Core-shell LAMMPS data with labels 72 atoms 3 atom types 24 bonds 1 bond types 0.0 25.552199999999999 xlo xhi 0.0 3.4729000000000001 ylo yhi 0.0 7.5550341969230992 zlo zhi 0 0.57915293603890028 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 8.5414096654372251 0 7.0019744914170934 2 0 Mg 0.0 21.317509665437225 1.73645 7.0019744914170934 3 0 Mg 0.0 1.305473070569473 0 6.3824254986555955 4 0 Mg 0.0 14.081573070569473 1.73645 6.3824254986555955 5 0 Mg 0.0 11.599427232286605 0 7.1348893014394577 6 0 Mg 0.0 24.375527232286604 1.73645 7.1348893014394577 7 0 Mg 0.0 22.317636529505325 0 4.9162455480743157 8 0 Mg 0.0 9.5415365295053256 1.73645 4.9162455480743157 9 0 Mg 0.0 14.7191069585647 0 4.1997101637159737 10 0 Mg 0.0 1.9430069585647001 1.73645 4.1997101637159737 11 0 Mg 0.0 19.368582461452974 0 4.8475593324246988 12 0 Mg 0.0 6.5924824614529749 1.73645 4.8475593324246988 13 0 Mg 0.0 14.876141315712628 0 1.3590676222006404 14 0 Mg 0.0 2.1000413157126285 1.73645 1.3590676222006404 15 0 Mg 0.0 22.434467414274536 0 1.8768376874224746 16 0 Mg 0.0 9.6583674142745348 1.73645 1.8768376874224746 17 0 Mg 0.0 25.403519481345068 0 1.9665346042744178 18 0 Mg 0.0 12.627419481345068 1.73645 1.9665346042744178 19 0 Mg 0.0 11.791153835029643 0 4.2104351391612411 20 0 Mg 0.0 24.567253835029643 1.73645 4.2104351391612411 21 0 Mg 0.0 7.5205485917667954 0 2.8158734374510623 22 0 Mg 0.0 20.296648591766797 1.73645 2.8158734374510623 23 0 Mg 0.0 4.0607910101886446 0 3.4992896672996685 24 0 Mg 0.0 16.836891010188644 1.73645 3.4992896672996685 25 0 OC 0.0 13.285248891513758 0 2.7699982121025579 26 0 OC 0.0 0.50914889151375853 1.73645 2.7699982121025579 27 0 OC 0.0 20.936589260386157 0 3.4641975911597482 28 0 OC 0.0 8.1604892603861572 1.73645 3.4641975911597482 29 0 OC 0.0 23.986202439953388 0 0.5325402326271601 30 0 OC 0.0 11.210102439953388 1.73645 0.5325402326271601 31 0 OC 0.0 16.279444440387302 0 2.7168590480247379 32 0 OC 0.0 3.5033444403873037 1.73645 2.7168590480247379 33 0 OC 0.0 23.808656173868567 0 3.4582262432311839 34 0 OC 0.0 11.032556173868567 1.73645 3.4582262432311839 35 0 OC 0.0 20.633767176411546 0 6.3413174243350081 36 0 OC 0.0 7.8576671764115451 1.73645 6.3413174243350081 37 0 OC 0.0 8.7393085844913578 0 1.2464068011554392 38 0 OC 0.0 21.515408584491357 1.73645 1.2464068011554392 39 0 OC 0.0 1.4926186844940634 0 0.62704555099373549 40 0 OC 0.0 14.268718684494063 1.73645 0.62704555099373549 41 0 OC 0.0 2.5870815683236543 0 4.8747585887887519 42 0 OC 0.0 15.363181568323654 1.73645 4.8747585887887519 43 0 OC 0.0 10.181592898661096 0 5.7136198738900781 44 0 OC 0.0 22.957692898661094 1.73645 5.7136198738900781 45 0 OC 0.0 5.9457938663955767 0 4.1039621177743468 46 0 OC 0.0 18.721893866395575 1.73645 4.1039621177743468 47 0 OC 0.0 13.142084596338396 0 5.7902520212059656 48 0 OC 0.0 25.918184596338396 1.73645 5.7902520212059656 49 0 OS 0.0 13.285248891513758 0 2.7699982121025579 50 0 OS 0.0 0.50914889151375853 1.73645 2.7699982121025579 51 0 OS 0.0 20.936589260386157 0 3.4641975911597482 52 0 OS 0.0 8.1604892603861572 1.73645 3.4641975911597482 53 0 OS 0.0 23.986202439953388 0 0.5325402326271601 54 0 OS 0.0 11.210102439953388 1.73645 0.5325402326271601 55 0 OS 0.0 16.279444440387302 0 2.7168590480247379 56 0 OS 0.0 3.5033444403873037 1.73645 2.7168590480247379 57 0 OS 0.0 23.808656173868567 0 3.4582262432311839 58 0 OS 0.0 11.032556173868567 1.73645 3.4582262432311839 59 0 OS 0.0 20.633767176411546 0 6.3413174243350081 60 0 OS 0.0 7.8576671764115451 1.73645 6.3413174243350081 61 0 OS 0.0 8.7393085844913578 0 1.2464068011554392 62 0 OS 0.0 21.515408584491357 1.73645 1.2464068011554392 63 0 OS 0.0 1.4926186844940634 0 0.62704555099373549 64 0 OS 0.0 14.268718684494063 1.73645 0.62704555099373549 65 0 OS 0.0 2.5870815683236543 0 4.8747585887887519 66 0 OS 0.0 15.363181568323654 1.73645 4.8747585887887519 67 0 OS 0.0 10.181592898661096 0 5.7136198738900781 68 0 OS 0.0 22.957692898661094 1.73645 5.7136198738900781 69 0 OS 0.0 5.9457938663955767 0 4.1039621177743468 70 0 OS 0.0 18.721893866395575 1.73645 4.1039621177743468 71 0 OS 0.0 13.142084596338396 0 5.7902520212059656 72 0 OS 0.0 25.918184596338396 1.73645 5.7902520212059656 Bonds 1 OC-OS 25 49 2 OC-OS 26 50 3 OC-OS 27 51 4 OC-OS 28 52 5 OC-OS 29 53 6 OC-OS 30 54 7 OC-OS 31 55 8 OC-OS 32 56 9 OC-OS 33 57 10 OC-OS 34 58 11 OC-OS 35 59 12 OC-OS 36 60 13 OC-OS 37 61 14 OC-OS 38 62 15 OC-OS 39 63 16 OC-OS 40 64 17 OC-OS 41 65 18 OC-OS 42 66 19 OC-OS 43 67 20 OC-OS 44 68 21 OC-OS 45 69 22 OC-OS 46 70 23 OC-OS 47 71 24 OC-OS 48 72