256 Lattice="14.471019744873047 0.0 0.0 0.0 14.471019744873047 0.0 0.0 0.0 14.471019744873047" Properties=species:S:1:pos:R:3:forces:R:3 energy=-743.0533377992415 stress="-0.006301238891214201 -0.00023695873955047663 -3.303052672505482e-05 -0.00023695873955047663 -0.006185739323227973 0.0006103942368904036 -3.303052672505482e-05 0.0006103942368904036 -0.006368937214724978" free_energy=-743.0533377992415 pbc="F F F" Ni 0.02372463 0.02070731 0.01906446 -0.52405921 -0.58273660 -0.50530255 Ni 1.78681269 1.80114166 0.00340861 0.96056867 0.66818703 -0.82091621 Ni 1.77645848 0.00819935 1.84090023 1.16529726 -0.75861772 0.33140685 Ni 0.01881188 1.79952543 1.80139233 -0.97166941 0.86259667 0.72991675 Ni 3.59235864 0.00329031 0.03123656 -0.18018105 -0.60657032 -0.55812220 Ni 5.40254047 1.77382740 0.00174489 0.32588456 1.08664226 -0.71748217 Ni 5.41008326 0.00921713 1.78431575 0.28608044 -0.74580535 1.13515110 Ni 3.65242676 1.82148633 1.82340832 -0.23546878 0.84301003 0.97076654 Ni 7.26577904 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7.20588410 10.86922063 -0.17162922 0.64002383 -0.96325906 Ni 9.06639382 9.01260881 10.85865542 -0.85421427 0.32666164 -0.94277781 Ni 9.06955379 7.22395701 12.63767136 -0.28137477 0.27136577 0.74821126 Ni 7.20283027 9.05958060 12.69790814 0.49141324 -0.32380105 0.32912892 Ni 10.87912404 7.25137189 10.88893999 -1.09628846 -0.44659965 -1.43397432 Ni 12.62604438 9.04853274 10.82653709 1.16957724 0.08752953 -0.20425539 Ni 12.65833973 7.24642676 12.63140597 0.70488380 0.23588652 0.86553649 Ni 10.83227647 9.05482785 12.66017813 -0.26887326 0.03068150 0.88952439 Ni 0.02718454 10.87503293 10.87240665 -1.02889227 -0.60714362 -0.91586897 Ni 1.82076442 12.67231931 10.85583710 0.45897371 0.92353485 -0.75655728 Ni 1.77974092 10.88871453 12.63385470 0.86103640 -0.91531002 1.13152783 Ni 0.00254511 12.69196682 12.69560290 -0.31660951 0.35448591 0.21999033 Ni 3.59978549 10.87117298 10.86490379 0.17577851 -1.30076421 -1.17350935 Ni 5.40817568 12.62967466 10.86977388 0.31795809 0.93978640 -0.72207249 Ni 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