32 Lattice="7.429280824197191 0.0 0.0 0.0 7.429280824197191 0.0 0.0 0.0 7.429280824197191" Properties=species:S:1:pos:R:3:forces:R:3 energy=-60.78872896657048 stress="-0.00911939310326143 0.0009444709885103464 0.00022059082904834717 0.0009444709885103464 -0.0097560610059994 -0.0005141916928618296 0.00022059082904834717 -0.0005141916928618296 -0.008883785584629014" free_energy=-60.78872896657048 pbc="F F F" Ni 0.03169963 0.01706806 0.03049098 -0.19631212 -0.26258264 -0.16920401 Ni 1.82130029 1.85766574 0.02790887 0.96261567 0.53411676 -0.48882723 Ni 1.85995763 0.02314222 1.88760346 0.46403341 -0.55169448 0.46261029 Ni 0.03504299 1.83521735 1.86679674 -0.57955337 0.64073102 0.68003313 Ni 3.69637222 0.02915396 0.03228751 -0.40372284 -0.28230667 -0.31019574 Ni 5.57834930 1.83770058 0.01708880 0.13387734 0.51228027 -0.24769852 Ni 5.56462187 0.03550681 1.85867422 0.20404841 -0.36657343 0.50288562 Ni 3.69218731 1.84047470 1.87863975 -0.28038473 0.88193438 0.39813986 Ni 0.02846480 3.69501141 0.02931039 -0.32763274 -0.19314047 -0.25137060 Ni 1.88216391 5.56830434 0.03717646 0.20548459 0.16155571 -0.21662832 Ni 1.86687023 3.67975158 1.86887504 0.76862427 -0.32872028 0.48382015 Ni 0.00395516 5.54362315 1.87947464 -0.20578116 0.30667843 0.17140221 Ni 3.74293447 3.73822966 0.00703973 -0.76276641 -0.80365054 -0.27975860 Ni 5.53916304 5.59889800 0.00902393 0.15027189 0.20311191 -0.12246616 Ni 5.54707687 3.73537521 1.82481366 0.39034697 -0.62625190 0.77662255 Ni 3.70548932 5.59343671 1.86593952 -0.29514452 0.22112783 0.57268988 Ni 0.00864041 0.02953567 3.74241855 -0.21406046 -0.39951857 -0.46794667 Ni 1.87344185 1.85737432 3.72203215 0.44541730 0.76593664 -0.62042796 Ni 1.89320648 0.03079777 5.56738984 0.17776809 -0.38089715 0.35377588 Ni 0.02251644 1.85037718 5.54067920 -0.26895099 0.56338947 0.35705504 Ni 3.70433192 0.02872380 3.74099379 -0.22755026 -0.51478455 -0.59261691 Ni 5.57190377 1.83371848 3.74311805 0.31373261 0.79348298 -0.65081446 Ni 5.59012344 0.01641789 5.57251085 -0.04221305 -0.07343957 0.14049175 Ni 3.69075578 1.87556814 5.55707710 -0.22784807 0.49424473 0.45127535 Ni 0.02810482 3.73387298 3.69968737 -0.47570909 -0.73146492 -0.34541358 Ni 1.87294372 5.53955264 3.68520861 0.49390296 0.45045707 -0.16496432 Ni 1.84925473 3.72736669 5.53564170 0.61628308 -0.48379866 0.38408397 Ni 0.00510197 5.55346377 5.59491042 -0.02159890 0.09242605 -0.04662319 Ni 3.74733203 3.70611387 3.69737366 -0.64283103 -0.47789047 -0.51842028 Ni 5.59680563 5.58387525 3.73686886 0.13917592 0.05199155 -0.49606341 Ni 5.54233053 3.71191801 5.60690833 0.34706345 -0.48506159 0.12256994 Ni 3.74937334 5.54577868 5.57374845 -0.64058624 0.28831109 0.13198432