108 Lattice="10.436165031466771 0.0 0.0 0.0 10.436165031466771 0.0 0.0 0.0 10.436165031466771" Properties=species:S:1:pos:R:3:forces:R:3 energy=-357.3694725351835 stress="-0.010500818896991787 0.0023864378855715093 0.0032702722096604455 0.0023864378855715093 -0.01049446984184556 -0.00010183403891477523 0.0032702722096604455 -0.00010183403891477523 -0.01106192769579333" free_energy=-357.3694725351835 pbc="F F F" Ni 0.00432646 0.01198249 0.02996790 0.73513938 0.30053228 0.59731937 Ni 1.71257075 1.72832525 0.02229986 0.39407651 0.13583243 -0.24302863 Fe 1.74095429 0.00358941 1.72967042 -0.07057002 -0.61380038 -0.05954721 Cu 0.03283790 1.74516318 1.70493077 -1.07484463 -0.36538390 0.21969292 Ni 3.47298923 0.02857360 0.00037143 -0.13091263 0.52021299 0.65369505 Fe 5.23740881 1.71343800 0.03178343 -0.23404250 0.35177326 -0.44011659 Ni 5.19998210 0.00258893 1.72956655 -0.10446018 0.11887936 0.31882354 Fe 3.45967991 1.76318689 1.74295216 0.14977319 -0.84084622 -0.29622323 Cu 6.92062866 0.02839670 0.02356731 0.17640945 -0.29345334 -0.37690624 Ni 8.71100241 1.72913747 0.02091973 -0.51931761 0.38329992 0.39222562 Cu 8.69785616 0.02265915 1.74295670 0.15414181 -0.19742649 -0.06359214 Cu 6.98951074 1.75218029 1.71007350 -0.13038510 0.31321669 0.24366843 Fe 0.02872076 3.50608560 0.00247142 -0.18709046 -0.14592565 -0.41224740 Cu 1.74862906 5.23935215 0.02105935 -0.15823184 0.01821652 -0.87281868 Cu 1.71011294 3.50240682 1.71521534 0.38358482 -0.19669121 0.21732500 Ni 0.03357794 5.21002591 1.71344301 -0.25616470 0.20802491 0.39817102 Fe 3.46937413 3.47818354 0.02847059 -0.09895927 -0.45277451 -0.78709661 Fe 5.22825815 5.18866142 0.02065978 0.36701318 0.13861319 -0.59035019 Ni 5.23754151 3.49079769 1.71175892 -0.40458443 -0.69602611 0.48726619 Cu 3.49268884 5.23392167 1.72725477 -0.20408989 -0.12739274 0.57866093 Ni 6.93696868 3.49553598 0.00353906 0.49128970 -0.46828954 -0.24574532 Fe 8.70380651 5.17513869 0.02874085 -0.25001816 0.08516915 0.44467273 Ni 8.71578798 3.47410503 1.74773366 -0.09208830 0.21324628 -0.05104275 Ni 6.94042083 5.18341421 1.76307583 0.48599140 0.90609133 -0.22172964 Cu 0.01154762 6.97269924 0.02274621 -0.29761575 -0.18201370 -0.16384173 Fe 1.71538009 8.71533054 0.01011047 0.26703671 -0.11248227 0.20397870 Ni 1.70883931 6.96857213 1.76779087 0.73614812 -0.14325173 -0.25814124 Fe 0.02544987 8.66573424 1.73437899 -0.06135920 0.18244214 0.76108258 Cu 3.49864326 6.93043275 0.02231644 -0.39854086 0.51924303 -1.03671461 Fe 5.24424385 8.71612779 0.02182617 0.26336530 0.29915616 -0.06173362 Cu 5.19647387 6.98749417 1.70519145 0.65884454 -0.32555791 0.68684282 Fe 3.49515549 8.67760054 1.75156673 -0.79456504 0.45159447 0.25001804 Fe 6.93695244 6.93886904 0.02315652 0.80566264 0.20147526 0.14762480 Cu 8.71698251 8.70786908 0.02751719 -0.41375510 -0.38926599 0.43125081 Ni 8.69333056 6.96117288 1.76996475 -0.42513037 -0.35122733 -0.24598865 Ni 6.98067982 8.71641942 1.74170482 -0.15480277 -0.64616679 -0.07059333 Ni 0.00985839 0.00311215 3.47494121 0.58507486 0.42713073 -0.30929566 Cu 1.70939025 1.74898209 3.50470189 0.17356069 -0.49922213 -0.19835772 Cu 1.71558948 0.00803814 5.23483892 0.00425990 -0.67268965 -0.33256148 Ni 0.00072784 1.71660649 5.23478478 0.14438209 0.14260426 0.02565609 Ni 3.46125833 0.01206470 3.47775284 -0.39481922 0.05053602 -0.67056024 Cu 5.19235696 1.70922846 3.45089968 0.57984081 0.46159123 -0.07755751 Cu 5.18524719 0.01237497 5.19617171 0.34457463 -0.91409035 -0.01557655 Cu 3.50112199 1.71923759 5.21534162 -0.56062223 0.23765992 0.20147342 Fe 6.94505696 0.03152935 3.49705775 -0.09322231 -0.49463076 -0.37772146 Cu 8.69189600 1.72942574 3.49195750 0.74235729 0.27162697 -0.16523772 Fe 8.71668054 0.00473493 5.23244381 -0.02713607 0.01233988 0.11038285 Ni 6.97525611 1.76968230 5.21570990 -0.03560499 -0.39061573 0.08826260 Cu 0.00657075 3.47274145 3.49551057 -0.91002339 0.23342212 0.20910805 Fe 1.75058738 5.20557785 3.44658293 -0.24344827 0.49477572 0.14403638 Fe 1.75153671 3.45762782 5.23565389 -0.34349011 0.15864595 0.18136368 Fe 0.02094669 5.23813706 5.24587278 -0.58634368 -0.10059727 -0.40607558 Cu 3.48515889 3.44421098 3.51346368 0.08571678 0.50123418 -0.25670867 Fe 5.21375689 5.19283663 3.45063412 0.13771332 -0.17646286 0.43613125 Ni 5.20226091 3.45422167 5.24238841 0.27206587 0.52996844 -0.42226070 Ni 3.44559040 5.24420755 5.20542188 0.26363479 -0.50351771 0.21537420 Ni 6.98064214 3.48730201 3.45670746 -0.22625348 -0.20053067 0.40291492 Fe 8.66551017 5.24934300 3.50997501 0.42820636 -0.38914357 -0.83933890 Fe 8.72334316 3.47053472 5.22688610 0.14686950 0.13224843 -0.35002920 Ni 6.94929633 5.24977295 5.19191674 -0.31808296 -0.74809379 0.42940327 Ni 0.01082427 6.93827379 3.48813958 0.09439868 -0.06190392 -0.15586368 Ni 1.78813970 8.67275979 3.48980728 -0.45878707 0.28491180 -0.05937742 Cu 1.70888528 6.96706806 5.23580517 0.36651820 -0.04957999 -0.54324684 Cu 0.02148751 8.68976004 5.25165091 -0.40876612 0.18455672 -0.32447928 Ni 3.45093705 6.94325532 3.50081517 0.21973999 -0.13576860 -0.51058313 Cu 5.19554997 8.68533266 3.49264580 0.14525135 0.80324736 -0.30727814 Fe 5.18883199 6.90360221 5.20426255 0.31630285 0.19551030 0.61338436 Fe 3.50448637 8.66817089 5.20710048 -0.17170114 0.55626117 0.21697535 Fe 6.94612723 6.97827083 3.47128272 0.22544597 -0.13238349 -0.55364918 Cu 8.70698911 8.72826913 3.46773462 0.00310825 -0.17188778 -0.06803789 Ni 8.64800410 6.93646317 5.19758383 0.18583721 0.48759994 0.07075878 Cu 6.91302980 8.70944243 5.19860545 0.23758314 0.41345557 0.30944543 Fe 0.03368493 0.00241167 6.93955258 -0.14873810 0.24138112 0.13147287 Ni 1.74082916 1.77410593 6.98785074 0.15766693 -0.34278471 -0.33161739 Fe 1.76618912 0.02018632 8.67897030 -0.09961714 -0.00809881 0.06531108 Cu 0.01733458 1.76793382 8.70159653 -0.10030117 -0.24496421 0.23711642 Cu 3.45712945 0.00698411 6.92490806 0.15886646 -0.83472434 0.52335586 Cu 5.20746522 1.73465123 6.94917547 0.39651417 0.10897836 0.39790023 Ni 5.20174991 0.00228713 8.70001755 0.17314910 0.54105809 -0.46299489 Cu 3.51010950 1.73388637 8.72221980 -0.21829019 0.24862737 0.57990421 Cu 6.95667377 0.01131759 6.98142206 -0.16144665 -0.62124263 0.05190334 Fe 8.70053807 1.74815876 6.96233916 0.31208203 0.15785393 0.41563671 Fe 8.71340231 0.00304815 8.71001179 -0.12089714 0.21703800 -0.16159882 Ni 7.01266542 1.70521326 8.72485206 -0.46865983 0.64510530 -0.43287261 Cu 0.01155434 3.45479852 6.96891801 -0.59120435 0.17440161 -0.29259228 Ni 1.73728021 5.23686291 6.93318710 0.38884002 -0.30143419 0.72205610 Ni 1.72629706 3.45087950 8.69541288 0.36473698 0.40374273 -0.23547337 Cu 0.00343706 5.22597853 8.70581045 0.11151017 -0.05924850 0.22173532 Fe 3.44506568 3.50719454 6.93166407 0.14253352 0.08553121 0.32820120 Ni 5.22613397 5.18763861 6.97633085 -0.24465294 0.32664484 -0.40248060 Fe 5.24993784 3.47119878 8.69414404 0.33815336 -0.42760793 0.26216273 Cu 3.50728934 5.19038608 8.70630704 -0.50981649 0.04473870 0.59334901 Fe 6.97805036 3.45802672 6.92319610 -0.22315899 0.33145425 0.52293395 Fe 8.71195364 5.20749672 6.90464418 0.37448128 -0.03510697 0.13770757 Ni 8.70059285 3.50491136 8.66297266 -0.49790865 -0.14721475 -0.75143683 Cu 6.95053505 5.23492875 8.69432585 0.31875537 -0.42736714 0.79601725 Fe 0.02771706 6.93196950 6.97425317 -0.79309285 0.56564972 0.41361260 Cu 1.73931033 8.69560460 6.97220769 0.14112593 0.96676859 0.13007605 Fe 1.74066681 6.97708861 8.69165217 0.13103902 0.14923855 0.51362559 Ni 0.01061722 8.68250802 8.67230905 0.62815929 -0.83133978 -0.54191750 Fe 3.46931201 6.96102938 6.94598749 0.42391869 -0.11378428 0.42506935 Ni 5.22617332 8.69629536 6.94711272 -0.25118778 -0.58674312 0.18904195 Fe 5.23231086 6.94323064 8.67423812 -0.28409353 1.10596199 0.19735702 Ni 3.44529033 8.72372990 8.68078595 0.36428091 -0.97637040 -0.51525493 Cu 6.96960273 6.92368946 6.96898085 -0.30397832 0.46320998 -0.36152873 Cu 8.68112365 8.66645878 6.97709898 0.14680742 0.19493810 -0.28658535 Fe 8.68658506 6.97910840 8.69363074 0.07236300 -0.13976002 0.13616758 Ni 6.98468900 8.67781930 8.70078595 -0.65902904 -0.61178270 -0.46109512