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=-88.18903261819518 stress="-4.878648563300035e-05 6.995297833729134e-05 2.4680653701411616e-05 6.995297833729134e-05 -4.570646573591242e-05 2.2305432231382956e-05 2.4680653701411616e-05 2.2305432231382956e-05 -7.389376948905894e-05" pbc="F F F" Nb 20.87719504 20.79869006 21.11041876 1.01474042 0.83746637 1.14694363 Nb 22.42224393 22.33533445 22.24148635 -2.32007534 -2.24192430 0.81309181 Nb 24.08611608 21.03369179 21.02598936 -0.65413277 -2.21249264 -1.78786284 Nb 25.22329650 22.46375436 22.40583543 4.75286690 -0.60940203 2.39798273 Nb 20.75559716 23.70178472 21.29874826 -0.80456092 -0.10367189 -0.74883979 Nb 22.27290972 25.38090187 22.36136659 1.68064595 2.44245189 -1.74715237 Nb 24.05835534 23.74645637 20.98193431 -0.67681502 2.97719606 -2.75049901 Nb 25.42001865 25.70070203 22.20342959 -1.06036411 -1.19439922 0.76512372 Nb 20.90085166 20.99793547 24.28187239 1.40996850 1.42776221 -0.60287928 Nb 22.56989732 22.48453339 25.60170120 -0.05157093 -0.62898067 -0.77513665 Nb 23.87793365 20.71904386 23.70328347 -0.51455660 -0.04907200 0.50439337 Nb 25.74624097 22.64302402 25.35498893 -1.27673681 0.81579022 -0.62926443 Nb 21.11042859 24.20947124 23.85512851 -2.80093722 -1.58376767 1.98241627 Nb 22.55280714 25.41333883 25.34655491 0.91327072 0.47958550 0.63699302 Nb 23.87241235 23.82230844 23.91049160 1.17106177 0.82630645 1.66953247 Nb 25.22286420 25.43858073 25.25205420 -0.78280455 -1.18284826 -0.87484265