units real atom_style full dimension 2 pair_style lj/cut/coul/cut 10.0 bond_style harmonic angle_style harmonic dihedral_style opls special_bonds lj/coul 0.0 0.0 0.5 read_data tips1.data pair_coeff 1 1 0.066 3.5 pair_coeff 2 2 0.03 2.5 pair_coeff 3 3 0.07 3.55 pair_coeff 4 4 0.03 2.42 pair_coeff 5 5 0.21 3.3 pair_coeff 6 6 0.1 4 pair_coeff 7 7 0.066 3.5 thermo 100 dump 1 all xyz 1000 tips1_out.xyz thermo_style multi minimize 0.0 1.0e-8 1000 100000 run 100000