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=53.886162797054915 stress="-268.47536317759 -73.3930272135808 47.35618146833637 -73.3930272135808 -468.1206379558471 32.831467788859584 47.35618146833637 32.831467788859584 -513.7295638823913" pbc="F F F" Fe -0.18564671 0.11115480 0.11044915 -113.49086436 -203.53297223 -127.60974460 Fe 1.41826113 1.17693662 0.06110600 149.52105820 199.68229557 -256.52612048 Fe 1.47413972 0.01872586 1.49443895 23.49666041 -166.58136089 200.09380950 Fe -0.01190878 1.51878885 1.32834452 -59.52685425 170.43203754 184.04205558