256 Lattice="12.787281036376953 0.0 0.0 0.0 12.787281036376953 0.0 0.0 0.0 12.787281036376953" Properties=species:S:1:pos:R:3:forces:R:3 energy=-614.8122538568798 stress="-17.824031597462625 8.971020845050365 5.836407958488327 8.971020845050365 8.304050065687175 -10.31222830049444 5.836407958488327 -10.31222830049444 -1.0652098358681243" pbc="F F F" Ni -0.02213838 0.00048953 0.00004372 0.54931775 0.09416015 0.38868358 Ni 1.60321503 1.59227408 -0.00086433 0.77712052 -0.17852096 -1.28389120 H 1.60553837 0.01532986 1.60035101 -0.16198034 0.11873088 -0.39768638 Ni -0.00478045 1.59517412 1.60516338 -0.43868508 -0.94144440 0.69904253 Ni 3.21026399 -0.02101648 -0.02871853 0.15691397 0.27241373 0.51745942 H 4.81914532 1.62111465 0.03537011 -0.04271171 -0.24352385 0.11657746 H 4.80172965 -0.02769609 1.62991360 0.07930657 -0.08793918 -0.23193539 Ni 3.20990190 1.61867725 1.61959196 0.24291724 -1.18068083 1.54495057 Ni 6.40523572 0.01411956 0.01068926 -1.80448931 -0.99631147 -0.85946054 Ni 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11.17516140 9.59703926 0.00419235 0.05999631 0.25264618 H 8.02478884 9.63777033 11.17619366 -0.05673248 -0.05029253 -0.00194792 Ni 6.38160202 11.21914271 11.17076321 0.31029675 -0.77140018 -0.38879134 Ni 9.56575663 9.58501632 9.61540904 0.14954242 0.69660199 -0.16718126 Ni 11.17594995 11.21828306 9.62186576 -0.54814768 -0.93053010 -0.42466894 H 11.17214021 9.60847157 11.21769818 -0.05882517 0.06508975 -0.51300293 H 9.60290012 11.19090869 11.21348968 0.35072637 -0.20459176 -0.57897021