LAMMPS data file via write_data, version 2 Aug 2023, timestep = 12, units = real

8 atoms
2 atom types

-2.393515988690103 2.393515988690103 xlo xhi
-2.393515988690103 2.393515988690103 ylo yhi
-2.393515988690103 2.393515988690103 zlo zhi
5.568854677218996e-09 5.568854498060402e-09 5.568854483482984e-09 xy xz yz

Atom Type Labels

1 OCA1
2 CAO1

Bond Type Labels


Angle Type Labels


Dihedral Type Labels


Improper Type Labels


Masses

1 15.9994
2 40.08

Pair Coeffs # lj/cut/coul/long

1 0.25 2.98451
2 0.3 2.58361

Atoms # full

1 1 2 1.23 2.393515978752756 -2.3935159886855355 -2.3935159886855355 -1 0 0
2 1 1 -1.23 -4.369554496008732e-09 2.787861497210997e-09 3.454569963423637e-12 0 0 0
3 1 1 -1.23 1.8879669827498446e-08 -2.393515988683567 -2.393515988683567 0 0 0
4 1 1 -1.23 2.393515981539138 2.8821588227145867e-08 -2.393515988683567 -1 0 0
5 1 1 -1.23 2.393515981539128 -2.3935159858991404 2.8821588227145867e-08 -1 0 0
6 1 2 1.23 2.3935159843188787 3.1611401940523365e-08 2.8826991460562112e-08 -1 0 0
7 1 2 1.23 2.1669482652697525e-08 -2.3935159859037656 2.8826991460562112e-08 0 0 0
8 1 2 1.23 2.1669482652697525e-08 2.8826991460562112e-08 -2.3935159886881916 0 0 0

Velocities

1 1.7276305905621785e-11 1.7276305742496007e-11 1.7276305862341298e-11
2 8.482116965890839e-12 8.48240287667617e-12 8.48236897888712e-12
3 -3.9444909581398284e-11 3.260929648142178e-11 3.26092975934018e-11
4 3.260928319584181e-11 -3.944489454172337e-11 3.2609297583240105e-11
5 3.2609294257461747e-11 3.260926868355445e-11 -3.944489324737718e-11
6 9.572658155547351e-12 -2.0261705577378942e-11 -2.026171726640575e-11
7 -2.0261709702172148e-11 9.572550898627882e-12 -2.0261717278393903e-11
8 -2.026170566662004e-11 -2.0261717809059734e-11 9.572563310094724e-12