32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-33.39025276466472 stress="-0.04468469728363209 0.045376187026362744 0.007849147518642241 0.045376187026362744 0.05780139408126245 0.024822718510313754 0.007849147518642241 0.024822718510313754 -0.08503949889526674" free_energy=-33.39025276466472 pbc="F F F" H 0.13918523 0.15050642 0.00239915 1.77364844 1.81072743 1.34795573 Cu 1.62203884 1.51937115 0.24421963 -2.85326343 1.40630052 -2.64124657 Cu 1.59176916 0.02202029 1.51477119 -5.28900844 -0.37367085 2.31384759 H 0.29553441 1.34125301 1.50601457 1.81756242 -1.59524816 -0.33724491 Cu 2.70763472 0.08948729 0.02805905 3.77236901 -0.58044278 -3.02091329 H 4.19915387 1.64120549 0.04683757 -0.56930589 -2.21608504 1.43848018 Cu 4.43970572 0.18292312 1.50795275 1.02396102 2.66685710 -1.11310024 H 2.64982536 1.53120867 1.30513478 0.99688832 0.60828054 -0.57765422 Cu 0.32207394 3.15944719 0.21835439 -1.07870839 3.97569513 -0.52145339 H 1.15399764 4.75685297 0.12784938 -1.50375665 -1.60648987 0.70071775 Cu 1.37987377 2.98887480 1.73666665 0.11624646 -3.84863760 -1.97578737 H 0.01942903 4.79417082 1.52909258 1.50044053 -1.77600054 -1.56163661 H 2.81105804 3.22875281 0.21672186 0.05856072 1.30092934 1.14073930 Cu 4.20677130 4.57736569 0.22577322 1.59942874 -0.48020829 -2.95008799 Cu 4.64977756 3.09364432 1.77354104 3.23159963 -5.05693970 -2.28763664 Cu 3.03273964 4.57675992 1.38803420 -3.65999286 1.75843081 -2.06469361 H 0.23384252 0.22745837 2.80691229 0.53962639 0.59687526 -2.05179384 H 1.90895391 1.44564997 2.74841186 -1.37963709 0.62085731 1.98566382 H 1.49214527 0.28201336 4.26680101 2.70902787 -0.22207272 -1.29206072 H 0.19215061 1.66717744 4.64995810 0.69351824 2.24206425 -1.00548485 Cu 2.75491735 0.16523617 2.88290997 1.73494760 1.58882037 4.62263311 H 4.37846166 1.35733739 3.18360837 -0.72845915 -0.69400221 -0.49830904 H 4.35872431 0.14592855 4.32706660 -1.75011598 0.89032989 -0.85823742 H 3.18041514 1.01246166 4.43965554 0.03165046 -1.14933857 -0.09318107 Cu 0.15154029 2.79717758 3.29811016 -3.64593590 -0.26612102 2.92487676 Cu 1.57473240 4.26010779 2.99582161 -1.73505732 6.20618035 3.94963337 Cu 1.53066631 2.72754451 4.73715536 0.83790906 0.40072919 1.76087753 H 0.02704010 4.28209294 4.48656723 1.07062445 -2.33224599 -1.82777019 Cu 2.98688953 3.20470050 2.77493780 0.19402452 -5.34455973 2.95609197 Cu 4.62749873 4.49397598 2.90357991 2.46554695 4.42897124 1.07099663 Cu 4.38766510 3.21338862 4.36129912 -1.44175083 -0.69320543 2.13643926 H 2.70918501 4.46832450 4.62370952 -0.53258891 -2.26678022 -1.67066102