32 Lattice="5.705932013206975 0.0 0.0 0.0 5.705932013206975 0.0 0.0 0.0 5.705932013206975" Properties=species:S:1:pos:R:3:forces:R:3 energy=7436.995945435906 stress="-30008.73197721248 -393.86800125558557 185.42385681251562 -393.86800125558557 -30282.609621613272 110.10894231281964 185.42385681251562 110.10894231281964 -30362.65199330255" pbc="F F F" Kr 0.01625167 -0.04028313 0.01911839 -617.70779385 -595.25817220 -650.72374465 Kr 1.47045738 1.37523721 0.01660006 -454.77419814 632.94600421 -1321.43697158 Kr 1.46890940 -0.00321006 1.38265594 -141.42343930 -1310.83563731 491.49691251 Kr 0.00636656 1.37678594 1.42925880 -1178.14219450 374.22149006 -336.76567473 Kr 2.79621085 0.01054970 0.00429351 718.32834971 -1082.80295998 -1053.05159411 Kr 4.31860189 1.41918750 -0.02897871 690.81583328 116.17235794 -879.95077296 Kr 4.31221194 0.05535869 1.39418675 691.73890839 -923.30980940 146.19192520 Kr 2.88138300 1.46821055 1.41717571 200.27910582 -493.21722867 -76.61000059 Kr 0.05458570 2.89738206 0.00577706 -820.69730927 -393.94465604 -950.82381906 Kr 1.42021088 4.33317256 0.00780364 68.25562462 793.93882827 -972.84101336 Kr 1.43499047 2.79985435 1.46144535 -372.03230799 363.58778590 -431.04246061 Kr 0.02210264 4.25568196 1.40380529 -962.81724298 879.89098315 255.31067286 Kr 2.87086510 2.87134360 -0.02767917 -211.52829713 -214.87476233 -1018.69899792 Kr 4.23415117 4.24973870 0.01032642 736.77338828 686.63893118 -455.51753764 Kr 4.31122385 2.80746723 1.49125694 1073.90398086 207.53821077 -211.24021251 Kr 2.76814807 4.26505024 1.41673741 408.89177093 1043.67190984 230.86368734 Kr 0.04205115 0.03962153 2.81488800 -939.35147068 -1110.69138873 269.98181352 Kr 1.45790610 1.40804691 2.82063047 -216.16898944 -192.32477508 467.00454298 Kr 1.39924008 -0.01755434 4.29849883 -108.87208172 -733.28143884 853.14954694 Kr -0.03155430 1.45585805 4.29695405 -812.24281143 -330.75294880 837.45556682 Kr 2.81716845 -0.02772725 2.88621934 176.25679095 -1106.69697836 -307.94774081 Kr 4.29473534 1.38124888 2.92053577 988.59270720 64.83838121 -426.26955120 Kr 4.27678358 -0.02000216 4.24177920 712.41355913 -903.58158393 813.97916195 Kr 2.86988409 1.37069995 4.32984012 -200.91186640 250.26232552 1082.77931653 Kr -0.02569755 2.80299360 2.87391462 -1030.72784241 283.81565350 -181.57005129 Kr 1.37466421 4.33175054 2.86638891 263.63111804 834.63529618 -2.87902785 Kr 1.39808097 2.81115401 4.30033545 284.32587290 149.56386079 988.53072872 Kr 0.04812403 4.30199470 4.29050644 -715.51117163 524.23706533 679.60360004 Kr 2.79916399 2.80072884 2.82650067 475.21753355 527.27184142 584.20121320 Kr 4.28862191 4.30912054 2.81118109 637.96581134 739.91766403 6.48564527 Kr 4.29394532 2.82279717 4.23270087 809.28565366 179.70702394 845.36573839 Kr 2.89170728 4.24677223 4.27184109 -153.76699179 738.71672646 724.96909862