POTENTIAL MODEL -------------------------------------------------------------- ------------------intermolecular soft forces ----------------- -------------------------------------------------------------- Name of atom |Name of atom |Soft potential type A (in kj/mol) |\rho (in A) |C (in kJ*A^6/mol) \epsilon (in kj/mol)|\sigma (in A) | --------------------|--------------------|--------------------| O1 O1 exp-6 241042.00 0.2525252530 1260.73 O2 O2 exp-6 284623.00 0.2525252530 1285.870 N1 N1 exp-6 96349.00 0.2873563210 1407.57 N2 N2 exp-6 102369.00 0.2873563210 1398.15 N3 N3 exp-6 191935.00 0.2873563210 2376.550 N4 N4 exp-6 405341.00 0.2873563210 5629.82 C3 C3 exp-6 270363.00 0.277777780 1701.730 C4 C4 exp-6 131571.00 0.277777780 978.36 C2 C2 exp-6 103235.00 0.277777780 1435.09 H1 H1 exp-6 12680.00 0.2808988760 278.370 H2 H2 exp-6 361.30 0.2808988760 0.0 H3 H3 exp-6 115.70 0.2808988760 0.0 H4 H4 exp-6 764.90 0.2808988760 0.0