32 Lattice="8.599038174018506 0.0 0.0 0.0 8.599038174018506 0.0 0.0 0.0 8.599038174018506" Properties=species:S:1:pos:R:3:forces:R:3 energy=-166.15750956012133 stress="-1.4807073216944078 -0.1811776180657424 -0.105464954627565 -0.1811776180657424 -1.6574401164752102 0.1798816862467021 -0.105464954627565 0.1798816862467021 -1.1772945088926496" pbc="F F F" Zr 0.00372696 -0.01446794 0.02107808 0.55539724 0.57387577 0.53679608 Zr 2.13796141 2.17936131 -0.02204516 -0.12310975 -0.31424522 -0.50420607 Zr 2.13943031 0.02340952 2.18150820 -0.19980547 -0.68345010 -0.33758166 Zr 0.02645841 2.16523760 2.14893170 -0.75145053 -0.28037813 -0.22834298 Zr 4.31284963 0.03674149 -0.01423655 -0.14456767 0.09291980 0.23629838 Zr 6.44174683 2.13790149 0.00386516 -0.07094117 0.07225919 0.15867558 Zr 6.48428148 -0.01452063 2.17784907 -0.13545901 0.09303728 -0.10271952 Zr 4.32070315 2.11853083 2.18538619 0.27713771 -0.18364409 -0.79422767 Zr 0.01715594 4.33648171 0.00213856 0.17749465 -0.06583675 0.15719173 Zr 2.22283363 6.45235145 0.03429668 -0.15229469 -0.12766584 0.13192398 Zr 2.17566443 4.27347699 2.18279226 -0.37184480 0.60677962 -0.63117108 Zr -0.02900222 6.45006080 2.13629963 0.34250889 -0.20001067 0.13192488 Zr 4.29440701 4.28098590 -0.01678486 0.28246804 0.21796525 -0.46798638 Zr 6.46985180 6.44059267 0.00139901 -0.62270611 -0.59495107 0.61426885 Zr 6.41912556 4.27027998 2.16616617 0.67881053 0.30705794 -0.29856083 Zr 4.29154554 6.45507269 2.18499156 0.24520026 0.53615869 -0.29869545 Zr -0.03532838 -0.02070535 4.33909169 0.29718779 0.29978871 -0.10288685 Zr 2.16584133 2.17587022 4.26961215 -0.48108016 -0.63240160 0.67778896 Zr 2.13835442 0.03028742 6.48958544 0.10250653 0.16208883 -0.30341741 Zr 0.03343633 2.19007842 6.43573487 0.01622358 -0.09963375 -0.07965331 Zr 4.30885833 0.03722988 4.27055799 0.06392307 -0.90864644 0.47107969 Zr 6.45885613 2.11670740 4.30158017 0.78997224 0.03433467 0.27789024 Zr 6.48193889 -0.00540051 6.41667870 -0.57224478 0.50290771 -0.46951618 Zr 4.30051950 2.15719256 6.42998812 0.26891347 -0.22898807 0.70121032 Zr 0.02613767 4.28209840 4.29757621 -0.74216336 0.34542950 0.17701630 Zr 2.15473507 6.40861794 4.34509254 -0.20192837 0.68335941 0.01201304 Zr 2.16054179 4.28067567 6.48490782 -0.07132397 0.30759708 0.60776100 Zr 0.02296045 6.45750871 6.44911856 0.46715601 -0.54637214 -0.47597586 Zr 4.31588771 4.27578073 4.29577627 0.32337776 0.46261651 0.51813919 Zr 6.40829833 6.45103628 4.30805829 0.04464864 -0.09882850 -0.08416334 Zr 6.45173675 4.32925642 6.46114502 -0.14238325 -0.16775606 -0.17267219 Zr 4.32018736 6.46393469 6.44796548 -0.14962334 -0.16536752 -0.05820143