LAMMPS data file via write_data, version 2 Aug 2023, timestep = 63, units = metal

18 atoms
3 atom types
6 bonds
1 bond types

0.015808399303916948 5.587188089446097 xlo xhi
0.01580839930393365 5.58718808944608 ylo yhi
0.015808399303903223 5.58718808944611 zlo zhi
5.355752769511769e-16 -9.43911696467103e-15 1.442404626300812e-14 xy xz yz

Atom Type Labels

1 Mg
2 OC
3 OS

Bond Type Labels

1 OC-OS

Masses

1 24.305
2 14.639
3 1.36

Pair Coeffs # born/coul/long/cs

1 0 1 0 0 0
2 0 1 0 0 0
3 22764.5 0.149 0 20.37 0

Bond Coeffs # harmonic

1 51.71 0

Atoms # full

1 0 1 2 1.4086533218394566 0.015808399303940863 2.801498244375006 0 0 0
2 0 1 2 4.194343166910451 0.015808399303940863 2.801498244375006 0 0 0
3 0 1 2 2.8014982443750065 1.4086533218394701 0.015808399303903223 0 0 0
4 0 1 2 2.8014982443750047 4.194343166910546 0.015808399303903223 0 0 0
5 0 1 2 0.01580839930391486 2.80149824437501 1.4086533218394548 0 0 0
6 0 1 2 0.015808399303910137 2.801498244374971 4.194343166910558 0 0 0
7 0 2 0.9345 1.4086533218394583 2.8014982443750065 0.015808399303903223 0 0 0
8 0 2 0.9345 4.194343166910553 2.8014982443750065 0.015808399303903223 0 0 0
9 0 2 0.9345 0.01580839930391236 1.4086533218394768 2.801498244375006 0 0 0
10 0 2 0.9345 0.01580839930391263 4.194343166910553 2.801498244375006 0 0 0
11 0 2 0.9345 2.801498244374963 0.015808399303937255 1.4086533218394548 0 0 0
12 0 2 0.9345 2.8014982443749807 0.015808399303944468 4.194343166910558 0 0 0
13 0 3 -2.9345 1.4086533218394583 2.8014982443750065 0.015808399303903226 0 0 0
14 0 3 -2.9345 4.194343166910553 2.8014982443750065 0.015808399303903226 0 0 0
15 0 3 -2.9345 0.01580839930391236 1.4086533218394763 2.801498244375006 0 0 0
16 0 3 -2.9345 0.01580839930391263 4.194343166910553 2.801498244375006 0 0 0
17 0 3 -2.9345 2.801498244374963 0.015808399303937255 1.4086533218394548 0 0 0
18 0 3 -2.9345 2.8014982443749807 0.01580839930394447 4.194343166910558 0 0 0

Velocities

1 -7.501281849994587e-14 3.636050250438034e-16 8.85874061015812e-15
2 2.7523798562406695e-13 -1.5425667729131054e-16 -7.536540519089743e-15
3 -1.1326847446819088e-14 9.88344568073611e-15 -2.2036668184472933e-15
4 -9.024015621541666e-15 2.148575147986111e-15 1.2946542558377847e-15
5 1.538159439276211e-14 2.9198585344426636e-14 -3.834380264098291e-15
6 7.646723860012108e-15 9.427286649317521e-14 3.1292068821951565e-15
7 -1.478126190110939e-14 2.8140193217056338e-14 1.0852702503506369e-14
8 2.1302944905744906e-14 3.020565961745501e-14 4.521959376460986e-15
9 -4.3414468742218816e-13 -5.274422563524578e-13 -1.8513164658320177e-14
10 -4.3429103654992193e-13 4.430719842139473e-14 2.156820269976234e-14
11 -3.697144839374019e-14 -3.5325020706735436e-14 -3.9962744529938946e-14
12 -2.4540919356854263e-14 1.2663772959211603e-14 4.834094625455639e-14
13 8.191548074008224e-14 -7.425559564203128e-13 -5.749836628871157e-14
14 -3.558203694647322e-13 -7.062502670898978e-13 -6.542408287474117e-14
15 3.106487077296965e-12 4.281659166375837e-12 -5.277247316909144e-14
16 3.0978229399109947e-12 -6.730459451192334e-13 1.3705090046898374e-13
17 4.883422890274133e-13 2.630747169921872e-13 -1.8602666002504704e-13
18 -1.937616179044253e-13 -6.424260959483613e-14 1.8174997289205748e-13

Bonds

1 1 7 13
2 1 8 14
3 1 9 15
4 1 10 16
5 1 11 17
6 1 12 18