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=10.5938882366144 stress="-63.72748658612244 16.45340113026419 7.666508835302864 16.45340113026419 -72.41947856347437 32.67925974545893 7.666508835302864 32.67925974545893 -104.36952482976093" pbc="F F F" U -0.25354363 -0.01806569 -0.07998135 -10.79169605 -13.21672621 -11.27812910 U 1.70070203 1.20342959 -0.09914834 17.66432204 30.88016258 -54.60247726 U 1.49793547 0.28187239 1.51001192 20.38009373 -47.96845961 55.07821614 U -0.01546661 1.60170120 1.37793365 -27.25271972 30.30502325 10.80239022