16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-91.86987770412485 stress="-47.06461970801921 -4.013091818220065 -17.016677063233217 -4.013091818220065 -53.58981482237445 -12.464761286014557 -17.016677063233217 -12.464761286014557 -39.224022280267725" pbc="F F F" W 0.28278197 0.06210000 0.13362859 -2.00929473 -3.06139700 -3.11095318 W 1.32702941 1.42547280 1.60133187 7.18140099 2.40181197 0.12494685 W 3.05473499 -0.08438932 0.13661615 -3.06089396 -2.44952701 -1.38327001 W 4.40480033 1.37719504 1.29869006 3.51585962 1.41810121 6.09526315 W 0.26530659 2.76735611 -0.10478015 -1.21644304 0.75728776 -1.57542519 W 1.24148635 4.58611608 1.53369179 3.30362157 2.13293261 -2.59977684 W 3.02598936 2.72329650 -0.03624564 -6.16433104 -1.12446731 -3.45330060 W 4.40583543 4.25559716 0.90424218 1.89484439 2.84902756 3.47715638 W 0.29874826 -0.22709028 3.04521269 -4.87816721 -3.55428935 -0.64315029 W 1.36136659 1.55835534 4.24645637 2.33109662 -2.28728567 9.28346892 W 2.79619161 -0.07998135 3.20070203 3.63585920 -3.15183654 -2.87522090 W 4.20342959 1.40085166 4.49793547 2.00964941 1.10517375 1.30974903 W 0.28187239 3.01001192 2.98453339 -11.01841650 1.00228944 -3.41620307 W 1.60170120 4.37793365 4.21904386 -4.19249105 9.99612604 9.46000831 W 3.00082602 3.24624097 3.14302402 7.19808696 -6.84273401 -12.08672710 W 4.34342958 4.51014833 4.58313260 1.46961876 0.80878656 1.39343455