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=94.74255545629094 stress="-215.80206141571472 -2.237089613186633 -17.341265676536032 -2.237089613186633 -499.5638609399759 -253.59056864396965 -17.341265676536032 -253.59056864396965 -448.0835856762741" pbc="F F F" Ar -0.14459490 0.11115480 0.11044915 -80.36725062 -292.13794271 -283.74042062 Ar 1.70960170 1.18822856 0.04092907 74.95530431 63.63912549 -55.97409518 Ar 1.28829595 -0.16490224 1.64041416 51.14557079 -64.96269575 97.59208485 Ar -0.22187219 1.51878885 1.32834452 -45.73362448 293.46151296 242.12243096