108 Lattice="10.39614145254749 0.0 0.0 0.0 10.39614145254749 0.0 0.0 0.0 10.39614145254749" Properties=species:S:1:pos:R:3:forces:R:3 energy=-399.1540458113288 stress="-0.007568690479054336 -1.372458810433091e-05 0.00022178667789452997 -1.372458810433091e-05 -0.007878758022179265 0.0015045162698580953 0.00022178667789452997 0.0015045162698580953 -0.00739091586470149" pbc="F F F" Ni 0.01872381 0.00958724 0.00897423 0.49269401 0.65393039 0.58616856 Ni 1.72645698 1.70912713 0.02682023 0.05255243 0.22386197 -0.63696419 Ni 1.69650801 0.00417488 1.69297755 0.12195580 -0.57693075 0.26268650 Ni 0.00248438 1.74977319 1.74463668 -0.65978069 -0.27772595 -0.27363533 Ni 3.48697118 0.00491646 0.01419570 -0.27945370 0.10979319 0.05561577 Ni 5.20920576 1.69960951 0.01747231 -0.11247822 0.29422684 -0.82785975 Ni 5.17652834 0.01461279 1.70152774 0.33387299 -0.78844705 0.28851003 Ni 3.46738908 1.71551160 1.75082120 -0.26206890 0.18349016 -0.32286464 Ni 6.91989002 0.00682913 0.01085492 0.11813928 0.21875454 0.30153272 Ni 8.64151316 1.71652421 0.03059612 -0.09623550 -0.15840078 0.10183234 Ni 8.64874325 0.01896293 1.72450947 -0.48171112 0.30732386 0.11461643 Ni 6.90948783 1.75690682 1.70842652 0.15063741 -0.56281495 0.59370585 Ni 0.01219526 3.46925304 0.00928686 0.33845417 0.01861880 0.27077503 Ni 1.76158132 5.23335559 0.03022469 -0.37007153 -0.44727188 -0.64823618 Ni 1.72409217 3.44616735 1.75313819 0.15800132 0.30815304 -0.46321209 Ni 0.00654064 5.21545539 1.73574893 -0.45711060 -0.04286058 -0.10133317 Ni 3.49093171 3.49552382 0.03194065 -0.46272218 -0.54748707 -0.69235915 Ni 5.18334542 5.17655534 0.01956889 0.29470007 0.19401327 -0.56117119 Ni 5.17365733 3.43086996 1.73044866 0.47911122 0.29078640 0.34399497 Ni 3.47651612 5.16373983 1.75646936 -0.11240537 0.48810180 0.28285181 Ni 6.97328575 3.43528520 0.03339009 -0.44850375 0.24035342 -0.90364162 Ni 8.61922783 5.22557061 0.02785126 0.13295765 -0.04047285 -0.03808541 Ni 8.63070848 3.43447058 1.72210320 0.78797970 0.30158482 0.20129501 Ni 6.93690792 5.21838792 1.70160103 -0.30843706 -0.21422089 0.81725339 Ni 0.00967821 6.91909645 0.01168228 0.37588379 0.13165265 0.35267558 Ni 1.71930225 8.67285985 0.02759175 0.11968656 -0.43337636 0.33543165 Ni 1.76538619 6.91719989 1.70975766 -0.33785700 0.16916235 0.35179943 Ni 0.03112994 8.67077242 1.71723027 0.17131036 -0.44137258 -0.07780777 Ni 3.44872400 6.91486243 0.02148105 0.35693895 0.43411428 -0.61270957 Ni 5.26151272 8.67550924 0.01552944 -0.25530440 -0.26493137 0.18226365 Ni 5.19202738 6.94850529 1.73201928 0.04949764 -0.45014398 0.20709915 Ni 3.49500387 8.66090398 1.74969203 -0.29978276 0.62265416 -0.38884660 Ni 6.91122788 6.92053398 0.02679202 0.23414069 0.42463761 -0.60916614 Ni 8.69226438 8.63456632 0.03421917 -0.86831451 -0.67238759 0.69042362 Ni 8.68645583 6.94622101 1.72021614 0.28382146 0.12029046 0.23006520 Ni 6.90532156 8.67872676 1.76547401 0.53246945 0.39711530 -0.28934309 Ni 0.00734905 0.02343096 3.46452577 0.26961827 0.21009964 -0.07050568 Ni 1.75479959 1.75860363 3.43618235 -0.10182669 -0.46949463 0.30592859 Ni 1.72918295 0.03076367 5.20394583 -0.03574970 -0.71377436 -0.19867787 Ni 0.01548450 1.71787832 5.20869172 -0.70288640 0.11060208 -0.21261550 Ni 3.45313880 0.00625357 3.45733779 -0.18261406 -0.69576620 -0.06921381 Ni 5.16960000 1.71434582 3.44477336 0.27504993 0.52832025 0.28968233 Ni 5.19647653 0.03385680 5.18590044 0.06660028 -0.83520893 0.14443589 Ni 3.47917855 1.70224240 5.21872289 -0.12092380 0.66984803 -0.21331709 Ni 6.90057633 0.01686195 3.48971453 0.42920894 -0.37930077 -0.36732706 Ni 8.69594958 1.73870365 3.43755529 0.21360601 -0.33988230 0.01987669 Ni 8.65908841 0.02090791 5.23362142 -0.19141444 0.20590804 -0.17395254 Ni 6.95475255 1.74329201 5.19984714 -0.20260765 -0.09709520 -0.17595500 Ni 0.02771103 3.45428884 3.44856035 -0.79650689 0.10261243 0.31940010 Ni 1.70567986 5.18719218 3.49476231 0.40727499 0.21367854 -0.37928520 Ni 1.75604856 3.43597795 5.18609939 0.09274631 0.18589620 0.15805540 Ni 0.03239838 5.22721161 5.23665437 -0.70324193 -0.25327772 -0.24619790 Ni 3.44083424 3.47819274 3.44691743 0.36500301 -0.25073748 0.43517772 Ni 5.19435077 5.16789555 3.49222561 0.22755584 0.38794392 -0.39021127 Ni 5.21272947 3.47726347 5.22778024 -0.19860473 -0.26240336 -0.38461495 Ni 3.46734498 5.20462454 5.19283158 -0.08380156 -0.01380717 -0.14606043 Ni 6.92044789 3.44758653 3.49153129 -0.13811834 0.04108835 -0.33353049 Ni 8.65093009 5.16892142 3.49277927 0.50829260 0.16035093 -0.38829866 Ni 8.69534509 3.40800724 5.19501488 0.39316217 0.29280086 0.18196544 Ni 6.95567928 5.22371415 5.18724829 -0.12241247 -0.32299754 0.22012777 Ni 0.01405888 6.94676926 3.46620284 -0.63528602 -0.02705244 -0.15568784 Ni 1.69214882 8.64055797 3.42829648 0.29479835 0.64388507 0.21406149 Ni 1.71962244 6.91036681 5.19485384 0.41198743 0.47097754 0.19453650 Ni 0.01963831 8.66887858 5.20770522 0.23745701 -0.29064323 0.10823477 Ni 3.44686265 6.94586076 3.46076805 0.15143397 -0.44504974 0.15921349 Ni 5.18574782 8.65591160 3.45225367 0.25675094 0.49314841 0.30896497 Ni 5.23262594 6.90258434 5.22447902 -0.44252113 0.32524898 -0.34716566 Ni 3.49382534 8.69014768 5.17237260 -0.34289907 0.07554657 0.39391923 Ni 6.94758577 6.95531157 3.47296024 -0.15321859 -0.38139102 -0.24930249 Ni 8.65184153 8.66349935 3.49502236 -0.14773000 -0.14030546 -0.19686800 Ni 8.69785803 6.93928360 5.19150756 0.45442062 0.14622838 0.14543437 Ni 6.93434000 8.64201229 5.22385714 0.07861790 0.63926256 -0.08811834 Ni 0.02601527 0.00193753 6.90891002 0.33994102 0.32031740 0.33156448 Ni 1.70268709 1.74083329 6.90192283 0.30657318 0.06862836 0.71219230 Ni 1.77666102 0.01390003 8.67583067 -0.20964138 0.43440074 -0.49208635 Ni 0.02923924 1.70450861 8.69549843 0.53648693 0.10495761 -0.67972543 Ni 3.44712568 0.00709909 6.92522618 0.15774488 -0.43762744 0.39069909 Ni 5.23270038 1.70902769 6.90323859 -0.47329712 0.26919952 0.44748521 Ni 5.23042029 0.00919512 8.68394282 -0.18521187 0.35842803 -0.39439422 Ni 3.44824360 1.75971006 8.67828429 0.24662138 -0.19123272 0.12834015 Ni 6.92688421 0.00583420 6.92922820 0.23274299 -0.62422859 0.26929868 Ni 8.64137218 1.72303727 6.94522747 0.63275034 -0.09467985 0.35927251 Ni 8.67119751 0.00982356 8.69696298 -0.91081463 0.83891829 -0.86018598 Ni 6.90170150 1.76435872 8.63444002 0.48225324 -0.27732868 0.73714809 Ni 0.01570664 3.49440595 6.89767282 -0.45058760 -0.23286045 0.53546650 Ni 1.78770044 5.17834563 6.93526160 -0.38392696 0.06122969 0.07940657 Ni 1.73951752 3.47501960 8.68058137 -0.19651643 -0.13983615 0.26939448 Ni 0.02595429 5.21292593 8.68493901 0.17629485 -0.12876744 -0.35062205 Ni 3.49223611 3.47686171 6.92427865 -0.09710406 -0.35853951 0.07560569 Ni 5.18498527 5.23189198 6.89997506 0.39188138 -0.26025254 0.34375225 Ni 5.22369155 3.49967259 8.68323010 -0.26235236 -0.29857574 0.23843424 Ni 3.49303139 5.20564998 8.68287283 -0.12532225 0.05674115 0.53755602 Ni 6.91654489 3.45126273 6.91940733 0.26829703 0.47886023 0.03559140 Ni 8.67407870 5.20801458 6.90346516 0.32089716 -0.05567272 0.31199680 Ni 8.69631472 3.49869588 8.64359431 -0.44322162 -0.13917937 -0.35280007 Ni 6.91571004 5.18180862 8.68964844 0.40268374 0.24789743 0.11866084 Ni 0.01335206 6.91411189 6.94131418 -0.52012390 0.21018163 0.18570153 Ni 1.71284534 8.63631141 6.96595407 0.19814981 0.48594233 -0.10054994 Ni 1.69806792 6.92011967 8.68129741 0.20470282 0.15104982 0.49777626 Ni 0.00639875 8.65399851 8.66847524 0.62663952 -0.70274908 -0.66926346 Ni 3.44105443 6.89877389 6.94929028 0.14105377 0.62049385 -0.19774551 Ni 5.22991812 8.64549370 6.95153064 -0.38484352 0.50416640 -0.08714675 Ni 5.22885921 6.94807970 8.65608319 -0.12476193 -0.14926480 0.53788254 Ni 3.47633226 8.64275217 8.69010120 -0.12541155 -0.35627132 -0.39706134 Ni 6.95775561 6.93528165 6.93129700 0.23002325 -0.15488945 0.19944995 Ni 8.67239126 8.69264981 6.92334138 -0.45635042 -0.56922996 0.10272502 Ni 8.65025079 6.94834556 8.67918249 -0.42319537 -0.10426581 -0.56030323 Ni 6.92302242 8.63670668 8.65291182 0.27315692 -0.13499479 -0.23898606