3 Lattice="4.525274952317816 -2.3429703101167223e-20 0.0 -1.4742900838138538e-18 4.525274952316762 0.0 -1.9705501067104525e-17 -6.689302816767616e-37 18.705239533417508" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-8.818457625661738 stress="4.221675551160287e-05 0.0 4.447429393118364e-23 0.0 4.221675551162029e-05 0.0 4.447429393118364e-23 0.0 4.147308670652711e-06" dipole="1.0399412060192763e-13 -2.7429235855518324e-15 -4.514556813389987e-11" magmom=0.0 free_energy=-8.824451785216228 pbc="T T F" Al -0.00000000 -0.00000000 9.35261977 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 Br -0.00000000 2.26263748 10.54006086 0.00000000 0.00000000 0.00000000 -0.00005960 0.00000000 Br 2.26263748 0.00000000 8.16517868 0.00000000 -0.00000000 0.00000000 0.00005960 0.00000000