32 Lattice="6.962936873233494 0.0 0.0 0.0 6.962936873233494 0.0 0.0 0.0 6.962936873233494" Properties=species:S:1:pos:R:3:forces:R:3 energy=-89.25491637477877 stress="-0.015265988722161158 0.002240284372856838 0.002275450760555777 0.002240284372856838 -0.015415310459337452 -0.0012429106986526382 0.002275450760555777 -0.0012429106986526382 -0.015153238052224304" free_energy=-89.25491637477877 pbc="F F F" Cu 0.00876302 0.02847373 0.02342153 0.27316812 0.24049910 0.16399014 Cu 1.74914209 1.76852381 0.02036091 0.05002022 -0.32300751 -0.93276167 Cu 1.73319930 0.00308199 1.71679254 -0.01620628 -0.79653365 0.15557165 Cu 0.02646956 1.74373022 1.70686948 -0.84445394 -0.11697898 0.32691410 Cu 3.46077173 0.00953975 0.02752357 0.09173910 0.03061143 -0.10427815 Cu 5.21571910 1.75222983 0.02729604 -0.18739541 0.05405932 0.01445633 Cu 5.20365901 0.03633825 1.74543650 -0.01825287 -0.11191330 0.07260748 Cu 3.45336108 1.71406433 1.76777320 0.29543904 0.16561158 -0.37354600 Cu 0.01303995 3.46279091 0.02271001 -0.28414110 0.07478241 -0.29794156 Cu 1.71928736 5.20649726 0.02394191 0.17152396 0.22423288 -0.27082463 Cu 1.72297790 3.47297037 1.70880389 0.32708088 0.18989748 0.57432983 Cu 0.05685255 5.21292792 1.73614086 -0.29870081 0.24504425 0.12543428 Cu 3.45691801 3.51089538 0.02998308 0.38577539 -0.20055645 -0.79304465 Cu 5.23087263 5.21808414 0.00982897 -0.33412366 -0.41854350 0.36789814 Cu 5.19648671 3.46116697 1.75723558 0.71300502 0.28488258 -0.18189061 Cu 3.50281233 5.19847498 1.72410265 -0.06799328 0.72757124 0.25443269 Cu 0.01570815 0.03020344 3.47541718 0.00456216 -0.02695187 -0.04539479 Cu 1.75819924 1.72063319 3.45430159 -0.51990807 0.23590485 0.40100310 Cu 1.71044787 0.00954292 5.25330639 0.09160270 0.02988503 -0.09318523 Cu 0.02373781 1.72379812 5.22375158 0.10153987 0.29801082 -0.16330947 Cu 3.47802364 0.03388687 3.54768451 0.17363153 -0.95319302 -0.16571854 Cu 5.20992318 1.76099247 3.45622283 0.77067573 -0.24983642 0.52482391 Cu 5.25348438 0.00217767 5.25641363 -0.49002045 0.56360957 -0.50866820 Cu 3.45853965 1.74814969 5.19361653 0.31712958 -0.07452587 0.94639945 Cu 0.01971973 3.51221493 3.46011829 -0.54897520 -0.25966902 0.33144183 Cu 1.74967766 5.21697077 3.50718489 0.06285425 0.59162289 -0.13199092 Cu 1.76220545 3.50646445 5.22382081 -0.33202842 -0.21332685 0.55191642 Cu 0.01487230 5.21093249 5.25022134 0.34788009 -0.36366119 -0.38366775 Cu 3.49601105 3.46018184 3.49671600 -0.09893118 0.39968865 -0.15040291 Cu 5.21142679 5.24956615 3.50563652 -0.05074572 -0.21691414 -0.17872723 Cu 5.21780963 3.51245014 5.25505875 -0.02168418 -0.24998419 -0.19466372 Cu 3.49982696 5.19387420 5.20962205 -0.06406707 0.21968190 0.15879667