256 Lattice="8.612344460295647 0.0 0.0 0.0 8.612344460295647 0.0 0.0 0.0 8.612344460295647" Properties=species:S:1:pos:R:3:forces:R:3 energy=3411.989802517835 stress="-12.148426982051381 -0.04338733536959403 0.008298122038290601 -0.04338733536959403 -12.15411737168282 0.011663412419501683 0.008298122038290601 0.011663412419501683 -12.148420107705324" pbc="F F F" Ne 0.01889777 0.00378385 0.02215578 -21.67329612 -21.27949976 -23.47759456 Ne 1.08179063 1.05515153 0.03256321 -2.62852663 5.69059088 -42.16775223 Ne 1.05462657 0.03574965 1.05092061 5.43589266 -44.72020586 1.99440550 Ne 0.03053813 1.01780076 1.07769739 -41.07934843 11.33925956 -3.21674849 Ne 2.21581791 0.02241940 0.01477212 -5.38024147 -33.68820318 -28.14919475 Ne 3.17017331 1.05909996 0.02047004 3.39120357 5.66665528 -38.05870890 Ne 3.27464424 0.02588143 1.08432764 -5.97244196 -36.42373809 -0.02684788 Ne 2.10231854 1.05240583 1.05992521 6.59009550 8.08781281 6.19800524 Ne 4.30329844 0.03278200 0.01263827 2.52610732 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