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=57989.93398391898 stress="-254736.3190222059 80832.30628042927 -27584.231292278186 80832.30628042927 -223055.4711691009 -13958.598381643824 -27584.231292278186 -13958.598381643824 -222239.08462388767" pbc="F F F" Fr -0.03131248 -0.04676679 -0.10590510 -44057.57019330 -57406.66761488 -91128.56621390 Fr 1.59854693 1.77028562 -0.01019013 24230.68142312 55929.55857669 -47550.76042924 Fr 1.46587735 0.16280879 1.50301410 127282.34953639 -99401.06668453 79297.10296211 Fr -0.26096926 1.36345467 1.56475940 -107455.46076620 100878.17572272 59382.22368104