16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-47.357419665866075 stress="-0.0003642129850210441 0.00012333746395658368 -0.0006607175408415857 0.00012333746395658368 -4.894166305213058e-05 -0.000191641568956302 -0.0006607175408415857 -0.000191641568956302 -0.0001893893701194193" free_energy=-47.357419665866075 pbc="F F F" Cu 20.99451428 21.14001646 20.89976234 -1.34250710 -0.40423547 -3.42840535 Cu 22.31668137 22.41986395 22.24396547 8.98987118 4.79804710 12.12306779 Cu 24.09073906 21.27219963 20.93381326 -3.91479207 0.37369624 -0.14239244 Cu 25.37778556 22.75978669 22.22592512 7.21218596 -7.44500630 12.05739505 Cu 20.98574937 24.18365717 21.20288723 -9.97011791 -7.26361013 -5.40318506 Cu 22.58343331 24.99928362 22.44809454 -0.40893538 9.54196321 13.68131203 Cu 24.22094491 24.23171545 21.18190327 -6.75489261 -3.13990818 -18.43946637 Cu 25.32183498 25.71219253 22.42485375 3.14816419 2.69521297 7.70874456 Cu 21.12990665 20.78220450 24.28278197 3.82850949 4.75932157 -1.94313707 Cu 22.56210000 22.63362859 25.22788108 1.99383114 -2.31297096 0.84087945 Cu 24.07034430 21.04852473 24.05473499 -2.17325252 5.28221335 -3.38452025 Cu 25.41354615 22.91848853 25.40480033 4.28426191 -6.02639545 5.33171559 Cu 20.87719504 23.79869006 24.11041876 -3.20145471 -2.93055509 -7.65634924 Cu 22.26735611 25.33533445 25.25149828 5.28290348 0.78871995 -0.03858241 Cu 24.08611608 24.03369179 24.02598936 -9.56616608 -5.21243636 -15.55426994 Cu 25.20782989 25.46375436 25.28376908 2.59239102 6.49594355 4.24719366