nwARGOS example: crown: coc fragment file


$coc       
    7    6    7    4    0
    1C1    CT    CT    CT       1   1   1   0
    0.000000    0.000000    0.000000    0.000000    0.000000    0.000000
    2H11   H     H     H        1   1   0   0
    0.150000    0.000000    0.150000    0.000000    0.150000    0.000000
    3H12   H     H     H        1   1   0   0
    0.150000    0.000000    0.150000    0.000000    0.150000    0.000000
    4O     O     O     O        1   1   0   0
   -0.600000    0.000000   -0.600000    0.000000   -0.600000    0.000000
    5C2    CT    CT    CT       1   1   2   0
    0.000000    0.000000    0.000000    0.000000    0.000000    0.000000
    6H21   H     H     H        1   1   0   0
    0.150000    0.000000    0.150000    0.000000    0.150000    0.000000
    7H22   H     H     H        1   1   0   0
    0.150000    0.000000    0.150000    0.000000    0.150000    0.000000
    1    1    2    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    2    1    3    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    3    1    4    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    4    4    5    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    5    5    6    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    6    5    7    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    1    2    1    3    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    2    2    1    4    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    3    3    1    4    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    4    1    4    5    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    5    4    5    6    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    6    4    5    7    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    7    6    5    7    0    0
    0.000000 0.00000E+00    0.000000 0.00000E+00    0.000000 0.00000E+00
    1    2    1    4    5    0    0
    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00
    2    3    1    4    5    0    0
    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00
    3    1    4    5    6    0    0
    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00
    4    1    4    5    7    0    0
    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00    0    0.000000 0.00000E+00