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=77.95910512588696 stress="-641.7691460740268 -56.71377995061226 -238.7234001455264 -56.71377995061226 -672.3795444365703 -11.379793557234734 -238.7234001455264 -11.379793557234734 -474.1060318789113" pbc="F F F" Ni 0.22086729 -0.01689004 -0.22903346 -0.79155815 -0.36529754 -0.91230484 Ni 1.59933616 0.93572417 0.98055861 -18.73375763 -46.66350351 29.27187412 Ni 2.14715992 2.22516294 0.23402360 -2.53577692 16.25773388 -55.13424995 Ni 2.93229823 3.31172061 1.19084223 21.63866442 30.73047318 26.95479213 Ni 2.29465675 0.14771729 3.20399864 -1.15340723 0.74186666 0.53353854 Ni 4.35802973 1.07349581 3.45018589 -3.87175176 -24.98293426 19.19885959 Ni -0.23115740 3.20444678 3.02575960 0.35468971 -0.42933084 -0.30961046 Ni 1.55604684 4.07636534 3.99475015 -45.04852656 112.65269163 -66.04055276 Ni 5.23975440 0.55577733 0.25284888 -1.08912818 0.61055135 -0.56761427 Ni 6.57116719 1.00454661 1.78983070 -14.33535397 9.88861789 -12.02488917 Ni 7.51432400 1.93324962 -0.30384491 -0.51400104 -0.06104437 1.02689833 Ni 8.42712388 3.91385061 1.22088890 7.91112859 -12.74728938 -11.68816717 Ni 7.81964364 0.29825864 2.90182602 14.81290630 -8.30410680 13.76630920 Ni 8.94092265 1.79747090 4.26025248 45.71287247 -19.09689578 -42.53198205 Ni 4.61890133 2.43827487 2.40447350 4.21106299 25.01375407 -19.87694549 Ni 6.32868209 3.48931485 3.46659910 0.76118599 -0.26549781 0.63291697 Ni -0.27058365 4.65017747 0.17843495 -2.26141995 -5.04477197 -1.77366111 Ni 0.67994952 6.20201413 0.91957267 -10.61091378 -9.06547496 12.82280715 Ni 1.83832478 7.32454839 0.07964709 13.94345268 13.32892406 -9.47932318 Ni 3.61643991 8.32327578 1.40123177 -76.33496216 45.85475401 -51.44773990 Ni 2.95366604 4.88968876 2.71888199 -30.76480797 -22.00364324 -18.41705492 Ni 4.18297782 5.79320854 3.39174556 32.94243957 23.94573878 16.74306321 Ni 0.30302897 7.83814538 2.63905551 -0.74250580 -3.29488152 -3.67530434 Ni 0.93114464 8.99801325 4.11824152 2.28190390 2.15539246 4.28985136 Ni 5.10049303 5.54851891 -0.14790264 -0.63233617 0.40955682 0.92580158 Ni 6.60365422 6.12475624 1.46651109 -23.92402168 26.27282123 -21.19996597 Ni 7.06544791 8.43063630 0.46577408 -37.34507159 -9.37629140 -12.46700169 Ni 8.61612729 8.80145122 1.02098422 36.26070435 8.40383172 13.27964249 Ni 7.58087455 5.09122498 2.35935114 14.83608538 -13.48813222 32.94466761 Ni 8.53127631 6.09201764 3.97117919 0.24750613 -0.27535563 0.75961859 Ni 4.66448343 7.68403127 2.11226018 76.43519346 -46.91213680 50.72886836 Ni 5.97555741 8.31914392 3.89352680 -34.48545485 12.04450679 -19.93715731 Ni -0.18643662 0.02979695 4.64687243 -22.34856398 -22.25815417 -14.72198139 Ni 0.93325827 1.12341543 5.35225234 23.00796369 22.69869094 14.50968326 Ni 2.00297454 2.99791377 4.62151619 47.84761447 -113.79375020 65.60867483 Ni 3.50089017 3.51894432 6.60702912 -0.73872533 -1.10223246 0.57263846 Ni 1.91735306 0.17049102 7.29388522 0.50827116 0.97541932 0.06289275 Ni 4.08450338 0.75571598 8.99881808 -0.36419214 -0.20150306 -0.93165091 Ni 0.23710347 2.57017884 7.93084891 -13.69063082 -20.38650331 -9.98203205 Ni 1.22422232 3.91950201 8.54655608 -14.61291074 -6.68079876 26.26564158 Ni 4.96360461 0.31836545 5.74169686 -19.64724157 -8.74378565 -8.59956244 Ni 6.48837336 1.00831489 6.43404765 -15.77957782 69.48928322 -26.91749511 Ni 7.84911873 2.25854751 5.26936712 -68.64559739 -17.21703093 19.12644597 Ni 8.60556472 3.49425818 6.03735392 21.80942039 37.07244407 23.21598216 Ni 7.20384740 -0.14918067 7.03810700 39.60342606 -62.97032293 33.65189597 Ni 8.86847215 1.00394286 8.76534421 -1.02069898 -0.07056269 -1.21647768 Ni 5.09980901 2.00409575 7.40737990 -3.92976280 2.91830438 2.84216255 Ni 6.16663094 3.82725993 8.36108682 0.02021020 0.89448181 -0.86882174 Ni -0.02543498 4.89949207 4.94651716 -1.93601068 1.12760615 1.51307423 Ni 1.16201767 6.98989951 5.74303982 -9.09481147 -1.09851359 5.19299378 Ni 2.82350393 7.21827495 4.80335328 -7.46359434 -21.05717091 -28.18547027 Ni 3.63834321 8.28337470 5.87827378 16.89843347 21.50486240 22.03521575 Ni 2.36102597 4.94186987 7.87644269 29.02448275 27.51484592 -17.45011033 Ni 4.55457252 5.79284007 8.85695185 0.41517059 -0.41602931 -0.80866297 Ni 0.06236183 7.74812411 7.77511221 -0.17128456 -0.62513393 -0.58414605 Ni 1.48115325 8.96771709 8.78828861 0.60694986 0.17017697 -0.08612929 Ni 4.68857725 4.74812168 5.24335814 -0.73036554 -1.21387075 -0.54947392 Ni 5.89974943 6.22892384 6.12165250 35.04617564 -58.25164449 -67.68502237 Ni 7.34497277 7.80178516 4.71375535 33.65461412 -12.52327075 21.30234355 Ni 8.54610002 8.89496231 6.59964402 -1.06257371 -1.17012097 0.23510886 Ni 7.83394746 5.70480081 7.92669675 -99.21515455 -60.04871784 -78.50000873 Ni 8.77099171 6.28111300 8.66957874 97.67329438 60.70785224 77.40613968 Ni 5.39757659 7.11536967 7.13716159 -33.35329696 59.39620286 67.54292070 Ni 5.99934153 8.70821989 8.60820831 0.51392608 -0.57568009 -0.39275348