32 Lattice="7.827204083621322 0.0 0.0 0.0 7.827204083621322 0.0 0.0 0.0 7.827204083621322" Properties=species:S:1:pos:R:3:forces:R:3 energy=-139.0627986995731 stress="-0.1538309110052154 -4.383105090938302 0.7617714028020863 -4.383105090938302 -1.6524167057644092 0.11942047335883643 0.7617714028020863 0.11942047335883643 -0.9913725205991835" pbc="F F F" Zr -0.03045396 0.02831941 0.02158985 -0.10333532 -0.88993657 -0.29107960 Zr 1.92365991 1.98776646 -0.02995370 0.74554145 -0.50716861 -0.87991147 Cu 1.93093872 -0.00745875 1.98373339 0.48761245 0.10662770 -0.22619958 Zr 0.02872408 1.94652226 1.89597089 -1.76988808 1.31424824 0.31709928 Cu 3.90801745 0.00778640 0.00073624 0.09782722 0.76494709 0.83450229 Cu 5.86493706 1.94176743 0.02265334 -0.60277161 -0.28036228 0.59951560 Zr 5.87165824 -0.00092751 1.98575334 -0.80112818 0.04044460 -0.74848857 Cu 3.91209559 1.94173123 1.94206140 -0.08651228 -0.58823887 -0.28580585 Cu -0.03649644 3.92362090 -0.03130356 0.46447387 0.23306267 0.51132814 Zr 1.97518200 5.83567640 -0.00783773 -0.43682123 0.22032704 0.26512090 Cu 1.88528021 3.87837531 1.98712033 0.12946695 0.69759549 -0.01856269 Zr -0.00874353 5.86700382 1.98028605 0.44157124 -0.72422155 0.36640120 Zr 3.90083816 3.88971260 -0.01104465 0.29953466 -0.36500560 -0.62545017 Zr 5.80209374 5.88927793 0.03157483 0.10505430 0.68034739 -0.14576830 Zr 5.87398050 3.91824574 1.97200072 1.48291541 0.30783735 -0.39778844 Cu 3.95119691 5.86426524 1.96003312 -0.29229216 -0.12959448 0.18695607 Zr -0.03487862 0.03049312 3.90299196 -0.87756465 -1.08420838 0.22869645 Zr 1.97493553 1.93730505 3.92604639 0.36167463 -0.24239787 -0.46542727 Zr 1.93503798 -0.00710168 5.89513207 0.49148858 -0.15926365 0.65290435 Cu -0.02062873 1.94299633 5.83245828 0.34961125 0.13117833 -0.33854168 Cu 3.88098996 -0.02256996 3.96863190 0.26451025 0.35977480 0.00462007 Zr 5.85983149 1.93596470 3.89463755 0.76757406 -1.90286208 1.01072342 Cu 5.85325578 0.02744549 5.89682728 -0.76902996 0.75831961 -0.79088189 Cu 3.88961926 1.99579370 5.87768986 0.33970883 -0.63201627 0.04406231 Cu 0.01811004 3.93653830 3.88906384 0.42250715 0.37736912 0.23586624 Cu 1.95801146 5.90697184 3.92824930 -0.28993032 -0.57589032 0.00075930 Zr 1.97495371 3.92682967 5.89263419 -1.24820612 1.06333545 1.15865286 Cu -0.01456190 5.88122568 5.85368131 0.85781208 -0.81866923 -0.84759793 Zr 3.90798707 3.89978744 3.93516856 -0.65971860 1.89007226 -0.72281417 Cu 5.84605161 5.85552379 3.98824477 -0.50563861 -0.35512137 -0.00765011 Zr 5.87928690 3.88937257 5.87095846 0.28377250 0.63966427 0.90636721 Cu 3.93099573 5.83164855 5.89018657 0.05018023 -0.33019428 -0.53160796