LAMMPS data file via write_data, version 2 Aug 2023, timestep = 3, units = real 4 atoms 1 atom types -1.955582199889509 1.955582199889509 xlo xhi -1.955582199889509 1.955582199889509 ylo yhi -1.955582199889509 1.955582199889509 zlo zhi -5.951347282662117e-17 -4.695797642689477e-17 5.3883872661075985e-18 xy xz yz Atom Type Labels 1 IPT Bond Type Labels Angle Type Labels Dihedral Type Labels Improper Type Labels Masses 1 195.084 Pair Coeffs # lj/cut 1 7.8 2.53461 Atoms # full 1 1 1 0 1.955582189922226 -1.955582199889509 -1.955582199889509 -1 0 0 2 2 1 0 1.955582189922226 -6.439293542825908e-15 -6.439293542825908e-15 -1 0 0 3 3 1 0 -9.967283887135636e-09 -1.955582199889509 -6.439293542825908e-15 0 0 0 4 4 1 0 -9.967283887135636e-09 -6.439293542825908e-15 -1.955582199889509 0 0 0 Velocities 1 -1.733451252835273e-19 -1.62680709351335e-18 -1.6442785201173046e-18 2 -1.4572419872736084e-19 1.6275511917503159e-18 1.6490407488338848e-18 3 1.5798693767255542e-19 -1.6367780098886904e-18 1.6339802005176993e-18 4 1.58820327697957e-19 1.644397575835219e-18 -1.6298132503906915e-18