32 Lattice="7.6870016807112815 0.0 0.0 0.0 7.6870016807112815 0.0 0.0 0.0 7.6870016807112815" Properties=species:S:1:pos:R:3:forces:R:3 energy=-141.1711007517827 stress="-0.007494958334239453 0.015956544555792707 -0.00707097460465314 0.015956544555792707 -0.007253935718803149 -0.007361179060814057 -0.00707097460465314 -0.007361179060814057 0.00794222047157828" free_energy=-141.1711007517827 pbc="F F F" Ni 0.02410376 0.02428755 0.00139984 0.79245900 0.83557256 0.91717372 Zr 1.95104288 1.95360637 0.01930063 -1.14985649 -1.04148806 -1.73417755 Ni 1.89411356 0.02481560 1.94022877 -0.26602603 0.39527354 0.13615707 Ni 0.00193331 1.95377903 1.91196718 0.39044536 -0.72271238 0.05431629 Zr 3.84073292 0.03729793 0.03782871 -1.24326103 -2.50099641 -1.64147850 Zr 5.75745168 1.89921428 0.00938999 1.44733404 2.25162627 -1.45526316 Zr 5.75671412 0.03562870 1.91216722 1.50805292 -1.45139805 2.19824340 Zr 3.81312522 1.88591318 1.94970615 0.18668408 0.95929132 3.09367198 Zr 0.03085077 3.80135003 0.03838974 -1.48483324 -0.08320433 -1.51043900 Ni 1.89383574 5.78710050 0.03355840 0.26023286 -0.42566988 0.05642194 Zr 1.89624920 3.84060520 1.92094521 1.08207771 0.16739041 0.97829641 Zr 0.00172522 5.79429346 1.94332962 -0.70591932 2.27651726 0.19863095 Ni 3.82965644 3.82183888 0.01109833 0.30321671 0.49191768 0.15011662 Ni 5.73828682 5.79659294 0.00304802 -0.61128802 -0.96430399 0.69991406 Ni 5.74990830 3.84798020 1.91017119 -0.47109611 0.18244294 0.21958705 Zr 3.87268198 5.79723949 1.92242471 0.73379577 0.33503664 0.01039008 Zr 0.00462631 0.03823377 3.86728257 1.02449585 1.09352937 -0.36547344 Ni 1.95665262 1.93087124 3.83563924 -0.57563349 -0.79649277 0.34728690 Ni 1.92841572 0.00565225 5.77171944 0.10728089 0.76450475 -0.61122565 Ni 0.02797350 1.92746431 5.80171056 0.81332816 -0.00443563 -0.48112822 Ni 3.85483807 0.03556295 3.86460741 -0.42610034 0.22781514 0.01630998 Ni 5.80142112 1.94216152 3.83385798 -0.46835709 0.11615525 -0.05678189 Zr 5.77270043 0.02990978 5.78366941 0.16681536 -0.01824538 -0.80477196 Zr 3.83156504 1.91701042 5.75283221 -0.88199116 -0.87713730 -0.46585946 Zr 0.02733835 3.85372847 3.83553366 -1.50030713 -1.96553920 0.18041256 Ni 1.90576273 5.76513496 3.80647845 0.53459288 -0.21640166 0.61757528 Zr 1.95950837 3.81074096 5.79965697 0.74044651 0.15161872 0.36278634 Zr 0.02985650 5.75180581 5.77046791 -0.08730630 0.97700712 0.05784950 Ni 3.84813921 3.82850163 3.80894084 0.48124727 0.67326578 0.62724363 Ni 5.73878201 5.79496141 3.81561287 -0.62309314 -0.80777466 0.16589284 Zr 5.80149425 3.81805631 5.79166606 0.08195684 0.72320403 -0.90308371 Ni 3.84676599 5.76375250 5.79810780 -0.15939335 -0.74636904 -1.05859402