Core-shell LAMMPS data with labels 20 atoms 3 atom types 8 bonds 1 bond types 0.0 4.8975999999999997 xlo xhi 0.0 4.8975999999999997 ylo yhi 0.0 4.8975999999999997 zlo zhi Atom Type Labels 1 Mg 2 OC 3 OS Bond Type Labels 1 OC-OS Atoms # full 1 0 Mg 0.0 0 0 0 2 0 Mg 0.0 2.4487999999999999 0 2.4487999999999999 3 0 Mg 0.0 0 2.4487999999999999 2.4487999999999999 4 0 Mg 0.0 2.4487999999999999 2.4487999999999999 0 5 0 OC 0.0 2.8837259316639998 2.8837259316639998 2.8837259316639998 6 0 OC 0.0 4.4626740683359998 2.0138740683359999 0.4349259316639994 7 0 OC 0.0 2.0138740683359999 0.4349259316639994 4.4626740683359998 8 0 OC 0.0 0.4349259316639994 4.4626740683359998 2.0138740683359999 9 0 OC 0.0 2.0138740683359999 2.0138740683359999 2.0138740683359999 10 0 OC 0.0 0.4349259316639994 2.8837259316639998 4.4626740683359998 11 0 OC 0.0 2.8837259316639998 4.4626740683359998 0.4349259316639994 12 0 OC 0.0 4.4626740683359998 0.4349259316639994 2.8837259316639998 13 0 OS 0.0 2.8837259316639998 2.8837259316639998 2.8837259316639998 14 0 OS 0.0 4.4626740683359998 2.0138740683359999 0.4349259316639994 15 0 OS 0.0 2.0138740683359999 0.4349259316639994 4.4626740683359998 16 0 OS 0.0 0.4349259316639994 4.4626740683359998 2.0138740683359999 17 0 OS 0.0 2.0138740683359999 2.0138740683359999 2.0138740683359999 18 0 OS 0.0 0.4349259316639994 2.8837259316639998 4.4626740683359998 19 0 OS 0.0 2.8837259316639998 4.4626740683359998 0.4349259316639994 20 0 OS 0.0 4.4626740683359998 0.4349259316639994 2.8837259316639998 Bonds 1 OC-OS 5 13 2 OC-OS 6 14 3 OC-OS 7 15 4 OC-OS 8 16 5 OC-OS 9 17 6 OC-OS 10 18 7 OC-OS 11 19 8 OC-OS 12 20