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:Z:I:1:forces:R:3 energy=2910806.370686384 pbc="T T T" Br 0.05791835 0.05068357 -0.01399360 35 -10985909.96087305 -633158.68835408 -13823523.56400455 Br 0.86936862 0.50143299 0.04790177 35 5051642.10501348 5002271.68333561 -4932278.11597110 Br 0.50052910 0.02600492 0.64904959 35 13624610.87844392 -18315346.59414706 11918673.71373515 Br 0.14707285 0.66767825 0.95654709 35 -7690343.02258436 13946233.59916553 6837127.96624050