LAMMPS data file via write_data, version 2 Aug 2023, timestep = 1933, units = metal 16 atoms 4 atom types 8 bonds 2 bond types -0.5495481956250127 6.24287319562459 xlo xhi -0.5495481956250124 6.24287319562459 ylo yhi -0.5495481956250108 6.24287319562459 zlo zhi -8.79728312213458e-17 -1.2231975980057486e-16 9.347348178152736e-18 xy xz yz Atom Type Labels 1 ClC 2 ClS 3 NaC 4 NaS Bond Type Labels 1 NaC-NaS 2 ClC-ClS Masses 1 31.905 2 3.545 3 20.690784 4 2.298976 Pair Coeffs # born/coul/long/cs 1 0 1 0 0 0 2 405774 0.23768 0 72.4 145.4 3 0 1 0 0 0 4 487 0.23768 0 1.05 0.5 Bond Coeffs # harmonic 1 63.014 0 2 25.724 0 Atoms # full 1 0 1 1.5005 -0.5495481956250127 -0.5495481956250124 -0.5495481956250108 0 0 0 2 0 1 1.5005 -0.5495481956250128 2.846662499999815 2.8466624999997885 0 0 0 3 0 1 1.5005 2.8466624999997885 -0.5495481956250121 2.8466624999997885 0 0 0 4 0 1 1.5005 2.846662499999787 2.846662499999817 -0.5495481956250108 0 0 0 5 0 3 1.5056 2.8466624999997885 2.846662499999815 2.8466624999997885 0 0 0 6 0 3 1.5056 2.846662499999787 -0.5495481956250124 -0.5495481956250108 0 0 0 7 0 3 1.5056 -0.5495481956250127 2.846662499999817 -0.5495481956250108 0 0 0 8 0 3 1.5056 -0.5495481956250127 -0.5495481956250121 2.8466624999997885 0 0 0 9 0 2 -2.5005 -0.5495481956250127 -0.5495481956250124 -0.5495481956250108 0 0 0 10 0 2 -2.5005 -0.5495481956250128 2.846662499999815 2.8466624999997885 0 0 0 11 0 2 -2.5005 2.8466624999997885 -0.5495481956250121 2.8466624999997885 0 0 0 12 0 2 -2.5005 2.846662499999787 2.846662499999817 -0.5495481956250108 0 0 0 13 0 4 -0.5056 2.8466624999997885 2.846662499999815 2.8466624999997885 0 0 0 14 0 4 -0.5056 2.846662499999787 -0.5495481956250124 -0.5495481956250108 0 0 0 15 0 4 -0.5056 -0.5495481956250127 2.846662499999817 -0.5495481956250108 0 0 0 16 0 4 -0.5056 -0.5495481956250127 -0.5495481956250121 2.8466624999997885 0 0 0 Velocities 1 -2.0144850784150999e-16 1.8004460388334954e-15 -2.937790739355354e-17 2 1.1751162957421416e-16 -1.5570290918583377e-15 1.9620245294980402e-16 3 7.764161239724864e-17 1.423254692119835e-15 1.4947977657054755e-16 4 2.098421956682396e-17 -1.6771637488784048e-15 -4.4919345010232536e-18 5 1.4237288984457432e-16 2.666255937089301e-15 -1.97501937815641e-15 6 -7.442219241875476e-17 -2.686479358942223e-15 9.302774052344344e-18 7 0 2.6403699571175598e-15 1.472265110892757e-16 8 -2.5885979971740783e-17 -2.4915255722800503e-15 2.4510787285742055e-15 9 -2.8706412367415176e-15 3.4296608460017075e-14 -4.3437334503325595e-16 10 -1.510863808811325e-15 -2.455153689318403e-14 1.2823456577286121e-14 11 3.7771595220283126e-17 3.3328711332497324e-14 1.3947751716264861e-14 12 3.890474307689162e-15 -3.627489575967941e-14 -6.368054881669608e-16 13 5.023497988265947e-16 -9.32204697337018e-14 3.961009962668031e-15 14 5.704218367835317e-15 1.0249573993232617e-13 -3.0325273861230434e-15 15 -5.474884764023176e-15 -1.0259584587049814e-13 -3.567411614855527e-15 16 -4.659476394913341e-16 9.295655407852116e-14 2.424383811728348e-15 Bonds 1 2 1 9 2 2 2 10 3 2 3 11 4 2 4 12 5 1 5 13 6 1 6 14 7 1 7 15 8 1 8 16