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=833.0585173085982 stress="-3998.6232767991146 -3559.224636292505 119.97178968119488 -3559.224636292505 -5346.467823704452 -272.87464800528113 119.97178968119488 -272.87464800528113 -1306.9723560707687" pbc="F F F" In 0.23577511 0.14284204 -0.11051793 -3260.91087176 -3894.98509286 -456.58850661 In 1.26844800 1.38805262 -0.05444732 3432.29250165 3877.79504534 -349.80615631 In 1.55472104 -0.11673640 1.47306147 344.60863001 -337.76801051 182.61692839 In 0.23641907 1.35458839 1.55257092 -515.99025990 354.95805802 623.77773453