108 Lattice="10.439339921131388 0.0 0.0 0.0 10.439339921131388 0.0 0.0 0.0 10.439339921131388" Properties=species:S:1:pos:R:3:forces:R:3 energy=-407.6752818584941 stress="-0.9984067684379738 0.8366161658935285 -0.5565453396851456 0.8366161658935285 -1.4215660751170436 -0.8593498914153672 -0.5565453396851456 -0.8593498914153672 -1.859685221551878" pbc="F F F" Ni 0.01499901 -0.02641071 -0.01312241 0.69378075 0.67253307 0.67705349 Ni 1.73483693 1.76575032 -0.01897979 -0.21423429 -0.32137759 -0.20922345 Ni 1.75467681 0.01626012 1.77097877 -0.21100310 -0.49551555 -0.30898420 Ni 0.03135236 1.70618282 1.75959899 -0.44583869 0.19016102 -0.41010951 Ni 3.47716416 0.02946982 -0.00191620 -0.01809570 0.12456182 0.23092480 Ni 5.19773705 1.76874661 -0.00185748 0.09818154 -0.11537695 -0.25599966 Ni 5.22477058 0.03012505 1.77434725 -0.24492383 -0.66810170 -0.59357287 Ni 3.45221409 1.72809543 1.75958157 0.13636174 0.02827998 -0.24153852 Ni 6.93227088 -0.01208791 0.00122629 0.10824040 0.41852875 0.38391599 Ni 8.71984826 1.73005159 0.02646200 -0.41733076 -0.12129379 0.29055850 Ni 8.69327493 0.00561000 1.78344297 -0.24684380 0.25979270 -0.24144666 Ni 6.93862895 1.71447967 1.73674473 0.52325183 0.18228622 -0.22347762 Ni -0.02300392 3.49244030 0.03025029 0.29778848 -0.15813564 0.13326666 Ni 1.74505711 5.24061371 -0.02058083 -0.15686706 -0.17261282 -0.30881896 Ni 1.76218406 3.46098847 1.75436612 -0.24707753 0.22351734 -0.12380789 Ni 0.03015044 5.21010197 1.71004256 -0.34329390 0.09783689 0.16756667 Ni 3.44946209 3.50075942 -0.00617908 0.24469335 -0.11366683 -0.20421814 Ni 5.23423001 5.20313254 0.01204116 0.04800788 -0.19658165 -0.48968390 Ni 5.22306259 3.45164825 1.76701622 -0.13700545 0.36533949 -0.47630714 Ni 3.49265671 5.25181864 1.71289933 -0.18381837 -0.57218785 0.64873608 Ni 6.98936202 3.49055151 0.00177130 -0.17675992 -0.15444602 -0.22049913 Ni 8.70591522 5.21921038 -0.00394641 -0.14842368 0.11702944 0.24200950 Ni 8.69166837 3.49056360 1.71905084 0.29217098 -0.09651962 0.24643553 Ni 6.93731809 5.25353943 1.75549637 0.18211504 -0.37122458 -0.14128892 Ni -0.02001142 6.93356570 -0.01747425 0.35795469 0.13595062 0.32184142 Ni 1.76322575 8.67414245 0.03871130 -0.02471078 -0.14751943 -0.10206136 Ni 1.76567818 6.97010331 1.71473249 -0.14099886 -0.15914661 0.39033251 Ni 0.01408417 8.69077616 1.70542115 0.17651781 -0.29508724 0.11263276 Ni 3.50784047 6.93009476 0.00925032 -0.06770682 0.45697769 -0.67885260 Ni 5.18963143 8.72803906 -0.00830918 0.23879988 -0.36902666 0.33635361 Ni 5.21071041 6.95198921 1.71303634 0.25748204 0.40834023 0.41884401 Ni 3.48501238 8.71981776 1.75641109 -0.05837746 0.13818760 -0.05401281 Ni 6.97244431 6.93482505 -0.02310205 -0.10487493 0.42513169 -0.25738283 Ni 8.67888777 8.71481211 -0.01354461 -0.52809059 -0.54136550 0.51942325 Ni 8.67886965 6.99218664 1.73249091 0.47203667 -0.29286222 -0.16957555 Ni 6.98125240 8.69208625 1.75154621 -0.39103907 0.28952327 -0.28533636 Ni -0.02844626 0.03839491 3.49534286 0.10383481 -0.15018264 -0.00915164 Ni 1.71822406 1.72893587 3.52129882 0.33801813 0.26399254 -0.12024949 Ni 1.75693515 -0.00798604 5.19286765 -0.20331825 -0.36466182 0.50960307 Ni -0.00066419 1.70926537 5.24859117 -0.25273879 0.18474546 0.12818261 Ni 3.49775629 -0.02984316 3.49672478 -0.17076348 -0.29788980 -0.16492447 Ni 5.21187611 1.72330276 3.45312586 0.12317941 0.15218474 0.56931240 Ni 5.20175414 -0.00462572 5.21654579 0.53661048 -0.28924985 0.04486278 Ni 3.50186205 1.71853517 5.21298761 -0.36062715 0.35278600 0.03161171 Ni 6.95221443 -0.02186022 3.46102317 0.20898014 -0.26426424 0.43641436 Ni 8.69426411 1.74570295 3.51202481 0.42900893 -0.22815974 -0.50835328 Ni 8.72158458 0.01517633 5.26641948 -0.31400947 0.12114045 -0.12690209 Ni 6.98505634 1.75027736 5.19205547 -0.63501167 -0.24626337 0.38076113 Ni -0.00290611 3.48432403 3.48172137 -0.35220239 -0.14595549 0.06690080 Ni 1.72614680 5.19497885 3.49268047 0.49676329 0.23883373 -0.26664274 Ni 1.74817920 3.49806452 5.23668174 0.00479441 -0.49941356 -0.28194735 Ni -0.00205384 5.25265113 5.22215364 -0.52408291 -0.27003381 0.05681155 Ni 3.49113875 3.45223615 3.45160378 -0.32724640 0.25275355 0.26010888 Ni 5.21166511 5.19994856 3.50207328 0.15819848 0.20942722 -0.38717463 Ni 5.18612616 3.48780794 5.19549511 0.34810663 -0.37021120 0.23623004 Ni 3.49325658 5.19728737 5.20222037 -0.22564923 0.28445836 0.41876680 Ni 6.94616155 3.45516681 3.44599663 0.03684518 0.28511147 0.26449966 Ni 8.66657594 5.22693642 3.48785346 0.40549868 -0.13957033 -0.09790317 Ni 8.68540550 3.45221870 5.20325655 0.47966056 0.32904044 0.25244432 Ni 6.93711936 5.19043174 5.24961994 0.03465396 0.27909588 -0.41779699 Ni 0.03257986 6.94025083 3.44691756 -0.51268705 0.15025453 -0.09162154 Ni 1.72143459 8.70109885 3.48839803 0.16842459 0.25694350 -0.17470658 Ni 1.71542185 6.97028240 5.21983628 0.44040960 -0.13590137 0.10702586 Ni -0.01976465 8.67210859 5.19825146 0.10844323 -0.13384638 0.13857922 Ni 3.50740835 6.93688083 3.51229582 -0.44511481 0.09812682 -0.43176198 Ni 5.18517312 8.72790808 3.47055207 0.56107861 0.15529969 -0.10377788 Ni 5.23294554 6.98328914 5.21776860 -0.11935809 -0.46227002 0.23189649 Ni 3.50820586 8.70731492 5.18804773 -0.53880802 0.24315165 0.38238737 Ni 6.94847725 6.94195802 3.49543853 -0.12487406 0.37103781 0.07430256 Ni 8.70934636 8.68332182 3.44849113 -0.21812252 -0.16952136 0.36122627 Ni 8.71253438 6.93025313 5.22959090 0.12869638 0.49319432 -0.12477468 Ni 6.95080328 8.71549724 5.24316923 0.36170714 0.24611353 -0.30738066 Ni -0.01685375 -0.01890678 6.98819065 0.55818589 0.38011550 -0.09589257 Ni 1.76601159 1.74945153 6.98816957 -0.31670052 -0.63921688 -0.48441341 Ni 1.76629934 0.00026266 8.70230583 -0.17777994 0.17657540 -0.32481935 Ni -0.01721334 1.72636576 8.69381285 0.26449084 -0.16796257 -0.20062141 Ni 3.51786343 -0.01875402 6.95129207 -0.31003418 -0.27532741 0.08168858 Ni 5.21088610 1.77267408 6.94586194 0.23168989 -0.28604582 0.05830356 Ni 5.17685836 0.01045531 8.73320488 0.24865157 0.16894970 -0.26804148 Ni 3.46689551 1.70761937 8.69672599 0.25175142 0.33039799 0.47382837 Ni 6.95269941 0.02622255 6.99023937 -0.14772531 -0.37984292 -0.14723343 Ni 8.69630747 1.72686515 6.99098783 0.26632376 0.26407391 -0.00035835 Ni 8.71485159 -0.01732170 8.67084809 -0.52061723 0.48901745 -0.42591628 Ni 6.94530244 1.73737092 8.70127957 0.21141829 0.12580030 0.32694447 Ni 0.01827205 3.44632427 6.97616475 -0.61593851 0.16507135 -0.19682288 Ni 1.71500434 5.18571309 6.93655827 0.13324382 0.46664858 0.41692100 Ni 1.70682723 3.44516508 8.70346120 0.14954496 0.22235164 0.55250033 Ni -0.02279935 5.19608048 8.70608055 0.35779463 0.14208561 -0.28658143 Ni 3.46112159 3.45806486 6.97573126 0.18346686 0.26652960 -0.23268041 Ni 5.22502065 5.21212405 6.98193809 -0.31496006 0.30069097 -0.46691811 Ni 5.23636658 3.50833961 8.66764373 -0.18494845 -0.38029943 0.67090479 Ni 3.45763932 5.19185346 8.69875206 -0.05075014 0.05212297 0.38000772 Ni 6.94868018 3.50831058 6.94225263 0.30164513 -0.50201061 0.18002245 Ni 8.71168250 5.23946537 6.93328151 0.26390854 -0.15245795 0.25313734 Ni 8.72637122 3.53306899 8.67766822 -0.36851978 -0.21112098 -0.23583987 Ni 6.95682143 5.22897924 8.70416591 0.26847741 0.17499531 0.26504427 Ni -0.02720836 6.96500470 6.97504817 -0.12172164 0.07529119 0.28722643 Ni 1.72662883 8.67999612 6.97811291 -0.17896333 0.39010166 -0.19868737 Ni 1.76041085 6.96513374 8.71505334 -0.62515963 -0.14386170 0.25711536 Ni -0.02735310 8.73045497 8.70718955 0.69177180 -0.69682371 -0.61734239 Ni 3.45090897 6.92890766 6.98275962 0.23510532 0.11359237 -0.57301993 Ni 5.19753116 8.71514099 6.92505015 0.09263351 0.20026875 0.54725329 Ni 5.20489497 6.96686765 8.69169510 0.11735561 0.17919586 0.26519510 Ni 3.44750678 8.69627330 8.67636200 0.21550706 -0.01960830 -0.05347490 Ni 6.96246879 6.97354736 6.95343893 -0.06599512 0.10542172 0.19434282 Ni 8.72560616 8.70603681 6.97892098 -0.39737334 -0.23326277 -0.20031106 Ni 8.68802908 7.00317141 8.66510352 -0.18534626 -0.23456663 -0.07911660 Ni 6.98075579 8.73365903 8.72677011 -0.22879972 -0.43911641 -0.58290003