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=31.27717536506661 stress="-141.78314005119242 58.62725806047397 2.5060616199831998 58.62725806047397 -123.81286358814921 8.620748704888882 2.5060616199831998 8.620748704888882 -79.111492852082" pbc="F F F" Pd 0.23171545 0.18190327 -0.17816502 -23.43397439 -20.74914899 -25.22994602 Pd 1.71219253 1.42485375 0.12990665 29.70133781 31.70304188 -24.48835046 Pd 1.28220450 0.28278197 1.56210000 84.62326537 -92.84307344 33.62867990 Pd 0.13362859 1.32702941 1.57034430 -90.89062879 81.88918056 16.08961659