32 Lattice="7.647036134997922 0.0 0.0 0.0 7.647036134997922 0.0 0.0 0.0 7.647036134997922" Properties=species:S:1:pos:R:3:forces:R:3 energy=-48.82120358093022 stress="-0.005338525612035244 0.0014828486989422536 -7.908902712142058e-05 0.0014828486989422536 -0.005463138073251689 -0.0001731418087321003 -7.908902712142058e-05 -0.0001731418087321003 -0.00510881362197954" free_energy=-48.82120358093022 pbc="F F F" Cu 0.03622026 0.02528011 0.03726382 -0.15101471 -0.21525149 -0.18646116 Cu 1.89469857 1.92170701 0.00694613 0.45536813 0.35589892 -0.19269449 Cu 1.92132325 0.03217026 1.92777138 0.34578641 -0.36565442 0.31375913 Cu 0.00780514 1.87640246 1.92337965 -0.30250094 0.67465254 0.46863786 Cu 3.82489668 0.03718978 0.01493786 -0.35367996 -0.24281935 -0.20946537 Cu 5.74269929 1.89210747 0.01595884 0.16967238 0.42887771 -0.08224056 Cu 5.71379367 0.00498806 1.94305079 0.26080214 -0.30811113 0.20369015 Cu 3.83627035 1.88202265 1.93741013 -0.50169688 0.82310792 0.22505599 Cu 0.01193854 3.83676671 0.01304550 -0.15651000 -0.32119537 -0.11160634 Cu 1.94330693 5.73037041 0.02319851 0.21971787 0.12648044 -0.08543576 Cu 1.89230153 3.78561005 1.94927476 0.55475003 -0.31765487 0.21758224 Cu 0.01426179 5.72960892 1.92501054 -0.14442652 0.15238162 0.27706292 Cu 3.79199758 3.79634953 0.00909562 -0.12829120 -0.25427298 -0.04244592 Cu 5.74976517 5.75541083 0.05911637 -0.05667112 0.01373110 -0.09871143 Cu 5.71807866 3.85213815 1.91913936 0.17492457 -0.51689170 0.29036883 Cu 3.82011940 5.74631763 1.94412508 -0.35667776 0.13375019 0.16379864 Cu 0.01027749 0.02340188 3.84025900 -0.15736338 -0.27984266 -0.33870358 Cu 1.94176747 1.90986906 3.82985896 0.22498340 0.49320047 -0.44565832 Cu 1.89666633 0.02322846 5.75212346 0.38606844 -0.24442442 0.15937676 Cu 0.03064291 1.92102481 5.69818533 -0.24963487 0.35266979 0.31248128 Cu 3.80406026 0.02796267 3.81047485 -0.29110341 -0.41500074 -0.19501906 Cu 5.76918636 1.92140284 3.79177226 0.14438268 0.42234650 -0.15495219 Cu 5.69788107 0.00621051 5.70898259 0.15280138 -0.11806514 0.03507835 Cu 3.83600843 1.88372938 5.71501912 -0.38522650 0.58304957 0.23059148 Cu 0.01675509 3.83773229 3.85846260 -0.27265930 -0.42621109 -0.57197034 Cu 1.93871815 5.73282548 3.79948812 0.24405374 0.27435963 -0.21811998 Cu 1.92981117 3.83440511 5.71331765 0.50669299 -0.42415888 0.30365430 Cu 0.05632981 5.73261047 5.73955394 -0.07591989 0.14581797 0.08021900 Cu 3.80078982 3.80914089 3.79657526 -0.16022016 -0.43464832 -0.26737672 Cu 5.73408701 5.75134481 3.82826950 0.19619342 0.07756503 -0.30429908 Cu 5.70752143 3.82023719 5.74036374 0.14793629 -0.34448139 0.04847632 Cu 3.85480168 5.73983888 5.70721430 -0.44053725 0.17079455 0.17532703