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=83.4682348146035 stress="-0.0011955386799874454 0.00033413704266479106 -0.00029454378072924463 0.00033413704266479106 -0.0013412021620588055 -0.00026839592842471644 -0.00029454378072924463 -0.00026839592842471644 -0.0014549595155041288" pbc="F F F" Cu 35.59659101 34.94648683 35.10954138 0.90111511 0.28947277 0.55139209 Cu 36.44459535 36.78324421 36.32998701 -3.19989244 -1.32925032 3.07487534 Cu 37.92701379 37.54820353 35.20099123 0.30895172 -3.56120231 -9.61668344 Cu 38.55589524 38.53874993 36.66265278 -60.55250313 55.62423115 -26.12152975 Cu 37.90424529 34.90229052 36.75725883 -0.03001148 0.66652270 -0.00432270 Cu 38.79155283 35.72088216 39.06405160 -147.20280209 80.87293219 -171.68813514 Cu 34.81180744 38.11105005 37.66720080 0.93394279 0.11772082 0.26285981 Cu 36.54877477 38.99146864 39.49538486 21.83169690 -5.08625811 -5.62382308 Cu 39.22262088 34.84433686 34.78209625 -0.18015882 0.80431401 0.53569020 Cu 40.74997922 36.04989673 36.35812427 0.14903851 -0.73731857 -0.83614670 Cu 41.94818812 37.95681790 35.08177758 -1.53357020 -0.50708460 0.63097755 Cu 43.66483256 39.29620592 35.41661606 0.23825324 1.24293641 0.56020519 Cu 42.33472841 34.62859478 37.07931378 -1.04362795 -2.51367656 -1.29432354 Cu 43.30623241 36.08063137 38.15475058 0.68042217 2.69611613 1.64190611 Cu 39.51567701 37.69823237 37.04928231 68.70103949 -59.43437689 29.28577053 Cu 40.79024621 38.76672657 39.38476432 -18.08085517 8.12581540 -11.43054713 Cu 34.76628147 40.15124589 34.93567952 0.89450719 0.29236968 0.80873778 Cu 36.54714913 41.60304818 35.90503041 -20.67385546 -41.13946134 36.21991414 Cu 37.05403308 42.62092295 35.01882052 20.47804456 40.77922805 -35.28404019 Cu 38.94198206 43.79598148 36.14399169 0.01030802 -0.84516001 0.15467088 Cu 37.70609579 39.92647898 37.42162521 -11.51646967 4.03664338 -4.80298071 Cu 38.45868869 40.74920932 38.82895218 2.89441407 6.03966883 5.49005992 Cu 34.82960153 42.94471660 37.58696455 0.73530976 -0.62804836 -0.49325967 Cu 36.56744857 42.84750151 39.18343987 -3.25193538 1.24543205 -4.90228510 Cu 39.74085497 40.28015531 35.20633789 -4.03169918 -4.23816538 -1.81281483 Cu 41.00439459 41.55820902 35.96963622 21.24511055 -26.75545404 -48.22205567 Cu 42.30539633 42.04401900 34.94151616 12.72782840 4.22210334 -9.76469380 Cu 43.54641741 43.72550231 35.96390429 -0.60136201 -0.57651536 0.44156009 Cu 42.42010011 40.58863840 37.17543462 -3.32971998 -2.10935031 -5.08467516 Cu 43.58168652 40.68415406 38.64280578 4.72025360 0.36949661 7.06334588 Cu 40.38688112 42.08824509 37.10112862 -32.36870805 27.62538235 59.53539885 Cu 41.15730085 43.93326682 38.81662040 0.18806705 -1.00149171 0.08123378 Cu 35.08567209 35.03820323 39.17717646 0.93416735 1.00880552 -0.09662261 Cu 36.33992262 36.37318125 40.86848830 -4.57434555 -1.71494432 2.20137250 Cu 37.90565462 37.01927222 39.86230136 -3.17896272 13.30881037 3.94075762 Cu 39.21617175 38.99673192 40.82350186 -10.62054909 -33.63264196 9.38477505 Cu 37.95855498 35.52142175 42.46977975 -0.25472303 0.07921204 -0.73446271 Cu 39.43038665 36.39350781 44.11329491 -0.33793502 -2.31189281 5.65987249 Cu 35.62768299 37.86563512 42.64698445 -6.10184226 -2.85643315 -5.45542046 Cu 37.01789044 38.52491200 43.70032918 6.92225382 2.35069683 4.77070662 Cu 39.52038785 35.28966064 39.84018430 154.22805319 -92.30256867 163.64694728 Cu 40.75335140 36.12071181 41.49242487 9.52967116 -7.12451459 -5.52253686 Cu 42.18614931 38.14606731 40.01148884 14.96763607 -11.33923415 4.36329572 Cu 43.50579728 38.72637582 41.26853654 4.29066342 2.33421518 5.17995899 Cu 42.42062669 34.79715033 42.52831300 0.16084265 1.16980082 0.36721480 Cu 43.96600606 36.82405335 43.73446151 -1.21465858 -0.11457830 -1.04193996 Cu 39.62629762 37.18842517 42.35335424 -9.17189870 10.19156887 -0.48584526 Cu 40.89462432 38.37094800 43.65996605 1.44252593 1.03384096 0.36088979 Cu 34.98875018 39.37036028 39.90615021 -21.17973141 5.19583152 5.79256542 Cu 36.03768472 41.89575541 41.15239181 -1.57002897 -2.74909574 -0.45333161 Cu 38.01433649 42.36100117 40.47950944 24.32100765 -219.82929991 -187.27584144 Cu 37.94051219 43.20305675 41.20640506 -33.55729285 222.24024944 177.88681311 Cu 37.98608835 40.33376325 42.59602716 -0.19932045 -6.76075730 -6.66782834 Cu 38.03755167 41.81597066 43.71144420 -0.05677203 6.48994249 5.96463795 Cu 34.93034799 42.20842410 42.89106271 -5.12264513 -2.61312180 -1.33309433 Cu 36.18039797 43.10187130 44.06540324 3.72015354 3.10824028 3.33053096 Cu 39.58604388 40.46914856 40.48013584 10.69250225 33.47492330 -3.71145445 Cu 41.19774168 42.01651381 41.26227964 -16.72221401 -4.24371589 12.02294876 Cu 42.50842636 42.40158933 40.29763519 1.99860349 -17.63103228 -17.04286632 Cu 43.40076708 43.72765556 40.55415023 14.26149958 21.85846788 4.17048971 Cu 42.42006226 40.88249314 42.87054360 -7.84246921 -2.78955352 -7.29930702 Cu 43.71545013 41.25609204 44.07894161 7.50118164 2.38321829 7.05766891 Cu 39.26809139 42.96218452 42.24109921 16.90453159 -1.63731263 12.79004402 Cu 41.31811355 43.77250168 43.98612036 -0.21103643 -1.16469876 -1.12721981