4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=106.723341654 stress="-57.02680661098296 4.789519009755805 -7.232321459609647 4.789519009755805 -41.721989345177796 1.3675508633712914 -7.232321459609647 1.3675508633712914 -55.72791299259618" pbc="F F F" P 0.04852473 0.05473499 -0.08438932 -88.43508100 -49.75778643 -101.75981855 P 1.63661615 1.40480033 -0.12280496 46.98020378 68.99871558 -55.55999470 P 1.29869006 0.11041876 1.26735611 117.19010173 -91.30056602 103.77772325 P -0.16466555 1.24148635 1.58611608 -75.73522451 72.05963687 53.54209000