LAMMPS data file via write_data, version 2 Aug 2023, timestep = 52, units = real 4 atoms 1 atom types -2.8465583164256225 2.8465583164256225 xlo xhi -2.8465583164256225 2.8465583164256225 ylo yhi -2.8465583164256225 2.8465583164256225 zlo zhi -5.523292422171059e-17 -4.507039449473336e-17 -4.677356669532134e-17 xy xz yz Atom Type Labels 1 IES Bond Type Labels Angle Type Labels Dihedral Type Labels Improper Type Labels Masses 1 252 Pair Coeffs # lj/cut 1 2.88 3.68208 Atoms # full 1 1 1 0 2.846558306524548 2.846558306524548 -2.8465583164256225 -1 -1 0 2 2 1 0 2.846558306524548 -9.901072850482251e-09 -4.440892098500626e-16 -1 0 0 3 3 1 0 -9.901072850482251e-09 2.846558306524548 -4.440892098500626e-16 0 -1 0 4 4 1 0 -9.901072850482251e-09 -9.901072850482251e-09 -2.8465583164256225 0 0 0 Velocities 1 5.400935430456245e-20 5.442698209755315e-20 -1.495395518074276e-20 2 5.433193577225182e-20 -5.429161308879065e-20 1.5449348148980002e-20 3 -5.4101520438187986e-20 5.423976963862629e-20 1.5587597349418302e-20 4 -5.423976963862629e-20 -5.456235110631566e-20 -1.4216626111738497e-20