Core-shell LAMMPS data with labels 18 atoms 3 atom types 6 bonds 1 bond types 0.0 5.6382000000000003 xlo xhi 0.0 5.6382000000000003 ylo yhi 0.0 5.6382000000000003 zlo zhi Atom Type Labels 1 Mg 2 OC 3 OS Bond Type Labels 1 OC-OS Atoms # full 1 0 Mg 0.0 1.4095500000000001 0 2.8191000000000002 2 0 Mg 0.0 4.22865 0 2.8191000000000002 3 0 Mg 0.0 2.8191000000000002 1.4095500000000001 0 4 0 Mg 0.0 2.8191000000000002 4.22865 0 5 0 Mg 0.0 0 2.8191000000000002 1.4095500000000001 6 0 Mg 0.0 0 2.8191000000000002 4.22865 7 0 OC 0.0 1.4095500000000001 2.8191000000000002 0 8 0 OC 0.0 4.22865 2.8191000000000002 0 9 0 OC 0.0 0 1.4095500000000001 2.8191000000000002 10 0 OC 0.0 0 4.22865 2.8191000000000002 11 0 OC 0.0 2.8191000000000002 0 1.4095500000000001 12 0 OC 0.0 2.8191000000000002 0 4.22865 13 0 OS 0.0 1.4095500000000001 2.8191000000000002 0 14 0 OS 0.0 4.22865 2.8191000000000002 0 15 0 OS 0.0 0 1.4095500000000001 2.8191000000000002 16 0 OS 0.0 0 4.22865 2.8191000000000002 17 0 OS 0.0 2.8191000000000002 0 1.4095500000000001 18 0 OS 0.0 2.8191000000000002 0 4.22865 Bonds 1 OC-OS 7 13 2 OC-OS 8 14 3 OC-OS 9 15 4 OC-OS 10 16 5 OC-OS 11 17 6 OC-OS 12 18