500 Lattice="17.33650598929337 0.0 0.0 0.0 17.33650598929337 0.0 0.0 0.0 17.33650598929337" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1833.7161802940204 stress="5.424325553524074 12.64872250274518 2.6993021397090358 12.64872250274518 -0.5497567191759839 -11.375679923911962 2.6993021397090358 -11.375679923911962 -0.7036798329595715" pbc="F F F" Ni 0.00981801 0.01983102 0.01241196 0.77269403 0.64397862 0.70428013 Ni 1.75544046 1.74675374 0.04334066 0.00862013 -0.47518238 -0.55312939 Ni 1.76822001 0.00808166 1.77637218 -0.30795339 -0.40842148 -0.45233645 Ni 0.03877410 1.74469707 1.70962088 -0.49237649 -0.23877444 0.15249443 Ni 3.45279116 0.00032878 0.02164246 -0.16667298 0.26802841 0.20023672 Ni 5.15993432 1.72431434 0.03223174 0.20000053 0.22393768 -0.29841293 Ni 5.19087368 0.01958174 1.67940296 0.08613927 -0.18619527 0.52720104 Ni 3.45024835 1.70714992 1.77788429 -56.53394057 -5380.97535931 -5252.94990563 Ni 6.93767908 0.02129304 0.01243459 -0.04846011 0.37130306 0.08326674 Ni 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0.19175573 -0.11442128 Ni 15.58556930 5.19326356 0.01798375 44.44122770 44.19844838 -0.00245647 Ni 15.63142972 3.50604217 1.74707615 -0.05990639 -0.43920021 0.15336639 Ni 13.86615171 5.22394299 1.72258526 0.07000239 -0.43603800 0.38434360 Ni 0.01291534 6.91449056 0.04904650 -0.10895435 0.19526726 -0.00503327 Ni 1.71691129 8.61811693 0.00802275 0.13984882 0.61742578 -0.40899784 Ni 1.72095496 6.99205587 1.70088185 0.60614227 -0.72810947 0.70957645 Ni 0.02930583 8.64903201 1.78520089 -0.70656086 0.28772690 -0.44414366 Ni 3.50441598 6.93102946 0.01621001 -0.14819408 -0.02637399 -0.44170139 Ni 5.24575054 8.65052218 0.02868469 -0.40496629 -0.03093420 -0.46165526 Ni 5.20896046 6.89811224 1.74490039 0.03034299 0.60381097 0.31979191 Ni 3.46637517 8.67577212 1.70108930 0.01005514 -0.12342465 0.28610015 Ni 6.92736924 6.92993892 0.02324066 0.19090387 0.11537244 -0.42972906 Ni 8.63947780 8.69438297 0.01739348 0.01918440 -0.25683764 -0.30307928 Ni 8.70200664 6.91991119 1.75146450 -0.81751452 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15.62788221 10.39302079 1.75045479 0.20978214 0.14483205 0.18211248 Ni 13.88276450 12.09766077 1.73484143 -0.12248812 0.63514937 0.31348755 Ni 0.01079891 13.92745500 0.01123558 0.46107337 -0.45825913 0.30157354 Ni 1.72474470 15.60872378 0.04190554 0.23080047 -0.39638480 0.40583633 Ni 1.72869096 13.83894322 1.76662322 10.60266782 4316.92254766 -4349.25726815 Ni 0.00362499 15.55069472 1.74131617 0.34419010 -0.10232123 0.19609097 Ni 3.48386239 13.90440101 0.05611993 -0.55842063 -0.16707070 -0.34702708 Ni 5.25215199 15.60333739 0.04086857 -0.30216104 -0.07256414 0.08938267 Ni 5.18190609 13.89666166 1.71824536 0.13374681 -0.00683277 0.42259387 Ni 3.45470569 15.62580946 1.73733068 0.04184299 0.08360948 0.21267458 Ni 6.91893397 13.88433785 0.01126700 0.20457489 -0.17973589 -0.04731762 Ni 8.64522876 15.56053125 0.04059983 -429.19317250 -420.00128071 -5.19381860 Ni 8.73151714 13.93683510 1.71314849 -0.65306765 -0.83731957 0.43641861 Ni 6.90845562 15.63408551 1.74145904 0.31347623 0.12571061 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