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=12.98238208700671 stress="-4.09075932291848 0.07322678459031223 -0.2541416822593568 0.07322678459031223 -4.383228119565267 -0.09651687663756094 -0.2541416822593568 -0.09651687663756094 -4.5588092507721205" pbc="T T T" V -0.14459490 0.11115480 0.11044915 12.07308653 -14.37806472 -3.06174060 V 1.70960170 1.31143450 -0.16166483 -19.78920715 15.34111598 3.49640479 V 1.28829595 0.03769167 1.64041416 -5.40457471 -9.78077470 -6.27348996 V -0.22187219 1.51878885 1.32834452 13.12069533 8.81772344 5.83882577