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=72724.67956482482 stress="-7954.125806967353 -1700.142617404066 -122.31959076452551 -1700.142617404066 -13773.789187765962 -4158.911031220207 -122.31959076452551 -4158.911031220207 -10947.433371255038" pbc="F T T" U 0.10882905 0.13202009 0.29509943 -111608.70496389 -215551.37655542 -141439.35307842 U 1.20369121 1.39052559 -0.14284252 96811.64727029 80123.05609842 -49559.59899616 U 1.61396875 0.11564357 1.25345778 70510.06363828 -22805.92072665 42904.39753489 U 0.06147043 1.40524783 1.30616908 -55713.00594468 158234.24118365 148094.55453970