64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=163.547057478303 stress="-0.0016459752538056105 -0.00021991372777576272 -0.00017139941726664626 -0.00021991372777576272 -0.0020553440838499324 0.000907236698624511 -0.00017139941726664626 0.000907236698624511 -0.0019820411625206895" pbc="F F F" Cu 35.22086729 34.98310996 34.77096654 -0.06474291 0.15269964 -0.18311289 Cu 36.59933616 35.93572417 35.98055861 -16.86219312 -40.32805654 24.14784595 Cu 37.14715992 37.22516294 35.23402360 -0.67370168 16.26089268 -45.24361548 Cu 37.93229823 38.31172061 36.19084223 16.57104772 24.34598967 20.81601520 Cu 36.90181109 35.14771729 38.20399864 2.85128474 0.94087861 -0.90907782 Cu 39.35802973 36.07349581 38.45018589 0.15599647 -0.18348063 -0.63761471 Cu 34.76884260 38.20444678 38.02575960 0.24576593 -0.04178800 -0.66281251 Cu 36.55604684 39.07636534 38.99475015 -39.63947468 121.46431395 -83.43358210 Cu 40.23975440 35.55577733 35.25284888 -0.40071439 0.46847949 -0.22617752 Cu 41.57116719 36.00454661 36.78983070 -3.35778969 1.47789690 -3.30278910 Cu 42.51432400 36.93324962 34.69615509 -0.39260654 0.00639839 0.59001135 Cu 43.42712388 38.91385061 36.22088890 3.55676829 -5.42525530 -5.16288332 Cu 42.73578848 35.79150318 38.24752218 -96.06537644 -41.66761466 -38.26265570 Cu 43.94092265 36.28827392 38.75986480 101.21378051 40.03643317 39.00549971 Cu 39.59592731 38.07886991 37.48008817 -21.92792237 -5.05806970 -27.93470299 Cu 40.62053955 38.32819731 38.74879789 23.44565165 5.28383341 27.83322138 Cu 34.82624793 39.49365118 35.42673195 -19.02669228 -19.74693669 -17.09395956 Cu 35.82447290 40.48365875 36.32972720 19.92926872 19.00063170 17.88731187 Cu 37.04272155 42.62085647 34.71585688 0.04190115 -0.55184247 0.74389707 Cu 38.61643991 43.32327578 36.40123177 -78.90304937 47.72613880 -53.53453304 Cu 37.95366604 39.88968876 37.71888199 -24.04663220 -16.84143515 -13.27598411 Cu 39.18297782 40.79320854 38.39174556 25.19681051 17.99895264 13.21549508 Cu 35.64061762 42.55244599 37.88440231 0.29443100 -0.99580821 -0.78888391 Cu 36.05879578 43.59193131 39.57757453 -1.66951818 3.22837537 0.86615410 Cu 39.90822097 40.66544620 35.04279382 -0.66256769 0.45414773 0.68893718 Cu 41.60365422 41.12475624 36.46651109 -17.68543059 18.04520445 -14.39183709 Cu 41.79075122 42.52488602 35.10418375 -0.20116474 1.25548124 -0.70852576 Cu 43.73012471 43.44819704 36.47528543 -0.71934529 -1.06751885 0.39584472 Cu 42.58087455 40.09122498 37.35935114 -6.44710056 -31.83826370 9.79790540 Cu 43.72136125 41.12169026 38.05491549 19.74933203 18.59465617 11.67400551 Cu 39.66448343 42.68403127 37.11226018 79.10958273 -48.61739604 52.50698798 Cu 40.97555741 43.26853098 38.89352680 -18.38942250 8.29028398 -10.32704088 Cu 35.31592320 34.88324137 39.25927082 -2.60434232 -0.61605102 1.03456477 Cu 35.74041727 36.29365956 40.76984940 0.57600108 0.26693737 0.30318018 Cu 37.00297454 37.99791377 39.62151619 52.78549956 -127.05704897 72.75723052 Cu 38.96556843 38.75948867 40.94765044 -125.25810970 -312.79406210 372.45212373 Cu 37.49158966 35.40175536 42.68368650 -0.07646649 0.35923802 -0.87686177 Cu 39.41579862 35.93707120 43.80559037 -11.16173912 -12.46348668 10.89701561 Cu 35.16374498 38.06049698 42.27388437 -3.16184355 -2.56571567 -4.72260889 Cu 36.22422232 38.91950201 43.54655608 -18.60119013 -17.17699249 17.51170593 Cu 39.16526829 35.22757881 40.50692713 -0.22295570 0.25652151 1.31679718 Cu 41.48837336 36.00831489 41.43404765 -38.84637013 60.83321824 -32.14986856 Cu 42.84911873 36.81500577 40.22971067 -1.98249664 1.34100981 2.56379213 Cu 43.71562119 38.49425818 41.04890985 1.05975640 -1.23958823 -0.69345651 Cu 42.20384740 34.85081933 42.03810700 38.19888531 -60.98701841 32.67516316 Cu 43.92266376 36.21309164 43.88925171 -0.82284666 -0.12239183 -0.90122281 Cu 40.41452828 37.00336033 42.84575081 11.02314361 12.66412235 -11.17976799 Cu 40.85429854 39.16374031 43.74908259 0.29834088 0.94003799 -0.63465907 Cu 35.28526443 39.62769123 40.10727546 -12.53844425 5.34429288 11.27913650 Cu 36.29964123 41.79720326 40.73723777 -53.82276081 -21.69779171 46.44076202 Cu 37.40122931 42.21827495 39.80335328 55.02649708 16.79626056 -47.86103953 Cu 38.61671803 43.28337470 40.87827378 1.32321705 1.25693761 1.53513108 Cu 37.36102597 39.94186987 42.87644269 22.18580694 19.92568657 -14.06791900 Cu 39.15415133 41.10762709 44.06940741 0.48251307 0.03208061 -0.43220941 Cu 35.11551939 42.75138677 42.23322464 -0.33027986 0.07517870 -0.20774649 Cu 36.70708239 44.04511937 42.95555895 0.61122810 -0.20946355 -0.71445876 Cu 39.22042981 39.39391917 40.19266730 124.81840365 312.93163860 -371.78571528 Cu 40.89974943 41.22892384 41.12165250 33.96710615 -60.87376393 -69.68177058 Cu 42.34497277 42.60168189 39.71375535 18.44958863 -9.20828340 10.83620971 Cu 43.67611777 43.71118706 41.38918701 -0.64081768 -0.30550379 0.16358669 Cu 42.99424106 40.00955443 42.05340744 -1.55729144 1.62235255 0.84185159 Cu 43.45186979 40.93751722 43.97630385 -0.46330197 0.04847111 0.10282694 Cu 40.39757659 42.11536967 42.13716159 -34.19735708 59.97909026 69.18468788 Cu 40.99623589 43.72152709 43.29927288 0.25644984 -0.02413500 -0.07580495