16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-67.30452817853013 stress="-1.804601601956727e-05 -6.214829234194141e-05 0.00013283949263776044 -6.214829234194141e-05 -0.00014315614319214366 0.00014555912026677377 0.00013283949263776044 0.00014555912026677377 2.933817924713728e-05" pbc="F F F" Nb 20.96970286 21.45089486 20.93381024 0.80175221 -5.55128552 1.05187656 Ni 22.15922768 22.51683428 22.77093457 1.61853113 3.66387035 -3.30954752 Nb 23.78902040 20.73155877 20.85906478 -0.77624645 0.79093235 0.34833288 Nb 25.29375489 22.38477302 22.56194135 4.51881900 3.32697560 -2.99246154 Nb 20.87455773 23.69796013 20.75979631 0.41305061 5.53731725 0.11190874 Nb 22.49454085 25.57842680 22.40643268 1.52546142 -0.24195135 0.51580225 Nb 23.96055881 23.91062519 20.80089401 -0.80422327 -0.76662458 0.62323051 Ni 25.78055862 25.22950407 22.29998375 -1.42196750 -1.01345967 0.51964295 Ni 21.49134752 20.94401407 23.95075215 -2.37383802 -1.81988588 1.48169595 Ni 22.73672153 22.76188005 25.47171949 -1.65443873 -0.49680814 1.02678511 Nb 23.75381041 21.25912702 23.74222034 -1.95180123 -4.50764995 3.20242295 Ni 25.35844045 22.44747051 25.22817044 0.38205732 0.20961219 0.61207794 Nb 20.91911278 24.19673490 23.84323236 0.00830214 -0.89101017 1.15238643 Ni 22.67171396 25.65809073 25.31702931 0.59289024 -1.16187132 -0.93082405 Ni 23.93585131 23.73253452 24.02826565 0.25216377 4.14361249 -2.24781802 Ni 25.23116772 25.56799256 25.76554664 -1.13051265 -1.22177368 -1.16551113