1   0.120107000000000E+02
       2   0.159990000000000E+02
 
 Atoms 
 
       1        1        2  -0.350000000000000E+00  -0.116000000000000E+01   0.000000000000000E+00   0.000000000000000E+00  # O 
       2        1        1   0.700000000000000E+00   0.000000000000000E+00   0.000000000000000E+00   0.000000000000000E+00  # C 
       3        1        2  -0.350000000000000E+00   0.116000000000000E+01   0.000000000000000E+00   0.000000000000000E+00  # O 
 
 Bonds 
 
       1        1        1        2
       2        1        2        3
 
 Angles 
 
       1        1        1        2        3