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=49.012972551346145 stress="-11.005800234943912 -1.5816449787402613 -0.6558564175335199 -1.5816449787402613 -8.146888748386036 0.9524153889718042 -0.6558564175335199 0.9524153889718042 -11.425392655789826" pbc="T F T" Fe 0.15597669 0.29553441 -0.15874699 -91.28461183 -152.06144888 12.59708624 V 1.22164374 1.20763472 -0.10143855 88.66778525 134.10060986 -1.40152411 Fe 1.20280085 0.12771106 1.27521450 35.85990041 -70.73388737 11.99047123 V -0.14610980 1.26269441 1.52805905 -33.24307383 88.69472639 -23.18603336