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=63.577320696181395 stress="-413.3193656746979 -138.4719772959236 58.94925763518398 -138.4719772959236 -259.5422191292306 -3.3356676283002002 58.94925763518398 -3.3356676283002002 -277.99293413954786" pbc="F F F" Nh -0.24190323 0.12283762 -0.23129050 -192.18163984 -156.09179662 -35.25256156 Nh 1.31488300 1.20119420 -0.20772684 236.28336692 151.49112306 -139.61390943 Nh 1.69726328 0.06523555 1.45496393 37.22592035 -61.38709317 62.68446712 Nh 0.08652854 1.52680613 1.33385171 -81.32764743 65.98776674 112.18200387