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=64.69048998130135 stress="-4.48398611286617 -0.8120709652393978 0.9444113806262886 -0.8120709652393978 -7.441059333576657 0.5761780739852281 0.9444113806262886 0.5761780739852281 -6.966117043402301" free_energy=64.69048998130135 pbc="F T T" Au 0.22094491 0.30205975 0.18190327 -41.52900860 -11.47414605 -11.80223586 Au 1.32183498 1.71219253 -0.07514625 42.76099742 -26.95344229 20.41611064 Au 1.62990665 -0.21779550 1.78278197 47.07008019 36.80474361 -31.47280518 Au 0.06210000 1.68215332 1.32702941 -48.30206901 1.62284473 22.85893040