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=-13.33346560131719 stress="7.637618321967361 -0.16590617168890953 -0.25983225743031824 -0.16590617168890953 8.022941825174343 0.10528415614920927 -0.25983225743031824 0.10528415614920927 6.741273482756302" pbc="F F F" Pt -0.20414597 -0.05190546 0.22094491 2.12439756 2.53995203 2.06537000 Pt 1.73171545 1.68190327 -0.17816502 -1.86776360 -1.82256301 2.20009045 Pt 1.71219253 -0.07514625 1.62990665 -2.08570711 1.90899815 -2.10232367 Pt -0.21779550 1.78278197 1.56210000 1.82907315 -2.62638717 -2.16313678