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lammps/tools/msi2lmp/test/in.h2-h2o-class1
0aa77408f808efficient_neuronet

in.h2-h2o-class1
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			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