16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=335.0240233183572 stress="-1749.105315657599 -116.88103219696131 -1361.1779941402856 -116.88103219696131 -1958.9656407412135 -361.5456787928624 -1361.1779941402856 -361.5456787928624 -1961.3976282862595" pbc="F F F" Xe -0.11665064 -0.21332009 0.07529810 -3.45189530 -3.17291412 -2.63754555 Xe 1.66493895 1.25428507 1.90663468 4.64278213 61.51930462 -58.54929475 Xe 2.99735295 0.03773489 -0.08698313 1.86054382 -6.00273754 -11.65070479 Xe 4.56099032 1.67051982 1.58579638 70.81444663 -44.94776672 -88.35451974 Xe 0.14445890 2.91342004 -0.23614435 -6.40670989 0.38504415 -4.65979528 Xe 1.65771522 4.56948222 1.65303772 -7.78132240 14.42338146 3.86800346 Xe 2.91629598 3.18654997 -0.00239973 -4.12869399 -13.21223010 -24.94712811 Xe 4.56669855 4.50808168 1.26448030 19.19498073 18.17021284 4.37548902 Xe 0.07236142 0.20379337 3.23854596 -689.63034025 -614.48821068 -645.47436131 Xe 1.26922180 1.28229695 4.52031036 641.46672961 574.14090381 697.87819881 Xe 3.38019334 -0.17261316 2.64143445 27.63612887 -60.64919882 30.56978440 Xe 4.66148001 1.60981806 4.25029099 488.89399628 -577.72279526 471.39888569 Xe -0.25591612 2.91895692 2.96474119 -12.68075517 5.77409706 -1.27394303 Xe 1.41150068 4.58674642 4.43302241 -1.84892736 5.43040527 8.16376748 Xe 3.51714099 2.97148583 3.15845074 -613.95717884 494.10270928 -524.39852238 Xe 4.36552560 4.43204687 4.63002225 85.37621514 146.24979474 145.69168609