32 Lattice="8.376855850219727 0.0 0.0 0.0 8.376855850219727 0.0 0.0 0.0 8.376855850219727" Properties=species:S:1:pos:R:3:forces:R:3 energy=-180.56570744614203 stress="65.81575275444192 6.064335717555146 -12.347523771406909 6.064335717555146 50.16532196712963 -4.907016428340343 -12.347523771406909 -4.907016428340343 56.59784329911183" pbc="F F F" Nb -0.12049575 0.09262900 0.09204096 3.03234110 1.37463082 1.11163308 Nb 2.26888204 1.93707605 -0.13472070 -2.79417162 0.76536670 3.19199616 Nb 1.91779392 -0.13741853 2.21122576 -0.35143632 2.74230683 -1.69270094 Nb -0.18489349 2.10987134 1.95116773 3.18640351 0.43154779 0.33080816 Nb 4.08575630 -0.03420984 0.16882826 1.25543737 1.27418934 2.05323716 Nb 6.33684296 1.87950665 -0.11208157 -3.53723977 -0.01672747 3.21152366 Nb 6.10599705 0.18564236 2.24908377 0.78122012 -0.83867920 -3.21415773 Nb 4.34145134 2.25739663 2.21658904 -1.95749193 -2.84727642 -2.05305124 Nb 0.22466171 4.33531320 -0.12164601 1.48884099 -3.37125754 0.40839184 Nb 2.26918347 6.29769243 0.12750193 -0.88472701 -0.19076457 -1.09422818 Nb 2.12628326 4.15321675 2.02631528 -1.44148405 -1.40056496 -0.27259007 Nb -0.03508886 6.18952257 1.67230773 1.02302959 0.33031051 2.11419561 Nb 4.34824975 4.33755724 0.24284059 -0.80472092 -2.19394763 -3.04711760 Nb 6.37810321 6.30975507 0.12420575 -1.96512464 -0.85837711 1.83823398 Nb 6.10006877 4.24663401 2.06591394 3.01684095 -0.14936057 1.00300859 Nb 4.02674480 6.13395520 2.10556061 2.99663248 2.23718736 2.01614195 Nb -0.12334412 -0.02027049 4.24117731 0.88482003 1.39735864 -1.12178358 Nb 2.04209265 1.90960444 4.18385649 -0.20177947 0.22903644 1.26871424 Nb 1.96193746 -0.13216084 6.12987636 1.65032388 1.80389665 -1.21649561 Nb -0.06678005 1.80238138 6.35825777 2.30151332 0.44017886 -1.90045334 Nb 4.41526095 -0.05515562 4.29786892 -2.49293104 2.33604592 2.61513022 Nb 6.49913080 1.86581823 4.00930071 -0.85665845 2.13142629 2.48205839 Nb 6.43568953 0.16907269 6.35216965 -2.80178070 2.41922995 -1.76348726 Nb 4.01830628 2.05095941 6.46676265 0.89242457 -1.34022076 -4.05229615 Nb -0.01057282 4.34001399 3.79144434 1.48548917 0.67329440 2.41011100 Nb 2.27104107 6.22002001 4.29668347 -3.80751289 0.77798303 -2.47559400 Nb 1.91271771 4.42407957 6.14514999 0.71965396 -4.82539416 -0.51687275 Nb 0.01210871 6.13849973 6.34126214 0.45407328 0.08386281 -2.81811683 Nb 4.22886520 4.23404042 4.11810350 -1.33646411 -0.94044381 0.50076793 Nb 6.39648868 6.20330883 4.08609046 -2.27204569 0.06738232 -0.81058474 Nb 6.11488360 4.28044356 5.97324414 -0.01929794 -2.99326484 0.89703170 Nb 4.05120663 6.11584330 6.14311893 2.35582225 0.45104437 0.59654634