64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1280962.9140480296 stress="-6184385.842389377 -1554519.0385928303 -1123154.2947818562 -1554519.0385928303 -4873648.537147362 -3810168.154596987 -1123154.2947818562 -3810168.154596987 -4332147.735760408" pbc="F F F" Sr -0.04522591 0.06993387 -0.41762862 -8.90038199 -12.92493031 -14.45728692 Sr 1.20875648 1.77415712 1.51657000 979855.78433629 -758189.67746096 -316268.12599808 Sr 2.12386715 2.97388278 -0.08499090 305.72700258 362.89714786 -547.61098437 Sr 4.32298019 4.01453219 1.72478223 1092.89871540 1300.88337056 -865.17309925 Sr 2.38246440 0.17551103 2.18297816 607.91453172 -1019.89425232 488.83604153 Sr 3.97988629 1.28663682 4.26534363 -563.75214486 -548.50760537 1454.08295916 Sr 0.26228912 2.50631592 1.82174588 -981088.43643160 758695.30483265 316076.99869434 Sr 1.55917528 3.05045662 3.70589464 -3462.04064091 2740.92625780 -8595.12704411 Sr 4.30763899 -0.14137276 0.65216792 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1.46148073 6.94802455 37680.58691676 -46440.66469451 -30272.09074257 Sr 2.06077390 2.46727085 5.31215158 3501.97076093 -2802.26690011 8645.71530420 Sr 3.65439483 4.26274468 6.24503432 2439.10627555 -1888.33134821 -2218.27740425 Sr 2.47782933 -0.24527798 6.79964439 755.90574150 -1117.35623511 -126.18120781 Sr 3.62772030 0.60278426 9.00771341 27.41696715 17.67328500 56.08255852 Sr 0.40594375 2.51771800 7.66384692 -39860.87019741 45843.40959034 30998.59818621 Sr 1.59151596 3.84991113 8.66959180 -67.27717099 -616.16031528 2575.25799330 Sr 5.47661778 -0.16097786 5.19121065 227.49167200 -361.25295184 81.50968040 Sr 6.40950317 1.45436115 6.83210762 198954.48875971 -237893.53398878 -93366.14302074 Sr 7.96348978 2.18339720 4.66240535 -30561.48944737 70818.13124775 79019.71600728 Sr 8.85686803 4.00333998 6.30503398 14994.38493185 -4041.16443662 -14282.44080565 Sr 8.29847242 -0.43755931 6.80914731 25.03744520 -74.74395327 -50.80915635 Sr 8.79371761 1.07153441 8.89109677 15.59533877 37.79014163 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7.62561799 7.52242908 5.09112237 -33620.23588802 56647.39108735 77605.61502591 Sr 8.53617944 8.71645658 7.02656247 89.97621676 96.09977055 93.85526504 Sr 7.65749915 4.32980287 7.45401615 -4050.82981179 3153.87248808 5401.26249950 Sr 8.57494207 6.22762981 8.40587516 152.54606813 282.83888194 161.33918689 Sr 4.16060871 7.32062803 7.76372651 8594.31836552 10708.85734668 -7720.52490977 Sr 6.48065403 8.88278461 8.80427071 -21.87534536 8.55283839 29.09099863