32 Lattice="7.526218284144076 0.0 0.0 0.0 7.526218284144076 0.0 0.0 0.0 7.526218284144076" Properties=species:S:1:pos:R:3:forces:R:3 energy=-143.09573429879032 stress="-0.01224671556170002 -0.004038242093363723 0.0031329372450756127 -0.004038242093363723 -0.0001938225750813766 -0.003748355815339616 0.0031329372450756127 -0.003748355815339616 -0.007176411362545145" pbc="F F F" Zr 0.02736270 0.01060808 0.03110497 0.57447082 0.57437653 0.67742860 Ni 1.82687234 1.85592148 0.03586958 0.30901840 -0.19487584 0.15086656 Ni 1.90226914 0.03606721 1.91551341 -0.10347948 0.69677973 -0.02462543 Ni 0.03075522 1.88516630 1.85739520 0.01339996 -0.28340912 0.05013537 Zr 3.77624517 0.03411746 0.00743399 -0.42199204 0.44454519 0.51559090 Ni 5.64416651 1.90500352 0.00474595 -0.18160618 0.27314091 0.96930766 Ni 5.67709366 0.01921770 1.87284885 -0.29418860 0.41118384 -0.19008500 Ni 3.81236277 1.84138644 1.88706259 0.04492166 0.29848334 -0.10531722 Zr 0.03724160 3.78964161 0.03109252 -1.86886247 -1.97501484 -1.93670248 Zr 1.84980237 5.65671458 0.00565596 0.27496711 2.70005510 -2.48935724 Zr 1.86791055 3.72946166 1.87325904 1.47813325 -3.21398172 2.02426121 Zr 0.00561476 5.63717183 1.91857351 -1.92303281 2.80006676 1.10737930 Zr 3.75874100 3.75563774 0.01078332 0.85159632 -2.80353907 -1.99839750 Zr 5.61540752 5.63598378 0.02345283 1.18913077 0.30402904 -0.35075391 Ni 5.63980954 3.78640315 1.86424189 -0.39947670 -0.44523098 0.67851162 Zr 3.78987564 5.67721193 1.87707045 0.71757041 1.88306939 3.05526369 Zr 0.03268070 0.01738559 3.73962077 -0.77512558 0.17735890 -1.19407032 Ni 1.85716535 1.84882133 3.75963191 0.78741816 0.34888289 0.34590215 Zr 1.90835223 0.03428150 5.61884116 0.35730226 0.21061895 1.52609182 Ni 0.02797274 1.84942671 5.66542248 0.45650795 0.72449466 -0.30820331 Zr 3.75171938 0.01894818 3.76051408 0.02604060 -1.02498936 -1.03644282 Zr 5.63575757 1.86927072 3.78902615 0.67716168 0.58859341 -1.50780133 Ni 5.61253391 0.01022090 5.60095679 -0.59691634 0.63342424 0.00992055 Ni 3.74899080 1.88079853 5.63755781 -0.19711692 0.47997988 -0.32057780 Zr 0.03252872 3.73107764 3.74938659 -1.01925777 -1.88493451 1.11351507 Ni 1.89802297 5.61216914 3.75151752 0.48569575 -0.00820082 0.42868597 Ni 1.90569850 3.78053858 5.64681686 0.73786872 -0.65639108 -0.73685350 Zr 0.02724407 5.63465297 5.59885021 0.63686354 0.18555700 0.13711442 Ni 3.77533529 3.77223564 3.73704503 -0.29702894 -0.35991331 0.40688662 Ni 5.65633660 5.64792585 3.70573900 -0.42977118 -0.85256276 -0.07082812 Zr 5.63406137 3.77285050 5.66332912 -0.60327757 0.55188893 0.18600164 Ni 3.74223800 5.65821115 5.64501992 -0.50693480 -0.58348529 -1.11284717