32 Lattice="6.274553064512663 0.0 0.0 0.0 6.274553064512663 0.0 0.0 0.0 6.274553064512663" Properties=species:S:1:pos:R:3:forces:R:3 energy=-69.65600305158058 stress="-0.012988067831421202 -0.015039134737510458 -0.012011630758547755 -0.015039134737510458 -0.0007742858985475274 0.003913035612402036 -0.012011630758547755 0.003913035612402036 -0.012472956209768057" free_energy=-69.65600305158058 pbc="F F F" Ni 0.01051184 0.02848101 0.02838883 -0.49440689 -0.27261697 0.21254159 Ni 1.56542569 1.57376504 0.00748959 -1.83487442 2.56582179 -0.92524959 Ni 1.58257845 0.01998904 1.57754039 -1.77909153 -3.09758537 -0.27542515 H 0.01883941 1.57961742 1.54139748 0.06569349 -0.52193740 -0.01831386 Ni 3.11598452 0.02111407 0.01234281 1.39702044 -1.05470854 -1.05669575 H 4.71256106 1.55043400 0.03059373 -0.19580133 -0.02245088 -0.15741407 H 4.65050746 0.01680742 1.57730703 -0.14522567 0.05386957 0.11597829 Ni 3.15286216 1.57150433 1.59366511 2.13363703 3.33060408 -0.71947338 H 0.00594990 3.14405698 0.00614045 0.27452334 0.10478492 -0.16535088 Ni 1.56632065 4.73122689 0.00239043 -1.25398911 -0.70284965 0.56334105 H 1.55709403 3.09365789 1.54237116 0.45212044 -0.00667543 -0.44089567 H 0.02723061 4.65629451 1.59067709 0.70927828 -0.03040854 -0.56026149 Ni 3.14702466 3.17318956 0.00424178 1.10859855 -0.25506266 -0.60851999 H 4.67933821 4.71641224 0.05131392 -0.41162630 -0.12983928 0.13289242 H 4.71063996 3.07847695 1.52112464 -0.09364933 0.06290896 0.13741812 Ni 3.13695524 4.73561782 1.54523986 -0.04342939 -0.45410985 1.51611544 Ni 0.02837626 0.01504194 3.13151473 -0.45145845 0.03423258 0.24428374 Ni 1.59866638 1.58714129 3.13286514 -1.09970818 2.95975040 1.26962153 H 1.61364772 0.02440053 4.66792120 -0.10166069 -0.11789473 -0.21368962 H 0.01763501 1.51730668 4.71908591 0.19801002 0.01088027 -0.24169709 Ni 3.11356396 0.01996241 3.11570700 0.59198041 -2.65200765 1.70168464 Ni 4.70009581 1.57491532 3.10806535 0.56541718 1.98172790 0.60360908 Ni 4.70527218 0.02262577 4.69879123 -0.24686401 0.10074079 0.23054539 H 3.12152204 1.60362114 4.73333738 0.01270212 -0.19324952 -0.10286233 H 0.00992152 3.19122292 3.15038322 0.25358001 -0.12399015 0.31593113 H 1.56463822 4.73108935 3.12997016 0.18865171 0.15605193 0.28052723 Ni 1.56982932 3.15358595 4.73393657 -0.54174742 0.37989727 -0.82829296 H 0.00688822 4.73352242 4.73065824 1.00856445 -0.86361430 -0.03409473 H 3.15638369 3.13456616 3.13707764 0.04209478 0.14173505 0.12223241 Ni 4.69137658 4.70399169 3.17244902 -0.35455179 -1.26969025 -0.11464529 H 4.70859749 3.14211770 4.67929930 0.09894187 0.29455082 -0.11288243 Ni 3.12434621 4.68577783 4.73063397 -0.05272962 -0.40886516 -0.87095779