500 Lattice="17.46420400605324 0.0 0.0 0.0 17.46420400605324 0.0 0.0 0.0 17.46420400605324" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2024.6289424610104 stress="-0.00377375307241366 -2.961850551330564e-05 7.859532630630976e-05 -2.961850551330564e-05 -0.003844271795812621 0.0004765138320060415 7.859532630630976e-05 0.0004765138320060415 -0.0037804474613553686" free_energy=-2024.6289424610104 pbc="F F F" Ni 0.03328992 0.00081945 0.03448599 0.34965104 0.42911629 0.28629265 Ni 1.75351151 1.78486827 0.03080244 0.30528532 -0.28683520 -0.31970865 Ni 1.73525753 0.01411516 1.73484051 0.22135281 -0.12455930 0.18032960 Ni 0.03139307 1.77411709 1.71276672 -0.40755292 -0.30468055 0.42262921 Ni 3.51000693 0.02470591 0.01268186 -0.20994157 0.15760812 0.10967607 Ni 5.24776809 1.74325007 0.03321155 0.14854820 0.13789487 -0.27740701 Ni 5.22119543 0.01775154 1.72926379 0.30966222 -0.33023087 0.15357497 Ni 3.52642975 1.73424005 1.78885832 -0.55339990 0.23215731 -0.27998210 Ni 7.00958327 0.01193296 0.00803679 -0.09645752 0.07479899 0.20949423 Ni 8.69722334 1.73961820 0.02568201 0.24023448 0.23114573 -0.17236720 Ni 8.75376275 0.00466247 1.76261279 -0.05759177 -0.18067148 0.09063035 Ni 7.01603899 1.72557733 1.78381732 -0.24986749 0.21962936 -0.25634514 Ni 10.44665603 0.01526519 0.02591007 0.02012164 0.07331828 0.05441263 Ni 12.20742424 1.71840543 0.00180544 0.21093833 0.07323829 -0.27191974 Ni 12.21968096 0.01607775 1.73845141 0.22869930 -0.27198440 0.04533312 Ni 10.50714565 1.75121508 1.73469002 -0.37558461 0.15670033 0.23178366 Ni 13.99957997 0.01742985 0.02295324 -0.14620657 0.17407189 0.16034252 Ni 15.73582725 1.73083495 0.00223865 -0.21855493 0.11485127 0.26161232 Ni 15.72966226 0.00407025 1.75847848 -0.25526150 0.32738314 0.17320473 Ni 13.98461573 1.72740620 1.72818128 0.01383727 0.03234452 0.18747800 Ni 0.03236242 3.47536561 0.03471480 -0.13875786 0.16361127 -0.23239243 Ni 1.77135646 5.22997888 0.00112768 0.01054222 0.06916427 -0.16824480 Ni 1.71166340 3.48207258 1.71439812 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0.00524392 -0.18676979 -0.20756193 -0.15622160 Ni 5.26213171 12.19048147 0.02426953 -0.08862510 0.21425890 -0.33234421 Ni 5.26747475 10.47288637 1.75693739 -0.32686142 0.18764777 0.23297685 Ni 3.48307705 12.23929895 1.71561095 0.22642907 -0.13523355 0.49202493 Ni 6.99830590 10.49305445 0.00283750 -0.05362091 -0.27790420 -0.23918101 Ni 8.70099762 12.21404647 0.02957795 0.29462935 0.14795288 -0.44500006 Ni 8.73462995 10.45630260 1.72210568 -0.14943579 0.28401539 0.39857830 Ni 6.99474980 12.25390454 1.73059593 -0.03320517 -0.46491504 0.34822763 Ni 10.45808860 10.44924981 0.02117167 0.21666275 0.32376792 -0.32680269 Ni 12.25565861 12.22543350 0.01160936 -0.16738268 -0.15940331 -0.22149465 Ni 12.20574234 10.45903780 1.77889149 0.22884344 0.20477717 -0.36880167 Ni 10.44776186 12.25910698 1.74374364 0.27817326 -0.35836213 0.07409049 Ni 13.98731568 10.46048501 0.02496011 -0.15716346 0.13977791 -0.14303829 Ni 15.73475318 12.23190503 0.00091630 -0.37596745 0.16468328 0.33816708 Ni 15.71734841 10.46808635 1.72432898 0.16976026 0.19919313 0.19966632 Ni 13.95082296 12.25168488 1.76132652 0.38749696 -0.20614932 -0.10370509 Ni 0.01723298 14.00557519 0.00937928 0.10991796 -0.26489616 0.22309619 Ni 1.71877526 15.69155661 0.01945341 0.35385180 -0.11853567 0.23274375 Ni 1.71926994 13.94646493 1.71634078 0.28177475 0.34327438 0.29127203 Ni 0.02717040 15.74448158 1.77379617 0.24160072 -0.26716028 0.10902489 Ni 3.51396238 13.96537284 0.02397996 -0.07964250 0.07406213 -0.23271966 Ni 5.26845184 15.70968196 0.01100952 -0.19028819 -0.17484477 0.09385203 Ni 5.24641229 13.94090574 1.75894948 -0.09623879 0.22399152 0.05087108 Ni 3.51587144 15.71719988 1.76962243 -0.16513283 0.10292696 -0.25651467 Ni 6.97227407 13.95281432 0.03198732 0.04152213 0.13686094 -0.41108084 Ni 8.76699407 15.69791712 0.00499811 -0.23855696 -0.12444318 0.06067202 Ni 8.72393744 13.96636865 1.72050781 0.17600236 0.29684799 0.28868573 Ni 6.95746763 15.72227580 1.71234096 0.25668968 0.09659262 0.38993378 Ni 10.50118859 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