256 Lattice="15.289442979975371 0.0 0.0 0.0 15.289442979975371 0.0 0.0 0.0 15.289442979975371" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1351.2813539644221 stress="-0.005252959421604055 0.00020595563504013936 0.001066953312713165 0.00020595563504013936 -0.009483943871991338 -0.00011805703280692921 0.001066953312713165 -0.00011805703280692921 -0.008709946664209028" free_energy=-1351.2813539644221 pbc="F F F" Nb 0.03459361 0.00356515 0.00942841 0.34416036 0.06295604 -0.43740917 Ni 1.90360253 1.92583618 0.00574130 0.06369577 0.47754476 0.51025578 Nb 1.92515285 0.03381155 1.87626430 0.77305141 -0.67446553 1.18901624 Nb 0.03518755 1.91700227 1.86047372 -0.61037236 1.69952761 0.32443412 Nb 3.75148384 0.02109126 0.04694707 -0.00235752 0.32978975 -0.17483496 Nb 5.72584868 1.85332368 0.00969900 1.32121616 -0.19355757 -0.03226977 Ni 5.66667516 0.03817089 1.87889372 0.37234579 0.48884739 0.41432419 Ni 3.85399457 1.93930676 1.92446985 -0.83294621 -0.28576988 -0.01194362 Ni 7.62754593 0.02424120 0.01387841 -0.15731218 0.56447879 0.78776448 Nb 9.59094387 1.89345804 0.01703415 -0.84698322 0.26125728 -1.56837362 Nb 9.58770518 0.00823210 1.91007311 -0.88989938 -0.66102169 0.97787698 Ni 7.63735536 1.94878645 1.90775983 0.11215718 -0.63685526 0.16114183 Ni 11.42725717 0.00783488 0.06734802 0.27022197 -0.00606827 -0.06152197 Nb 13.31588997 1.92282766 0.03610085 0.09217994 -0.10386055 -1.23868007 Nb 13.31645369 0.01060646 1.96989848 0.11213637 -1.23991534 0.13281333 Nb 11.47571537 1.89334991 1.88909235 -0.96129917 0.40205173 1.28450882 Ni 0.01364175 3.87706862 0.01067252 1.23424827 -0.11435492 0.97737505 Ni 1.92686628 5.74586582 0.02005257 -0.42817960 0.29908040 0.88708013 Ni 1.94619757 3.82491459 1.92628531 -0.50276367 -0.25016485 -0.43120848 Ni 0.00663887 5.80069735 1.93252387 0.80134184 -0.36285789 -0.59738322 Nb 3.82165072 3.81466310 0.01514033 -2.03347228 -0.96297738 -0.67103317 Nb 5.69582043 5.75639246 0.03309242 1.67166070 1.06565299 -0.66950203 Nb 5.70473529 3.79075503 1.91968085 1.55906749 0.34460915 1.23992881 Nb 3.78781651 5.76419372 1.94390781 -0.51915799 0.26224382 -0.18562842 Ni 7.66714201 3.76224305 0.00381386 -0.27152327 0.21244794 0.38742022 Nb 9.55453430 5.77215251 0.04244849 -0.85096754 -0.32454122 0.04967534 Nb 9.54284320 3.82110140 1.90740620 -0.60651778 0.59981657 1.50536976 Ni 7.61125869 5.67474353 1.93104642 0.06829484 0.34101808 0.06507167 Ni 11.46205944 3.78580917 0.02893501 0.16879581 0.85311325 0.13392391 Ni 13.37886643 5.73802068 0.04770443 -0.91458192 -0.35346997 0.38302969 Nb 13.34870958 3.83142576 1.87575851 -0.01147226 2.10212092 0.38208516 Ni 11.44122809 5.78125444 1.97686958 0.27755207 -0.29655759 0.11718198 Ni 0.00427054 7.65230630 0.00887929 0.85924312 -0.32396726 0.91050806 Nb 1.89320743 9.56881514 0.02464507 0.40300683 -1.17496313 -0.63090618 Ni 1.91261467 7.68352092 1.90878095 -0.12086772 -0.37817703 -0.93484833 Nb 0.01716076 9.54270306 1.88876829 -1.71535258 -0.63984330 -1.11807326 Ni 3.81920840 7.66659189 0.03643379 -0.01362876 0.34821023 0.76419696 Ni 5.73243519 9.60931363 0.02401207 -0.12028670 -0.45076502 0.93451031 Ni 5.76927835 7.67188212 1.88057240 0.01122333 0.36239996 -0.15394538 Ni 3.85448052 9.60590235 1.95701115 0.50403739 -0.35228516 -0.43459468 Ni 7.61375817 7.70063106 0.01896892 0.16791320 0.27047004 1.05951617 Ni 9.56192689 9.49334557 0.02215743 -0.34008811 0.23672619 0.89564738 Ni 9.55972925 7.60451908 1.92233956 -0.27666373 -0.02941565 -0.02156554 Ni 7.59021545 9.58930499 1.93716228 0.16200677 -0.04755153 -0.52552670 Nb 11.44264265 7.64066970 0.02346794 0.16272049 -0.08497979 -0.60188086 Ni 13.36159274 9.56516879 0.02811192 -0.25120431 0.29495435 0.17900953 Nb 13.36475944 7.61039231 1.88552734 0.64898480 -1.06330716 0.79074435 Nb 11.48740166 9.58457574 1.90017828 -1.62015015 -0.32559612 -0.84844793 Ni 0.03133421 11.49261728 0.01809297 0.28318935 0.19116876 0.43425291 Nb 1.94372149 13.37749672 0.00907207 -1.07164617 0.53447418 -0.46613762 Nb 1.93631008 11.48848470 1.91395803 -0.04537168 -0.24210932 0.18100078 Ni 0.04339802 13.40244131 1.87318987 0.30464453 -0.45739688 0.01500471 Nb 3.82341723 11.49203371 0.02031695 2.06785959 -0.95125964 -0.86503523 Ni 5.73530676 13.38248217 0.02242731 0.03124532 -0.59330346 0.66823558 Ni 5.74156410 11.45155705 1.93995521 0.07730026 0.20934013 0.14825175 Nb 3.85322547 13.38031901 1.89970105 2.01550257 0.83313045 0.94529058 Nb 7.65770530 11.51986342 0.03032065 -0.09004322 -0.32553461 0.71165646 Ni 9.59772784 13.34190885 0.00439257 0.40617987 -0.84036457 1.16591204 Ni 9.55416563 11.50116440 1.92563706 -0.04903305 0.15161047 -0.56131382 Ni 7.65313962 13.35716764 1.88387362 -0.27160975 -0.71116310 0.25792401 Ni 11.49971397 11.43410547 0.03491549 -0.65189648 0.24048849 0.49066715 Nb 13.39447331 13.33135507 0.00948014 -0.94239892 -0.26036214 0.23500759 Nb 13.34368086 11.48819749 1.90033259 0.83493097 0.65131395 -0.24692344 Ni 11.46577168 13.39637263 1.91227275 -0.08331139 -0.73087389 -0.20083581 Ni 0.03419503 0.03893051 3.75079466 -0.03468153 -0.11458565 -0.16822314 Nb 1.87888233 1.87473130 3.86695167 2.19204603 2.17110434 -0.49225216 Nb 1.89264129 0.02202906 5.74348152 1.17489544 -1.51636336 0.14618320 Nb 0.00345965 1.87568061 5.67209709 -1.48708158 1.22657864 0.37872241 Ni 3.82178597 0.02704792 3.83437384 0.13565685 0.47565320 -0.30203171 Nb 5.70542656 1.92034539 3.78778264 -0.05607211 -0.12360595 0.24757736 Nb 5.75043360 0.02395003 5.77454897 -0.22671512 -0.71311432 -0.15742793 Ni 3.84426847 1.95055176 5.75990463 -0.33851728 -0.07223488 -0.48844741 Ni 7.67761108 0.02884237 3.85762937 -0.19325020 0.71108903 -0.47556506 Ni 9.56294811 1.87823573 3.80226437 -0.24005379 0.44789058 0.41600282 Nb 9.55455572 0.05036515 5.73177466 -0.00819973 -0.24002363 -0.77020809 Ni 7.60097528 1.90483651 5.69856765 0.51563302 0.46312021 -0.04944556 Ni 11.44300050 0.03957058 3.81130831 -0.03886799 0.26317216 0.42339016 Nb 13.34991619 1.91418450 3.83136722 0.15298626 0.91298541 1.31130067 Nb 13.37358559 0.02303064 5.77550226 -0.90304762 -0.61571941 -0.50538283 Ni 11.43571347 1.89921149 5.69314654 0.13165003 0.61877018 -0.14927340 Ni 0.05109627 3.86786700 3.86664213 0.23214135 -0.19386995 -0.54517441 Nb 1.84264241 5.72069848 3.82592382 0.10565520 -2.20515840 -1.50511710 Ni 1.90634334 3.85742020 5.78373689 -0.07917171 -0.43105979 -0.26249172 Nb 0.00479387 5.73349106 5.70017785 -0.88028805 -1.30480112 2.06957954 Ni 3.79422198 3.78127128 3.76130025 -0.04786435 0.05099430 0.69736484 Ni 5.71778674 5.73829028 3.78010226 0.20225627 -0.77850241 -0.12504788 Ni 5.75019804 3.76547102 5.73880572 0.09026706 0.26514585 -0.44423938 Nb 3.81193891 5.74999248 5.79494039 0.87282537 -1.93884752 0.00175000 Ni 7.66021965 3.77937321 3.85469242 0.13226301 0.12855790 -0.06670378 Ni 9.57987806 5.73584650 3.79959536 0.07125176 -0.26897759 -0.59554179 Ni 9.54458290 3.85692053 5.73859843 0.10825408 -1.02924076 -0.80033190 Nb 7.65765783 5.71502612 5.69644889 -1.19494380 -3.24023767 -0.92944391 Ni 11.44852495 3.82801927 3.78337646 -0.07450370 0.09434213 0.52889671 Ni 13.37621039 5.69738944 3.84648090 -0.72593063 -0.15112125 -0.24192266 Ni 13.35391074 3.84715745 5.71832640 -0.72849156 -0.03354193 0.02417874 Nb 11.44507608 5.73417761 5.72384766 0.90048372 -2.37295330 -1.78325956 Nb 0.01186173 7.64879033 3.82600238 -1.78754857 -0.33209976 -1.41912422 Nb 1.88811933 9.53395616 3.81523302 1.76825379 1.22021273 -0.94445418 Nb 1.94541313 7.66016624 5.75024428 -0.58350941 -1.12552824 2.38144931 Nb 0.03468118 9.57752720 5.74211249 -1.86942976 0.79770763 1.35729285 Nb 3.80579182 7.61391652 3.80628861 1.73113516 0.88724065 -2.29206578 Ni 5.74000589 9.57991571 3.77923191 0.25578362 0.53283241 -0.04577630 Nb 5.70302577 7.64690979 5.79509206 0.15172729 0.62516350 0.18626677 Nb 3.83896044 9.52282216 5.74559434 1.28028859 2.98918022 0.50972957 Nb 7.62548283 7.60150134 3.81588125 -0.94648467 0.00909180 -2.18651674 Nb 9.52901702 9.53711455 3.79334590 -0.37011165 1.04857145 -0.13672772 Nb 9.54566034 7.67879513 5.75644539 1.11323147 0.86789622 -2.59913376 Ni 7.68203497 9.53342971 5.74192740 -1.06598667 1.24466528 -0.63094974 Ni 11.46311146 7.62282240 3.83326230 0.04145935 -0.15463484 -0.54928008 Nb 13.39392411 9.60672720 3.84909015 0.71564722 -0.59535627 1.18979551 Nb 13.36369118 7.61463244 5.72203517 0.86572175 -0.51178893 -0.95658569 Ni 11.43020801 9.52245973 5.74337326 0.48768357 0.69170174 -0.61929264 Nb 0.00668879 11.44549544 3.79187895 -1.54432873 0.87738999 0.13915640 Nb 1.97310024 13.34955838 3.80895789 -0.47675003 0.82088729 0.08865399 Ni 1.85903758 11.49080505 5.74569012 0.58478440 -0.05096933 0.18537598 Nb 0.02519229 13.35014349 5.78583597 -0.59352334 -0.12966147 0.06682513 Ni 3.82586027 11.46824800 3.80753230 0.74420285 -0.16242677 0.09729276 Ni 5.75240220 13.35951637 3.85950512 0.04945916 -0.85262343 -0.47363548 Ni 5.72726045 11.50910034 5.79160951 0.03555203 -0.48660146 -0.55725266 Nb 3.81102149 13.34344855 5.69655329 1.24990280 -0.59494300 -0.01461554 Ni 7.58946750 11.47544833 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0.29254333 -0.18664354 0.57021167 Nb 1.90839690 13.37174075 7.61344504 0.39460048 -0.57862199 1.43417756 Ni 1.90650091 11.49387276 9.55678121 -0.05387505 0.03727169 0.56047874 Ni 0.02801329 13.39678010 9.56705454 0.89833551 -1.02537139 0.14952116 Ni 3.83688511 11.47622701 7.61993149 0.30200023 0.04863737 0.68167570 Ni 5.69117766 13.34918941 7.64078930 -0.33130301 -0.51869431 0.41781895 Ni 5.74632105 11.51662417 9.58201374 -1.26933990 -0.00940095 -0.50374401 Ni 3.78347873 13.38397563 9.59554877 0.14156634 -1.09003743 -0.08141598 Nb 7.61050369 11.42990111 7.67610552 -0.75395322 0.58563894 -0.93480977 Ni 9.54253085 13.39992318 7.62832879 0.32989708 -0.63903665 0.09704417 Ni 9.53376737 11.46398840 9.53093002 0.74034262 0.65371188 0.49453838 Nb 7.66354872 13.38828107 9.58941804 0.63585562 0.55013234 -1.01144943 Nb 11.47446135 11.46445911 7.68072776 -1.63868803 0.15086881 -0.29746577 Nb 13.39122638 13.34742044 7.59292300 0.56281608 0.28328299 0.24810876 Nb 13.35987391 11.45763449 9.57100935 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11.44378089 0.03312437 -1.68233481 0.82646412 Nb 13.34299550 1.86098273 11.47827055 1.44435349 0.41437494 0.60309406 Ni 13.39419629 0.00138900 13.37531749 -0.78119046 0.71447735 -0.62228877 Ni 11.49943833 1.95553678 13.41178908 0.17993683 -0.45865705 -0.09316372 Nb 0.00243991 3.79026557 11.46112104 -1.59191194 -0.67641100 -0.12042677 Nb 1.90380686 5.69891397 11.44989838 1.13825286 -0.74365792 1.61643365 Nb 1.90475045 3.83677342 13.35257958 1.17039982 -0.29993013 1.45019379 Ni 0.00782958 5.73156061 13.39330129 0.36100005 0.12235660 -0.39551176 Ni 3.81941745 3.78076326 11.49856669 -0.37582994 -0.35069821 -0.24796836 Nb 5.69661184 5.68650416 11.43457476 -0.92112241 0.15292015 1.59878773 Nb 5.75398377 3.80916487 13.34356611 -2.36432021 0.11856012 2.25822326 Ni 3.84985685 5.75021193 13.39270804 -0.19972403 0.13730430 -0.23239889 Nb 7.66613204 3.79672515 11.44054848 -1.39857847 -0.09674091 0.39156134 Nb 9.53711864 5.72306987 11.44230092 1.64752468 2.05179289 2.37144634 Nb 9.52016722 3.86515309 13.39850085 1.74785331 -0.35277321 2.80803633 Nb 7.68010709 5.76877731 13.39366121 -1.48621899 1.35820321 2.06824420 Nb 11.43548362 3.80193148 11.43806189 3.21281463 0.77170461 2.03305353 Ni 13.35764704 5.73639333 11.45243598 -0.49516043 0.04223307 0.13531350 Ni 13.34370487 3.79420781 13.35511306 -0.72289212 0.29758103 -0.61596411 Ni 11.49467386 5.68475252 13.39140331 0.50980766 0.25269874 -0.43445200 Nb 0.00986233 7.61470860 11.47474015 -0.46329413 1.54842329 1.27652685 Ni 1.91758859 9.56470609 11.52052892 -0.39049652 0.42474106 -0.30931084 Ni 1.90764541 7.59400973 13.40324782 -0.19011034 0.18752843 -0.50535401 Ni 0.03176447 9.62543010 13.37510839 0.81789862 -0.00965592 -0.84346498 Nb 3.84281245 7.66134079 11.43047186 -1.44724296 0.76335468 2.07464415 Nb 5.71969669 9.55748846 11.45468931 -1.01761167 0.48344611 -0.61267946 Ni 5.67590181 7.62729661 13.36343767 0.31552797 -0.15633262 -0.01035159 Nb 3.84482102 9.54370144 13.41071121 -0.79294761 -0.61543664 0.74563326 Ni 7.67219824 7.66344243 11.44090580 -0.28665695 0.79125412 1.34167222 Ni 9.59352023 9.61774670 11.49617222 0.50539390 -0.13709710 0.10436412 Nb 9.54800559 7.61821120 13.38247380 2.05535559 1.07115520 0.18138529 Nb 7.63422174 9.53349372 13.35025350 0.57250927 -0.91112091 0.95231953 Ni 11.45490360 7.65229915 11.45950681 0.82053078 0.53731882 0.58241550 Nb 13.36844188 9.57973520 11.49962202 0.08835872 -1.45457301 -0.95779425 Nb 13.37364884 7.66529188 13.38709362 -1.10831736 -0.49772766 -0.32453679 Ni 11.50223769 9.61132559 13.35366934 -0.55782510 -0.14923411 -0.25940589 Ni 0.00682568 11.46834224 11.42716078 0.99486644 -0.08761206 -0.05861584 Ni 1.85512795 13.34472822 11.49800858 0.39968153 -0.86285318 -0.44622042 Nb 1.90378448 11.45563836 13.40898626 0.24539932 0.07746244 -0.79616102 Nb 0.03125533 13.41563516 13.34155044 0.29160520 -0.47214574 -0.85991184 Ni 3.79943905 11.44823177 11.48674209 -0.35684708 0.50333546 -0.49595360 Nb 5.75804156 13.38566828 11.49306865 -1.54497957 0.40113432 -0.00540384 Nb 5.77015962 11.44836850 13.39736818 -0.97268927 1.50136195 1.46858856 Ni 3.79370499 13.38944563 13.41054284 -0.27814170 -0.82882554 -0.85144685 Nb 7.61029946 11.44144345 11.45132824 2.55063458 0.97414440 0.15344697 Ni 9.52789424 13.35516049 11.41837554 0.09929382 -0.64350627 0.48376539 Ni 9.53517641 11.40349501 13.38511310 0.11286126 0.37540366 -0.55069982 Ni 7.64387896 13.41127589 13.36886757 0.55323694 -0.73957365 -0.66770573 Nb 11.44409019 11.43101545 11.43208719 -2.16986885 0.27635160 -0.61192297 Ni 13.36217479 13.39560746 11.39912367 -0.55500590 -0.52674773 0.02895461 Nb 13.37791187 11.46628270 13.39708743 0.48094735 -0.12035759 0.18214837 Nb 11.47293672 13.35042263 13.40210768 -0.85981113 0.02076278 -0.59792330