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=169.874659156 stress="-65.49151419242578 0.4131346341814314 -0.7796528482458783 0.4131346341814314 -59.66933036034868 0.3761335704179894 -0.7796528482458783 0.3761335704179894 -62.90724599241524" pbc="F F F" Br -0.14801295 -0.02432459 0.06329927 -92.56116965 -67.97627457 -86.23061060 Br 1.43745442 1.27846858 -0.00548572 71.93548593 81.60256655 -74.22408716 Br 1.34126820 -0.15859300 1.31668137 86.54233507 -91.42900217 77.12620671 Br -0.08013605 1.24396547 1.59073906 -65.91665136 77.80271020 83.32849105