Core-shell LAMMPS data with labels 6 atoms 3 atom types 2 bonds 1 bond types 0.0 3.3246999999999902 xlo xhi 0.0 2.8792746599621144 ylo yhi 0.0 5.1006 zlo zhi -1.6623499999999951 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 -1.6623500115832824e-08 1.9195164495723251 2.5509578753879998 2 0 Mg 0.0 1.6623499833764954 0.95975822958495371 0.00065787538799972072 3 0 OC 0.0 -1.6623500115832824e-08 1.9195164495723251 4.5621858666120003 4 0 OC 0.0 1.6623499833764954 0.95975822958495371 2.0118858666119994 5 0 OS 0.0 -1.6623500115832824e-08 1.9195164495723251 4.5621858666120003 6 0 OS 0.0 1.6623499833764954 0.95975822958495371 2.0118858666119994 Bonds 1 OC-OS 3 5 2 OC-OS 4 6