32 Lattice="50.60998344421387 0.0 0.0 0.0 50.60998344421387 0.0 0.0 0.0 50.60998344421387" Properties=species:S:1:pos:R:3:forces:R:3 energy=-79.23287721175318 stress="2.9598181861680267e-05 -1.9803015401532836e-05 4.054000817700035e-05 -1.9803015401532836e-05 1.5348553012782204e-05 6.5012177974053575e-06 4.054000817700035e-05 6.5012177974053575e-06 -1.0480427982915463e-05" free_energy=-79.23287721175318 pbc="F F F" Cu 25.09837022 25.45240902 25.20184912 0.58915657 0.35516917 0.33806285 Cu 26.86453901 27.24941682 25.13825843 0.72045694 -0.85494941 -0.69151294 Cu 26.94821756 25.33230600 27.06539234 0.74838186 0.01767066 -0.32776356 Cu 25.36032611 27.07997175 26.93098536 -0.91204429 0.55839229 0.81862243 Cu 29.10177298 25.11095897 25.46674369 -3.50118435 -0.81985275 -1.30692742 Cu 30.42598519 26.81560667 25.24916333 0.74119135 1.98661961 0.39935426 Cu 30.49417730 25.11912861 27.04300412 1.20732019 0.65447128 2.63436434 Cu 28.89092547 27.30071248 27.35741775 0.38574703 -1.66352813 -0.75051218 Cu 25.07677947 28.98195178 25.11966969 0.76464166 -0.00008527 0.97154983 Cu 27.26432617 30.54248423 25.69402960 -0.74825944 1.75337439 -1.15768369 Cu 27.13519256 28.73280846 26.86496057 -1.51996639 -0.17067531 2.86148974 Cu 25.17905256 30.91151738 26.93583269 0.63004658 -0.92808065 0.34771385 Cu 28.90945246 28.86651075 25.39473928 1.18700948 -0.46369646 -0.43398474 Cu 30.87838253 30.44151793 25.41417904 -0.41092616 0.99660375 -1.29904201 Cu 30.93345709 29.13766350 27.12243906 -0.23789281 -2.31792550 1.60055004 Cu 29.13021344 30.69775659 27.14912864 -0.20744719 0.91915614 -0.76088279 Cu 25.36529291 25.47481953 29.11877884 -1.98046731 -3.80270958 -2.50802578 Cu 26.92017596 26.93107193 28.93691584 4.06813099 3.11893710 -3.00209164 Cu 27.26870233 25.39630919 30.62724643 -0.86721589 -0.76703288 2.16280989 Cu 25.53592112 27.01141711 30.52093226 -2.07805172 2.86708831 4.04605834 Cu 28.69603314 25.07019465 29.03345789 1.79816145 0.42966352 -1.86928541 Cu 30.49528732 27.45022612 29.10316160 1.38069609 -0.64678788 -1.26464033 Cu 30.97730374 25.45952343 30.68966447 -1.02116982 0.73512724 -0.78446149 Cu 28.98105668 27.04008643 30.65720643 -0.81626843 0.50679315 0.61168746 Cu 25.20020721 29.05099393 28.72469759 0.80333206 -0.27758663 -0.43075325 Cu 27.18658890 30.97556040 28.73247649 -0.74760114 -0.66044606 0.03565772 Cu 26.77316305 29.06274584 30.70258265 0.77900928 -0.13145880 -0.69988802 Cu 25.05682771 30.70504939 30.48570707 0.57032698 -0.05674526 -0.52733327 Cu 28.82920745 29.19264083 28.79364134 -0.19073123 -0.55939182 1.80613331 Cu 30.90253457 30.90425437 28.74989679 -0.45315412 -0.59652078 0.62452800 Cu 30.97411222 29.06608922 30.71951373 -0.97173097 0.42414956 -0.46870123 Cu 28.55551240 30.70802672 30.92851412 0.29050276 -0.60574298 -0.97509232