32 Lattice="8.124695887283888 0.0 0.0 0.0 8.124695887283888 0.0 0.0 0.0 8.124695887283888" Properties=species:S:1:pos:R:3:forces:R:3 energy=-104.85419051420529 stress="-0.007659658684611601 0.0010886139362172968 -0.0005851425293662029 0.0010886139362172968 -0.007834014874530615 0.00016311161419545588 -0.0005851425293662029 0.00016311161419545588 -0.006269807147188366" free_energy=-104.85419051420529 pbc="F F F" U 0.01505590 0.03007217 0.02428981 0.73098533 0.71748788 0.73638726 U 1.99546936 1.99714080 0.03371528 -0.29145123 -0.26923272 -1.62109128 U 2.04926775 0.00412657 2.04212607 -0.33904567 -1.61607475 -0.20671876 U 0.03843805 2.03235087 1.99351688 -1.65195311 -0.40198866 -0.33142312 U 4.03842386 0.00894929 0.01132788 0.18157326 0.26608925 0.30510498 U 6.05704412 2.07798404 0.02101902 -0.32691732 0.02048617 0.29774693 U 6.05404272 0.00808302 2.04032022 -0.25700785 0.33038577 -0.06520050 U 4.02186102 2.00187355 2.04014713 0.83677838 -0.58979676 -0.59895871 U 0.02365761 4.04770837 0.01283300 0.25788460 0.30245581 0.26167288 U 1.99499731 6.12553195 0.01902912 -0.13354522 -0.35154934 0.42521827 U 2.05893542 4.08998277 2.03978391 -0.61666054 0.79723160 -0.65118879 U 0.01720864 6.05357780 2.00433662 0.34847953 -0.25637282 -0.20642308 U 4.07784134 4.07215948 0.02853906 0.50566184 0.37407117 -1.35974073 U 6.11504817 6.12318309 0.00226762 -1.02341627 -1.05420811 1.06303559 U 6.08601312 4.09162674 2.00250138 1.26674267 0.41258080 -0.41318003 U 4.02520851 6.07503677 2.06380245 0.47283701 1.45095264 -0.36662684 U 0.02121207 0.01685590 4.07948817 0.38899080 0.29944452 0.16705655 U 2.01392336 2.05404631 4.07585947 -0.52983665 -0.70423225 0.76716397 U 2.05770336 0.03478836 6.10662543 -0.11640710 0.33240827 -0.36825319 U 0.01713795 2.07822157 6.06164979 0.21873706 -0.09046297 -0.23188937 U 4.09207115 0.01003130 4.07763039 0.41042826 -1.31993765 0.46438900 U 6.12840365 2.01184112 4.02483020 1.18968946 -0.25364881 0.37047205 U 6.06806372 0.02817514 6.08585275 -0.83461762 0.82411285 -0.87877937 U 4.05554921 2.03183179 6.12602758 0.39265385 -0.33204710 1.20830792 U 0.03346015 4.03008678 4.05008978 -1.39587975 0.49101164 0.44143560 U 2.06182153 6.12761073 4.07831080 -0.35110276 1.22798597 0.54950720 U 2.02256946 4.06202451 6.10810683 -0.31273315 0.52332457 1.28980990 U 0.04058942 6.12726263 6.10252027 0.95225077 -0.95420783 -0.99895766 U 4.09846144 4.05611716 4.06031518 0.84033968 0.59280882 0.84059889 U 6.12227458 6.12315378 4.12075807 -0.53018518 -0.55461584 0.10815086 U 6.10122851 4.02607939 6.09536787 -0.44238355 0.17808743 -0.50922021 U 4.04440696 6.09133952 6.10161058 0.15911049 -0.39254955 -0.48840620