4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=995.5275978439576 stress="-220.92529015690604 -42.608902184572976 78.51756831526899 -42.608902184572976 -553.6696745807146 30.980480692393424 78.51756831526899 30.980480692393424 -481.8895039859405" pbc="F T T" C 0.22094491 0.23171545 0.25224757 -274.87952222 -82.64617173 -71.36645495 C 0.57183498 0.96219253 -0.07514625 115.55763040 -392.89157045 303.06173144 C 0.87990665 -0.21779550 1.03278197 893.09899767 436.78238851 -499.06876814 C 0.06210000 0.93215332 0.57702941 -733.77710585 38.75535367 267.37349165