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=-11.920004916494145 stress="12.239423316492374 -0.3717594974902577 3.323736535967053 -0.3717594974902577 12.70323374615473 1.7161610733104897 3.323736535967053 1.7161610733104897 9.423095564993599" pbc="F F F" B -0.26460689 0.20020259 -0.15033272 4.86606248 3.78270974 4.51503373 B 1.60470978 1.26898726 0.23034010 -4.53729835 -1.89948780 2.09869839 B 1.21709627 0.18333836 1.51888536 -3.69238557 5.02048830 -3.98844524 B 0.24473802 1.73393203 1.20739627 3.36362144 -6.90371025 -2.62528688