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=-45.377825117650154 stress="-0.0003266235089302839 0.00016164301172096025 -0.0001553461841582992 0.00016164301172096025 -0.0002809748805089869 0.0003035434327741129 -0.0001553461841582992 0.0003035434327741129 -0.00019323145744273775" free_energy=-45.377825117650154 pbc="F F F" Si 21.46048872 20.72592512 20.78504734 -1.18475429 1.25820879 1.83863084 Si 22.68365717 22.70288723 22.58343331 -0.67775651 -10.86045108 -3.55230300 Si 23.79585403 20.84894620 21.22094491 2.80315549 0.50637088 2.90563184 Si 25.73171545 22.68190327 22.32183498 3.18783917 -1.40942054 2.86503009 Si 21.21012800 23.92485375 21.41177904 -3.12175148 3.17434394 -4.58526683 Si 22.28220450 25.78278197 22.57211192 2.20344027 2.79553608 -0.10675676 Si 24.13362859 23.82702941 21.07034430 -1.66180716 4.63095556 -4.85148848 Si 25.54852473 25.55473499 22.41561068 -2.67652810 -1.59112893 1.69550987 Si 21.12114954 21.00650154 23.87719504 -0.27216278 -0.87324366 -1.40347779 Si 22.29869006 22.61041876 25.26735611 2.11200143 -3.38351715 7.11527963 Si 23.71326810 20.74231237 24.33235706 0.41050326 -1.00590599 -1.16857569 Si 25.53369179 22.66901337 25.07828543 1.39228275 -3.43778692 1.74340911 Si 20.96375436 23.90583543 23.86602575 -7.09827641 2.80637705 1.43378287 Si 22.20178472 25.79874826 25.27290972 1.96529002 -1.53971010 -2.37058232 Si 23.88090187 23.86136659 24.05835534 4.17236369 10.02782079 0.53402254 Si 25.24645637 25.48193431 25.42001865 -1.55383936 -1.09844872 -2.09284592