3 Lattice="3.979087752555365 1.2314740896047315e-18 0.0 -1.989543876277683 3.445991077600474 0.0 0.0 0.0 18.028870821332553" Properties=species:S:1:pos:R:3 energy=-8.66600763082322 dipole="-4.965391644049913e-15 -6.357594150751334e-16 6.996950459335649e-15" free_energy=-8.67977995369408 pbc="T T F" Al -0.00000000 -0.00000000 9.01443541 Br 1.98954388 1.14866369 10.52287867 Br -0.00000000 2.29732739 7.50599215