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=26.323430132243928 stress="-144.80269848493327 55.22803690784733 3.071782204990029 55.22803690784733 -125.45118709545994 7.978586602176591 3.071782204990029 7.978586602176591 -88.61102896281598" pbc="F F F" W 0.23171545 0.18190327 -0.17816502 -25.33136393 -22.60658316 -28.74896975 W 1.71219253 1.42485375 0.12990665 32.40254508 33.50827557 -26.82890811 W 1.28220450 0.28278197 1.56210000 83.70181041 -92.20599389 36.65344238 W 0.13362859 1.32702941 1.57034430 -90.77299156 81.30430147 18.92443549