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=49.81931022725709 stress="-0.00038655836932124476 -6.85152558951314e-05 -1.3587983661964622e-05 -6.85152558951314e-05 -0.0002732341497273564 -5.6506030478197695e-05 -1.3587983661964622e-05 -5.6506030478197695e-05 -0.0003940622650918461" free_energy=49.81931022725709 pbc="F F F" Nb 20.99167574 21.13791048 21.11490714 -0.22518087 0.04154223 -2.98777606 Nb 22.63362859 22.32702941 22.57034430 -2.08597089 4.43721004 -5.11219032 Nb 23.96186356 20.99331572 20.91561068 -0.01049497 -0.74779694 -1.04383043 Nb 25.63661615 22.40480033 22.37719504 1.70226068 0.11530054 1.27124678 Nb 20.79869006 24.11041876 20.76735611 1.12140831 -2.30277374 1.63741159 Nb 22.33533445 25.24148635 22.58611608 2.93940703 6.04969481 -5.86032767 Nb 24.03369179 24.02598936 20.87818432 -3.26667915 -2.32488332 -3.19685688 Nb 25.52363976 25.10829288 22.25559716 1.55427556 1.93018471 4.30776631 Nb 20.70178472 21.46305909 23.58716701 -2.76135839 -0.59391541 2.63192462 Nb 22.36934252 22.39414372 25.55835534 -0.43146192 0.35652948 3.17078382 Nb 23.74645637 20.98193431 23.92001865 2.78055525 -5.16091718 2.03411738 Nb 25.70070203 22.20342959 25.30057140 -0.92545697 1.62278269 -0.47043474 Nb 20.99793547 24.28187239 24.01001192 -9.01330252 -4.19158201 1.18560670 Nb 22.48453339 25.60170120 25.37793365 0.94176302 3.58329031 4.52999506 Nb 23.71904386 24.00082602 24.24624097 8.95640706 -1.51180693 -0.50987589 Nb 25.64302402 25.35498893 25.61042859 -1.27617122 -1.30285929 -1.58756027