log log.phen3_cff97-class1
boundary m m m
units real
atom_style full
pair_style lj/cut/coul/cut 15.0
bond_style harmonic
angle_style harmonic
dihedral_style harmonic
improper_style cvff

read_data phen3_cff97-class1.data

thermo_style multi
minimize 0.0 0.0 100 1000

write_data phen3_cff97-class1.data2