108 Lattice="10.439340123996056 0.0 0.0 0.0 10.439340123996056 0.0 0.0 0.0 10.439340123996056" Properties=species:S:1:pos:R:3:forces:R:3 energy=-407.7206962008425 stress="-0.009913146128331426 -0.0001990230357174504 0.00015591810081159335 -0.0001990230357174504 -0.009463149192855135 0.00026981754639633513 0.00015591810081159335 0.00026981754639633513 -0.009700731378838581" free_energy=-407.7206962008425 pbc="F F F" Ni 0.01401930 0.01818608 0.03070702 0.35139750 0.38995465 0.38634186 Ni 1.71456415 1.75306815 0.00567973 0.17542779 -0.18437997 -0.24014919 Ni 1.72010461 0.01294518 1.75122401 0.47900367 -0.43999894 -0.20155867 Ni 0.03020240 1.72598929 1.77253359 -0.63902612 0.26568571 -0.24719614 Ni 3.48554622 0.01138702 0.01228595 -0.21269024 0.16811922 0.03008953 Ni 5.23497012 1.74628106 0.02855350 -0.12523454 -0.03315284 -0.71831109 Ni 5.19511180 0.02813100 1.72224741 0.15731614 -0.65444547 0.39871860 Ni 3.50415736 1.74785430 1.72043930 -0.75405069 0.07405681 0.42163915 Ni 6.94567979 0.01302102 0.05404074 0.14110638 0.04647638 -0.12080658 Ni 8.71524670 1.75653858 0.01319460 -0.23281443 -0.09047132 0.08104091 Ni 8.71196339 0.01031801 1.70791963 -0.17963681 0.18653035 0.14581915 Ni 6.97054715 1.73487182 1.71990732 0.02636975 -0.03974223 0.41177218 Ni 0.02211878 3.46963213 0.03184146 0.03115035 0.08153591 0.04684484 Ni 1.76779532 5.23625492 0.02042367 -0.28527713 -0.26812606 -0.67190377 Ni 1.71512285 3.50237582 1.78606744 0.54433770 -0.69229903 -0.32795811 Ni 0.02964249 5.20422638 1.74396070 -0.73750791 0.28019827 -0.19114454 Ni 3.46949718 3.44518650 0.01487957 0.08440003 0.24961422 -0.39650869 Ni 5.21357020 5.24606227 0.00199252 0.06065659 -0.52227952 -0.13893400 Ni 5.25032772 3.47130028 1.76569165 -0.25991956 0.44139703 -0.12768086 Ni 3.44961093 5.19082733 1.71671718 0.59439602 0.18134120 0.71358202 Ni 6.94373944 3.45374666 0.00121267 0.23935427 0.44586564 -0.36771120 Ni 8.72800236 5.22873272 0.02573336 -0.31995272 -0.14994708 0.10922185 Ni 8.68346772 3.45559388 1.74363580 0.58683317 0.09671636 -0.12240849 Ni 6.99087207 5.21309463 1.76476525 -0.42475513 0.12503750 -0.28155931 Ni 0.00454248 6.93910512 0.00698492 0.23069366 0.14745065 0.21219462 Ni 1.73125636 8.73355834 0.01031617 0.08648105 -0.45881043 0.26428050 Ni 1.73121887 6.96602840 1.70922285 0.13545914 0.16336936 0.36106850 Ni 0.00493738 8.70856290 1.72906356 0.31070473 -0.30600574 0.06907902 Ni 3.50658160 6.94415122 0.02075277 -0.24074721 0.51263893 -0.47852599 Ni 5.23771827 8.70844041 0.00604375 -0.13563725 -0.14917198 0.17634163 Ni 5.20772697 6.99054405 1.74284286 0.15498123 -0.45660460 0.17421022 Ni 3.45627073 8.69222143 1.77262782 0.15255990 0.45645685 -0.40425050 Ni 6.93016668 6.93167085 0.02266867 0.34791600 0.22716634 -0.34741207 Ni 8.66544496 8.67026460 0.00638615 -0.40200950 -0.42030027 0.31783606 Ni 8.72160910 6.95974726 1.71954413 0.09825929 0.14775766 0.34663507 Ni 6.96776323 8.72922540 1.72017631 0.10946733 0.08227439 0.16087681 Ni 0.02158165 0.01355374 3.45027755 -0.13511880 -0.09406629 0.37461507 Ni 1.72857991 1.71269152 3.50778330 0.46195967 0.68344158 -0.17101578 Ni 1.76921275 0.01966251 5.19722840 -0.32466714 -0.45394049 0.40930897 Ni 0.01241472 1.76837125 5.23904649 -0.39642770 -0.28461714 -0.17505224 Ni 3.47409962 0.00660911 3.51392801 0.11233003 -0.31915512 -0.41474411 Ni 5.18874108 1.75371154 3.45087696 0.52567905 -0.09759968 0.19537165 Ni 5.24680788 0.03366664 5.18695112 -0.07399893 -0.49758273 0.36315443 Ni 3.51344806 1.77137927 5.23926198 -0.34718634 -0.31028782 -0.22471298 Ni 6.97322459 0.03214888 3.48074413 -0.06748429 -0.56517995 -0.35883245 Ni 8.70705963 1.70665430 3.48064343 0.57551522 0.13629759 -0.15351743 Ni 8.68290011 0.02589332 5.26328761 0.07326212 -0.15901334 -0.15700148 Ni 6.98650142 1.73781947 5.18711942 -0.44672315 0.17830362 0.38749125 Ni 0.00387539 3.50046398 3.48369941 -0.51779631 -0.38038307 0.14168449 Ni 1.71840911 5.20743691 3.46251011 0.77961146 0.29908621 0.35224642 Ni 1.75410905 3.49300483 5.24461866 0.13913613 -0.09136423 -0.45061637 Ni 0.01327744 5.21358483 5.19317353 -0.52841043 0.04264617 0.33202024 Ni 3.49146071 3.46724634 3.51323284 -0.29769791 0.30148759 -0.35369293 Ni 5.23560843 5.22448782 3.50435765 -0.29770336 -0.11433600 -0.62578949 Ni 5.24347287 3.46013200 5.20147800 0.13457661 0.26081389 0.22104364 Ni 3.51309322 5.25254599 5.22381541 -0.31408937 -0.34895685 -0.14718253 Ni 6.99280000 3.46545732 3.46783955 -0.47494010 -0.19047004 0.13584523 Ni 8.67437398 5.18701240 3.49659188 0.67865279 0.33793721 -0.18564813 Ni 8.70366818 3.46468349 5.21597723 0.45717125 0.20885904 -0.04233919 Ni 6.93633103 5.22187492 5.18615732 0.18065050 -0.25973701 0.47635358 Ni 0.02793923 6.95579350 3.46631046 -0.55650177 0.25899103 -0.14334838 Ni 1.76251252 8.71481747 3.49017728 -0.20134330 0.27523876 -0.13228956 Ni 1.70744006 6.95820463 5.19052095 0.55481521 -0.27283610 0.22379881 Ni 0.05077389 8.71123278 5.22276963 -0.19925913 -0.03404446 -0.12440250 Ni 3.49211095 6.96187902 3.48784294 -0.15106282 -0.30141660 -0.10171915 Ni 5.23648309 8.69756928 3.47230227 -0.10127248 0.38302348 0.24424945 Ni 5.25368868 6.93550152 5.25410042 -0.40611371 0.49516278 -0.37183169 Ni 3.47789141 8.66596689 5.25129115 0.22661782 0.39196453 -0.16608989 Ni 6.93976226 6.95834106 3.48713031 0.29263778 0.18736187 -0.40529359 Ni 8.68572098 8.71295194 3.49379952 -0.12168468 -0.25549825 -0.25463999 Ni 8.68228862 6.94664235 5.19599522 0.42157558 0.23157969 0.07858788 Ni 6.98775816 8.70788410 5.20684079 -0.17568666 0.40182414 0.21239912 Ni 0.02438705 0.01914092 6.95851599 0.20597638 0.14401950 -0.18923697 Ni 1.76580517 1.75008529 6.95123898 -0.16812543 0.12605102 0.04449802 Ni 1.77022898 0.01027434 8.64209418 -0.18795518 0.03631617 0.19833714 Ni 0.02149123 1.71312021 8.68040040 0.23586316 0.16009490 -0.16812811 Ni 3.45876770 0.02406533 6.97536432 0.43992854 -0.58755933 -0.44908259 Ni 5.21850428 1.72559803 6.94308550 0.37615538 0.23073175 0.13569339 Ni 5.18555451 0.02713402 8.72175193 0.16110845 -0.07181046 -0.20667738 Ni 3.49549470 1.73296002 8.69186058 -0.03474087 0.37445008 0.43517477 Ni 6.99092503 0.00217111 6.99000588 -0.22896833 -0.32100774 -0.04516533 Ni 8.70580015 1.76578288 6.92547356 0.32358367 -0.21450004 0.55863927 Ni 8.73021743 0.01609906 8.69599355 -0.54053933 0.65996882 -0.58362130 Ni 6.92916643 1.72110735 8.67701443 0.41177428 0.22491420 0.35986839 Ni 0.01337518 3.46548823 6.95479826 -0.35708686 0.21899889 0.30292858 Ni 1.76025178 5.19775560 6.93663203 -0.13222944 0.31566778 0.25161190 Ni 1.75686210 3.47432885 8.71955244 -0.13122522 -0.07802372 0.10387853 Ni 0.02838651 5.23618594 8.70095104 0.09844765 -0.18708138 -0.25048973 Ni 3.50941582 3.47783526 6.93579350 -0.07867691 0.13654087 0.29229868 Ni 5.21533860 5.21958774 6.99393866 0.24433664 -0.05373820 -0.27423564 Ni 5.22784781 3.51170676 8.70463600 0.09927112 -0.29747043 0.26796903 Ni 3.46049002 5.20990863 8.70927820 0.09476834 0.25085082 0.30739209 Ni 6.98711886 3.50130537 6.94096963 -0.33063010 -0.13731945 0.24089709 Ni 8.67983473 5.26242685 6.93202054 0.36594284 -0.24419794 0.20462485 Ni 8.72753578 3.45314276 8.69873742 -0.40872711 0.09530414 -0.34667997 Ni 6.98953640 5.24772051 8.71299494 -0.02041822 -0.19144182 0.18231508 Ni 0.01221323 6.96378566 6.95037897 -0.44086265 -0.09663958 0.13150659 Ni 1.72537219 8.66619580 6.93928731 0.23906825 0.45582126 0.43240297 Ni 1.71181637 6.95331124 8.71083645 0.16636877 0.13886912 0.17676934 Ni 0.02690970 8.73327789 8.68593278 0.48380793 -0.56308968 -0.52177469 Ni 3.48850135 6.94412580 6.95541389 -0.14574387 0.12361693 0.30618367 Ni 5.24464969 8.70560795 6.99198283 -0.47564109 0.46444235 -0.42146258 Ni 5.25183920 6.99350587 8.71236454 -0.42383624 -0.51252125 0.37136181 Ni 3.47057902 8.66669264 8.72383992 -0.10453382 -0.16737111 -0.32481277 Ni 6.92575696 6.97641637 6.92518735 0.56834913 -0.36491131 0.17504103 Ni 8.71789833 8.68589144 6.98116988 -0.21140068 -0.25749531 -0.35886386 Ni 8.67039510 6.98478674 8.68359380 0.04015029 -0.20045274 -0.13763976 Ni 6.95637826 8.65241551 8.64176896 0.23840525 0.44253093 0.36649475