64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=66.14077026048682 stress="-273.39660389120695 -7.616463088793694 -114.32452722669998 -7.616463088793694 -288.3197810407824 34.56590794066892 -114.32452722669998 34.56590794066892 -279.4825771793834" pbc="F F F" Ni 0.22086729 -0.01689004 -0.22903346 -3.47977732 -2.23342117 -2.94135409 Ni 1.59933616 0.93572417 0.98055861 -6.03778868 -19.83284372 16.83230475 Ni 2.14715992 2.22516294 0.23402360 -1.39303824 8.06682206 -26.36880596 Ni 2.93229823 3.31172061 1.19084223 5.48156644 19.40658621 7.57074161 Ni 2.29465675 0.14771729 3.20399864 -9.19331077 -2.66505487 -3.56571029 Ni 3.85840215 0.76443239 4.02546443 8.35332830 7.01898584 -0.30006442 Ni -0.04422626 2.79563377 2.93187189 -0.26921659 -1.32806309 -1.24930521 Ni 1.55604684 4.07636534 3.99475015 -19.99421775 50.57940271 -28.82845251 Ni 5.78248547 0.50979054 0.01871475 -1.72009872 -1.04270700 -4.02321236 Ni 6.20935311 1.04524550 2.00114475 -5.63891776 5.17764530 1.88378630 Ni 7.56413860 2.40080582 -0.13579737 -6.31348005 -5.71679135 -4.61198705 Ni 8.67982227 3.56376137 0.86736005 5.89846296 5.42298370 5.40810710 Ni 7.81964364 0.29825864 2.75344230 4.32216287 -6.14958202 0.62080091 Ni 8.94092265 1.58905321 3.94859689 19.05801767 -2.94613206 -14.72870361 Ni 4.13852573 2.20608632 2.20242380 4.35672160 -3.06393505 4.14072819 Ni 5.75858622 3.88988228 3.51999491 0.79152890 -1.59232844 -0.90242152 Ni 0.10340100 5.31298788 0.02164361 -2.71261373 -2.27245474 -1.79806720 Ni 1.63900191 6.14262195 1.24085714 -8.98242204 -16.59451442 26.81212753 Ni 2.21949456 6.99713164 0.09651729 12.04760830 16.83406810 -24.74885269 Ni 3.61643991 8.32327578 1.40123177 -34.53716885 21.92836978 -22.40807370 Ni 2.95366604 4.88968876 2.71888199 -10.95455491 -8.07013269 -8.62259338 Ni 4.18297782 5.79320854 3.39174556 15.97112407 10.61069804 8.94693398 Ni 0.34278350 7.83814538 2.63905551 -2.10723842 -9.72152335 -16.11526901 Ni 0.60366252 8.66349090 4.11824152 3.53826716 8.39301976 16.93710001 Ni 5.26176311 5.27927672 -0.22400553 -1.65789834 -0.74130585 0.04513083 Ni 6.60365422 6.12475624 1.46651109 -11.22280005 13.41046715 -8.83795580 Ni 6.67119966 8.29253646 -0.21778446 -1.99340203 -0.71063693 -0.27524476 Ni 8.57559210 8.55058575 1.17451505 0.62248183 -0.62318211 1.68012449 Ni 7.58087455 5.09122498 2.35935114 10.18912433 -12.70888151 10.69201942 Ni 8.97462727 6.11272182 3.87984742 0.77791282 0.14516067 1.33439837 Ni 4.66448343 7.68403127 2.11226018 34.42436924 -21.73425860 21.99911317 Ni 5.97555741 8.31914392 3.89352680 -16.74537494 5.84269377 -8.69763010 Ni -0.22954640 0.28866239 4.68786656 -0.62505604 -0.08720880 -2.14537116 Ni 1.11803101 1.09305905 6.30199494 -12.63763625 10.56192927 -7.40728039 Ni 2.00297454 2.99791377 4.62151619 20.60185000 -54.24520476 26.47128921 Ni 3.07353166 3.51894432 6.34725891 -4.66282343 -4.80841518 5.47322065 Ni 2.43970136 0.30962604 7.02044147 9.49556152 -7.72327242 9.77544075 Ni 4.08450338 0.75571598 8.58475277 -8.08371140 -22.32950118 15.72433293 Ni -0.00344088 2.96978731 7.51668654 -6.93288920 -5.13249646 -6.94652581 Ni 1.22422232 3.91950201 8.54655608 -6.72263066 -7.59001689 14.14783035 Ni 4.08532250 0.00206044 5.83625574 5.39344996 -2.96067550 3.35123371 Ni 6.48837336 1.00831489 6.43404765 -20.83802480 29.31866365 -14.22661796 Ni 7.84911873 2.01595790 5.07449325 -19.59891621 1.38579996 10.11836273 Ni 8.60556472 3.49425818 6.03735392 2.59960203 7.75135803 4.70183617 Ni 7.20384740 -0.14918067 7.03810700 17.93398495 -29.73998640 15.17492402 Ni 8.75567948 0.58042468 9.03850275 -0.26866692 0.41904139 -0.27866735 Ni 4.60939942 2.00409575 7.77385137 8.90185264 23.35502226 -15.75028888 Ni 5.88981588 3.99050463 8.64455433 0.48795838 -0.26606967 -1.19100997 Ni 0.03346674 4.71662307 5.34902654 -4.96234932 -2.66485819 0.37099165 Ni 1.12753280 6.21395641 6.27609686 3.03221664 3.00837761 1.12294787 Ni 2.82350393 7.21827495 4.80335328 -8.31165499 -11.82949990 -12.07992817 Ni 3.63834321 8.28337470 5.87827378 8.26407615 11.00204150 11.03392321 Ni 2.36102597 4.94186987 7.87644269 15.28495051 14.85530562 -6.81107290 Ni 4.67171808 6.11056424 8.96640764 -1.50947911 -0.60439948 1.66781120 Ni -0.14980647 7.97085593 7.41342367 -5.52174786 -1.32432578 -4.32866876 Ni 1.40009545 8.42893138 8.60183795 6.13053016 0.84980553 3.46505343 Ni 4.60146438 4.30457994 5.50975364 5.73902424 3.04304282 -2.58192832 Ni 5.89974943 6.22892384 6.12165250 10.71969977 -26.52166330 -36.35926593 Ni 7.34497277 7.80178516 4.71375535 16.44384116 -6.57101721 10.36347671 Ni 8.84947997 8.91585207 6.75724536 -0.82880336 -0.88008879 0.12295148 Ni 7.43376557 5.85345170 7.38498733 3.03976351 -3.31311846 -0.07747931 Ni 8.66153064 6.54291660 8.96495890 1.91658300 1.65912977 2.84877052 Ni 5.39757659 7.11536967 7.13716159 -15.60281610 28.69615356 28.62867576 Ni 5.86157597 9.04079721 8.69789396 0.24290368 -0.40300673 -0.25868040