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=-53.30230953360829 stress="3.664236948662372e-05 6.939812466573998e-06 1.2973409418457425e-05 6.939812466573998e-06 -3.794121945316907e-05 -1.9897945222107635e-05 1.2973409418457425e-05 -1.9897945222107635e-05 -3.559498970715779e-06" free_energy=-53.30230953360829 pbc="F F F" Si 21.28278197 20.91722851 21.18643573 0.73429470 0.40937974 0.25985392 Si 22.32702941 22.48368313 22.54852473 1.71257221 0.27466049 -1.80330669 Si 24.05473499 20.78802304 20.95892459 -1.62316587 0.00470193 0.00729172 Si 25.31529193 22.10005924 22.29869006 -0.69444930 0.94780196 1.13256563 Si 21.11041876 23.70593683 20.83533445 0.73088427 -0.29400203 0.64837510 Si 22.24148635 25.33817029 22.53369179 1.03554188 0.95244500 -2.25668503 Si 24.02598936 23.87818432 21.02363976 -0.96283282 -1.05075186 0.41504586 Si 25.40583543 25.25559716 22.20178472 -0.38263058 -0.15010863 1.23282753 Si 21.29874826 20.93722054 23.88090187 -0.61737922 -1.16323723 -0.33676272 Si 22.36136659 22.55835534 25.24645637 1.13636501 -0.86605952 2.23534129 Si 23.79619161 20.90845930 24.20070203 0.82779745 0.08655251 -0.82882911 Si 25.20342959 22.40085166 25.49793547 -0.90923116 0.83704006 -0.90768759 Si 21.28187239 24.01001192 23.98453339 -3.59154863 -0.30808630 -0.06658647 Si 22.60170120 25.37793365 25.21904386 -0.81800195 2.86445693 2.63037025 Si 24.00082602 24.24624097 24.14302402 4.75686427 -1.43231624 -1.30935437 Si 25.35498893 25.61042859 25.70947124 -1.33508024 -1.11247680 -1.05245934