32 Lattice="7.980229751848054 0.0 0.0 0.0 7.980229751848054 0.0 0.0 0.0 7.980229751848054" Properties=species:S:1:pos:R:3:forces:R:3 energy=-122.25532775102488 stress="-0.004284013635133276 -0.0008604861792830104 -0.0027270373244519743 -0.0008604861792830104 -0.00022686747479396828 6.712140454323448e-05 -0.0027270373244519743 6.712140454323448e-05 -0.001208216984438849" free_energy=-122.25532775102488 pbc="F F F" Cu 0.01382591 0.01361392 0.03292249 0.83503766 0.46565703 0.67866323 Cu 1.97205258 2.01010453 0.03915034 0.07766242 0.22576999 0.66808721 Cu 2.00565913 0.01869215 1.98914228 0.17128301 0.13732641 -0.60846529 Zr 0.01382889 1.92717675 1.96670513 -0.38720850 0.27364387 -1.55597793 Zr 3.96766238 0.00230422 0.01511934 -0.62030609 0.85902273 0.37412976 Cu 6.02348544 1.99165224 0.03214623 -0.72592607 0.34908845 0.56171475 Zr 5.96722451 0.02986711 2.01752366 0.25231795 0.63976432 0.05463320 Cu 3.96496827 2.00657902 2.02883373 0.10483971 0.36413628 -0.82762600 Cu 0.01072530 4.03578415 0.01747036 0.66325872 -0.04780249 0.83806473 Zr 2.05126888 5.98319999 0.00661717 -0.12406987 -0.66018475 0.26621819 Cu 1.95429116 4.00051355 1.98331548 -0.06548084 -0.10862751 -0.89321739 Cu 0.02424057 6.00275269 2.02703550 0.52173181 -0.62876201 -0.45947985 Cu 4.03067489 3.95140695 0.02918104 0.11162634 -0.49279497 0.72270638 Zr 5.97156078 6.02055906 0.01006400 -0.49719966 -0.80070954 0.36459973 Cu 5.95204330 3.95108944 1.98364040 -0.25317409 -0.41354894 -0.17430845 Zr 3.99659599 5.98135148 2.03580540 0.67369938 0.42385348 -0.30251169 Zr 0.04799714 0.01483356 4.02658200 -0.15971637 -0.66693237 0.33708310 Zr 2.01901745 1.99249899 3.96503790 -0.15014749 -0.36195647 -0.68794890 Cu 2.01389613 0.01136141 5.92905372 -0.27950389 0.25734254 0.13737584 Cu 0.02972167 1.98863804 5.98668241 0.46453170 -0.17073254 -0.32841219 Zr 3.97064767 0.01944911 3.99507333 0.10053689 -1.29292188 -0.23878774 Cu 5.91731113 2.01318796 4.00394313 0.09957567 -0.24621943 -0.36416832 Cu 6.01781901 0.03820870 5.98044363 -0.34477096 0.65662077 -0.65973586 Zr 3.96869229 2.00421965 5.96287223 0.51596037 -1.32583994 2.09396868 Zr 0.00718771 4.01937737 3.98485771 -1.68332416 0.22325915 -0.15859991 Zr 1.97775530 6.01471824 3.96649550 -0.97039345 1.78400668 -0.56495989 Zr 2.02411996 4.03556963 6.02240084 -1.24096286 -0.26139027 2.24655987 Cu 0.03953848 5.98507439 5.96640020 0.27322660 -0.08744167 -0.10823124 Zr 4.02735069 3.98743357 3.98159490 1.09422743 -0.29642705 -2.08252623 Cu 6.02170591 5.95172416 3.96555802 -0.20635306 -0.20424138 -0.33117867 Zr 5.98081339 3.94620413 5.96513662 1.23800651 -0.00165129 0.28315067 Zr 4.00260166 6.01411735 5.98341766 0.51101518 1.40869282 0.71918023