Core-shell LAMMPS data with labels 6 atoms 3 atom types 2 bonds 1 bond types 0.0 3.526099999999996 xlo xhi 0.0 3.0536921762843057 ylo yhi 0.0 4.2374000000000001 zlo zhi -1.763049999999998 0 0 xy xz yz Atom Type Labels 1 Mg 2 OC 3 OS Bond Type Labels 1 OC-OS Atoms # full 1 0 Mg 0.0 -1.7630500069445052e-08 2.0357947943685111 1.05935 2 0 Mg 0.0 1.7630499823694983 1.0178974022737428 3.1780499999999998 3 0 OC 0.0 -1.7630500069445052e-08 2.0357947943685111 3.1780499999999998 4 0 OC 0.0 1.7630499823694983 1.0178974022737428 1.05935 5 0 OS 0.0 -1.7630500069445052e-08 2.0357947943685111 3.1780499999999998 6 0 OS 0.0 1.7630499823694983 1.0178974022737428 1.05935 Bonds 1 OC-OS 3 5 2 OC-OS 4 6