32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=593.5664566232813 stress="-0.026582988070748253 0.0004788277555627747 -0.0008430161247475804 0.0004788277555627747 -0.025344693242991587 0.00014161249020567304 -0.0008430161247475804 0.00014161249020567304 -0.026995258509503975" pbc="F F F" Zr 20.85540510 21.11115480 21.11044915 -35.84738915 -39.80303303 -46.94791017 Zr 22.70960170 22.34512630 20.83833517 -19.77179825 23.81129228 -60.50195822 Zr 22.31428531 20.83509776 22.36371066 -6.26608585 -55.71821594 30.56858623 Zr 20.77812781 22.48254321 22.23417995 -51.56634261 13.93431377 10.39874116 Zr 23.63239121 20.95894820 21.20259391 35.95063875 -64.07898129 -39.32828139 Zr 25.56504129 21.91044416 20.86550211 28.95238990 6.55711695 -40.32580751 Zr 25.28802619 21.22277084 22.68584377 38.55315011 -93.06276912 -55.38676913 Zr 24.18362810 22.69581920 22.64685009 -35.44942412 -54.67424126 -14.56034869 Zr 21.26959405 24.17626233 20.85402479 -44.34891441 -5.06385219 -56.55864712 Zr 22.70996341 25.49207130 21.15300231 -27.72562237 80.56587190 -69.66058451 Zr 22.53848316 23.95774659 22.41852158 -36.12185557 -32.51143418 2.47380701 Zr 20.95789336 25.38825682 22.56916429 -52.01619806 68.34637918 -19.20321425 Zr 23.96469590 24.17895518 21.29140871 16.59515913 -28.07285066 -130.49778509 Zr 25.61455359 25.53253581 21.14904689 35.08949201 38.60958025 -31.32908317 Zr 25.28091226 23.98699481 22.32740656 124.98812717 -4.79775668 -20.26451748 Zr 23.80598025 25.32157598 22.51361598 22.99736050 116.37275480 28.60447884 Zr 20.85198705 20.97567541 24.12165461 -64.81547158 -47.07936053 -24.97822457 Zr 22.18391079 22.27846858 23.97644859 28.29930500 14.66176916 4.07854398 Zr 22.26128685 20.84140700 25.31668137 24.39037478 -56.56090410 45.33432920 Zr 20.91986395 22.24396547 25.59073906 -38.63893126 29.77633164 49.51135596 Zr 24.27219963 20.93381326 24.13132919 -37.78695223 -63.76318230 14.80291014 Zr 25.75978669 22.22592512 23.78504734 87.02585500 45.41348599 52.87456166 Zr 25.68365717 21.20288723 25.58343331 41.91850477 -24.84131276 36.76766673 Zr 23.99655606 22.15152413 25.72094491 -14.38130098 23.30383854 42.04295509 Zr 21.23171545 24.18190327 23.72268664 -70.32610466 -27.94376139 36.29859022 Zr 22.71219253 25.42485375 24.12784212 -11.43977011 81.40277798 -8.41919707 Zr 22.28220450 24.28278197 25.56210000 20.70593408 -80.94702613 57.76778598 Zr 21.13362859 25.32702941 25.57034430 -77.48376322 63.92462812 31.66387502 Zr 24.33039712 24.05473499 23.91561068 -25.83669098 -19.78771225 33.06898450 Zr 25.63661615 25.40480033 23.88720696 53.96837191 65.25703121 2.58943798 Zr 25.29869006 24.11041876 25.26735611 65.67997521 -27.34500412 76.18433785 Zr 23.83533445 25.24148635 25.58611608 24.70797707 54.11422615 62.93138084