32 Lattice="7.828108862597123 0.0 0.0 0.0 7.828108862597123 0.0 0.0 0.0 7.828108862597123" Properties=species:S:1:pos:R:3:forces:R:3 energy=-121.83338934590394 stress="-0.006228307235718623 0.00749000218574538 -0.0030005809700722422 0.00749000218574538 -0.002134546137446144 5.522474640504067e-05 -0.0030005809700722422 5.522474640504067e-05 -0.004479709630767254" free_energy=-121.83338934590394 pbc="F F F" Cu 0.02384076 0.00272036 0.03721327 0.81147101 0.75394132 0.51244908 Cu 1.95769570 1.94045931 0.00341194 -0.18125367 -0.06949793 -0.01736841 Cu 1.96205302 0.02827754 1.94620712 -0.38051925 0.29612101 -0.19697481 Zr 0.02144176 1.93528575 1.99114960 -0.45913786 -1.34925201 0.51020865 Zr 3.90789366 0.06534520 0.02195568 -0.80476430 -0.21729233 -0.89891419 Cu 5.87488510 1.98803613 0.02608316 -0.39093980 0.21855643 0.39654462 Zr 5.85132467 0.00969449 1.99596654 1.69386724 -0.38466647 0.20498662 Zr 3.89506363 1.91917757 1.96664267 0.25211289 1.93424621 -0.15379360 Zr 0.02685520 3.91957679 0.00207062 -0.99600999 -0.85585601 -1.64008535 Zr 1.96775463 5.88301493 0.00800159 1.59836342 0.88912084 -0.97303173 Zr 1.94176849 3.94554071 1.99193099 1.68573919 -0.99837815 0.44502667 Zr 0.02058375 5.88087458 1.98245969 -2.04772270 1.33360861 0.81691951 Cu 3.89689096 3.88537115 0.03065421 0.42288636 -0.00763824 0.39781831 Cu 5.87414640 5.88498547 0.02130763 -1.00562038 -0.79621305 0.73675817 Cu 5.86257780 3.88786603 1.96387813 -0.89685426 0.25907557 0.04009521 Cu 3.93531892 5.85556463 1.92465906 0.61830615 -0.81362048 -0.14933884 Cu 0.00534434 0.02290345 3.88362613 0.90367072 0.32067080 0.13107021 Cu 1.99295550 1.97651379 3.88728985 -0.85021998 -0.46911709 0.36845931 Cu 1.88919908 0.01764092 5.87442341 0.00772308 0.55371885 -0.47787865 Zr 0.01663062 1.92003086 5.83700322 -0.00944201 -0.27549230 -0.62757457 Zr 3.87904287 0.00721717 3.93369173 -1.60706864 -1.38590769 0.09558124 Cu 5.88258357 1.97256905 3.93399572 0.19121154 0.35934847 -0.17847464 Zr 5.86713959 0.03353942 5.85592860 0.89734029 -0.05793039 0.02572847 Zr 3.89644322 1.96160844 5.83669185 -0.59895764 -0.08094321 0.95609042 Cu 0.01698983 3.90808970 3.91511904 -0.47027738 -0.20068165 0.10628160 Zr 1.95141555 5.86224045 3.89612269 1.70393234 1.33297200 0.12966399 Zr 1.98680504 3.91437835 5.85310742 0.52629383 -0.02550199 0.80627692 Zr 0.01019384 5.85235729 5.84792148 -0.82266468 0.11402101 0.07992991 Cu 3.93098260 3.90899813 3.92458291 1.10556546 0.52266024 -0.25868453 Cu 5.84137747 5.89341626 3.91425246 -1.00285966 -0.77850434 -0.04981021 Zr 5.84632756 3.87785050 5.87768266 -0.02133249 0.54872939 -0.59089977 Cu 3.91592813 5.90179206 5.87579927 0.12716115 -0.67029740 -0.54705959