log log.h2-h2o-class1
units real
atom_style full
pair_style lj/cut/coul/cut 15.0
bond_style harmonic
angle_style harmonic

read_data h2-h2o-class1.data

thermo_style multi
minimize 0.0 0.0 100 1000

write_data h2-h2o-class1.data2