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=46.38574593465555 stress="-9.433659656928914 2.1473294415040525 1.4452811239565082 2.1473294415040525 -9.331921298221133 1.7723205693248505 1.4452811239565082 1.7723205693248505 -9.064652274653293" pbc="F T T" Fe 0.11893942 -0.27043062 -0.08859103 -95.45296300 43.61764862 -3.52903884 W 1.53926819 1.73010044 0.10695920 123.44969179 -65.56105412 -4.84156826 W 1.62528982 0.12033173 1.67828948 57.99259300 23.41914414 -23.29283587 Fe 0.21182891 1.30560606 1.23241985 -85.98932180 -1.47573864 31.66344297