256 Lattice="13.940471649169927 0.0 0.0 0.0 13.940471649169927 0.0 0.0 0.0 13.940471649169927" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1022.2476965527362 stress="-0.007531869526978402 0.0006551327497120132 -0.00036906418646188044 0.0006551327497120132 -0.007842006468404885 -0.0006729127427267638 -0.00036906418646188044 -0.0006729127427267638 -0.007666615383057305" free_energy=-1022.2476965527362 pbc="F F F" Ni 0.00842862 0.00131184 0.00146233 0.65042462 0.60593215 0.59222631 Ni 1.76220496 1.71985236 0.01436536 -0.36831346 0.15216450 -0.36107938 Ni 1.74355593 0.00550315 1.74632147 -0.00373295 -0.44232968 -0.08518889 Ni 0.02835139 1.69462738 1.75758873 -0.38412187 0.20169766 -0.45979800 Ni 3.45702563 0.01059435 0.02492585 0.17329778 0.04934776 0.02494792 Ni 5.26010431 1.72543968 0.02148290 -0.30983079 0.18605441 -0.37846368 Ni 5.18800381 0.01424612 1.74782204 0.19220227 -0.32269713 -0.11619491 Ni 3.47954870 1.75718866 1.70685912 -0.19695932 -0.17272993 0.29462583 Ni 6.95850398 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0.04081580 0.02723712 3.51243636 -0.13181945 -0.29132282 -0.11279586 Ni 1.72146901 1.72118560 3.49056001 0.71807417 0.28520964 -0.12937477 Ni 1.75691421 0.03307996 5.23833964 -0.14481797 -0.46094073 -0.05431715 Ni 0.01276615 1.73743275 5.19778332 -0.27128149 0.22802238 0.55139361 Ni 3.49293530 0.00815822 3.49735893 -0.15887125 -0.15981491 -0.09805332 Ni 5.19357056 1.77365509 3.45171150 0.17822113 -0.32282108 0.45108977 Ni 5.20439646 0.02072760 5.24458376 0.21295302 -0.35261779 -0.11380951 Ni 3.50207276 1.73766269 5.25639171 -0.26139373 0.44516429 -0.50768054 Ni 6.94469414 0.03212446 3.45376626 0.04447805 -0.30038239 0.24603397 Ni 8.68864930 1.76004944 3.50392139 0.05830891 -0.17282969 -0.36432277 Ni 8.72485976 0.02556527 5.22872853 -0.37833721 -0.29447265 0.15613864 Ni 6.92740417 1.71443134 5.26175984 0.33636679 0.14053589 -0.33298660 Ni 10.42439287 0.02741412 3.50817001 0.41207784 -0.23366884 -0.30877716 Ni 12.21584162 1.75168484 3.45107255 0.10969676 -0.34178790 0.34272141 Ni 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3.46034627 12.18958136 -0.19269112 0.18824497 0.29397651 Ni 6.97573749 5.18051037 12.22075268 0.15769182 0.30514901 0.16922392 Ni 10.42839042 3.45554598 10.42140498 0.22014310 0.41372424 0.51441979 Ni 12.20080803 5.20593151 10.45782943 0.00011843 0.21996178 0.11299125 Ni 12.19597250 3.51143159 12.17813942 -0.42274912 -0.21593915 -0.24279620 Ni 10.43072528 5.21012441 12.22113145 0.10844214 0.12082963 -0.08505375 Ni 0.02170316 6.94325803 10.42057080 -0.36589510 0.24857745 0.54576789 Ni 1.77665282 8.74545792 10.43972191 -0.50961162 -0.53906970 0.49817155 Ni 1.74478396 6.93866517 12.19855325 -0.17934760 0.24118873 0.19839265 Ni 0.01272196 8.68878736 12.20242044 0.48220989 0.10493151 -0.53497253 Ni 3.47319926 6.98031741 10.48672786 0.17001049 -0.19798703 -0.18755427 Ni 5.20080422 8.74587506 10.47072420 0.29152547 -0.45449937 -0.25796848 Ni 5.20862467 6.92833100 12.22002638 0.25800539 0.22360878 0.17674707 Ni 3.50440601 8.68796655 12.21950386 -0.23953072 0.16291242 0.28973658 Ni 6.95614653 6.97491645 10.48268252 0.09061064 0.17413958 -0.04724604 Ni 8.74194736 8.69010159 10.43044566 -0.36754415 0.25766579 0.41495803 Ni 8.69653250 7.00849557 12.22046625 -0.03507877 -0.32665974 0.12646038 Ni 6.95535625 8.74687409 12.20233026 0.14770097 -0.21138864 0.03584444 Ni 10.44159038 6.96158815 10.47612691 0.25377359 -0.14590838 -0.24052788 Ni 12.20633110 8.73956651 10.49000704 0.17822772 -0.29804787 -0.18308217 Ni 12.19551311 6.94407735 12.17202804 -0.26182823 0.00990549 -0.17661927 Ni 10.46125224 8.69992554 12.18503355 -0.02736437 0.19124842 0.31520096 Ni 0.00044963 10.48033671 10.46797803 -0.10165279 -0.06611512 0.23028705 Ni 1.73977611 12.20844222 10.46426294 -0.07585533 0.20968533 0.24354652 Ni 1.77139793 10.46812017 12.20432570 -0.29989941 -0.07878946 0.18687492 Ni 0.02447895 12.16348170 12.21980329 0.58125618 -0.51523048 -0.55749940 Ni 3.45127972 10.43189678 10.43961008 0.67410807 0.50536793 0.35458188 Ni 5.22845363 12.21484257 10.43006199 -0.25807322 0.07857636 0.44657805 Ni 5.24024854 10.42623889 12.17756552 -0.25638748 0.70675372 0.25783441 Ni 3.47785496 12.20283776 12.20897931 0.15110045 -0.40823435 -0.47129521 Ni 6.96046442 10.48089014 10.42247969 0.11001065 -0.22238779 0.58617958 Ni 8.69137347 12.19046764 10.46520938 0.34750461 0.38188542 -0.04326064 Ni 8.69750691 10.48232273 12.18746208 0.26298382 -0.14222673 0.10885795 Ni 6.98007803 12.21118042 12.17421691 -0.24332905 -0.28829283 -0.19893162 Ni 10.44614351 10.45137613 10.43188289 0.18644212 0.42997446 0.39955573 Ni 12.19993104 12.17271633 10.43468417 -0.40928863 -0.41328708 0.05604897 Ni 12.18593801 10.42656548 12.21681025 -0.39680174 0.26716576 -0.41394303 Ni 10.51163692 12.21420696 12.17838755 -0.17955061 -0.54138961 -0.47244642