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=-65.86751796177609 stress="-0.00031330912823291014 -3.7009595761281885e-05 -0.0002014901945208827 -3.7009595761281885e-05 -0.0003648699582401303 2.7754623917197646e-05 -0.0002014901945208827 2.7754623917197646e-05 -0.00029973172157611496" pbc="F F F" Cu 35.22086729 34.98310996 34.77096654 -0.63718323 -0.17852503 -0.48338100 Cu 36.59933616 35.93572417 35.98055861 -3.72171617 -10.36408161 7.79158258 Cu 37.14715992 37.22516294 35.23402360 -0.76040631 3.72881268 -12.83815360 Cu 37.93229823 38.31172061 36.19084223 4.63575570 7.11233137 5.43684899 Cu 37.29465675 35.14771729 38.20399864 -0.68960951 0.49397434 0.25706334 Cu 39.35802973 36.07349581 38.45018589 -0.65085647 -5.65735050 4.79624644 Cu 34.76884260 38.20444678 38.02575960 0.08415064 -0.36904421 -0.44770487 Cu 36.55604684 39.07636534 38.99475015 -11.05729145 26.68788380 -14.92349762 Cu 40.23975440 35.55577733 35.25284888 -0.95175574 0.46015315 -0.57119090 Cu 41.57116719 36.00454661 36.78983070 -2.69630731 2.92615873 -2.11764444 Cu 42.51432400 36.93324962 34.69615509 -0.55350644 0.18869982 1.06883336 Cu 43.42712388 38.91385061 36.22088890 1.56324198 -3.68117687 -2.91071051 Cu 42.81964364 35.29825864 37.90182602 3.20899033 -1.86424556 3.34667618 Cu 43.94092265 36.79747090 39.26025248 6.04722257 -4.35048643 -5.91518324 Cu 39.61890133 37.43827487 37.40447350 1.10366880 5.84678886 -4.78301443 Cu 41.32868209 38.48931485 38.46659910 0.38600639 -0.16451276 0.36224404 Cu 34.72941635 39.65017747 35.17843495 -0.62573747 -2.28882673 -0.38411405 Cu 35.67994952 41.20201413 35.91957267 -1.69676201 -1.63153973 3.87980846 Cu 36.83832478 42.32454839 35.07964709 3.38038891 2.92174528 -1.91901533 Cu 38.61643991 43.32327578 36.40123177 -18.06911184 10.64800029 -11.90972167 Cu 37.95366604 39.88968876 37.71888199 -6.23093405 -3.57980448 -5.06824122 Cu 39.18297782 40.79320854 38.39174556 7.49425527 6.80260611 2.09846310 Cu 35.30302897 42.83814538 37.63905551 0.05356685 -1.69505013 -1.48929621 Cu 35.93114464 43.99801325 39.11824152 1.26791172 0.41044731 1.87631432 Cu 40.10049303 40.54851891 34.85209736 -0.48345907 0.03978099 0.80191438 Cu 41.60365422 41.12475624 36.46651109 -5.62022474 6.26201924 -4.67711737 Cu 42.06544791 43.43063630 35.46577408 -7.91208720 -2.26681135 -2.21347064 Cu 43.61612729 43.80145122 36.02098422 7.11042904 1.33105147 3.01893845 Cu 42.58087455 40.09122498 37.35935114 2.86110473 -3.22447133 7.22060396 Cu 43.53127631 41.09201764 38.97117919 0.46912774 -0.20744340 1.03708473 Cu 39.66448343 42.68403127 37.11226018 17.65790874 -11.01850786 11.06440798 Cu 40.97555741 43.07655432 38.89352680 -9.93131377 1.61844081 -5.36315727 Cu 35.04263434 35.15136053 39.28249517 -1.11737531 0.02285450 -2.34586691 Cu 36.21994698 35.60264947 40.79204899 -1.38973908 3.34648606 -5.32054051 Cu 37.00297454 37.99791377 39.62151619 11.45259295 -28.07161409 16.03051836 Cu 38.81127333 38.51894432 41.34725891 -1.38808724 -1.58871439 2.04588750 Cu 36.91735306 35.17049102 42.29388522 3.80189720 -1.30634116 7.13433896 Cu 39.08450338 35.75571598 43.99881808 -2.91734066 -5.34108243 3.80331274 Cu 35.23710347 37.57017884 42.51668654 -0.60386928 -1.99740704 -2.30612168 Cu 36.22422232 38.91950201 43.54655608 -5.15049701 -4.23458151 5.03757094 Cu 39.94590214 35.43324153 40.72739038 -5.88937036 -1.64695510 -2.27906968 Cu 41.48837336 36.00831489 41.43404765 -3.65076874 17.14887406 -5.01451745 Cu 42.84911873 37.58984275 40.26936712 -20.23147719 -11.62650203 -8.32896865 Cu 43.60556472 38.49425818 41.03735392 13.24573019 16.86121295 14.29137754 Cu 42.20384740 34.85081933 42.03810700 9.36589725 -14.31318704 7.98791891 Cu 43.86847215 36.00394286 43.76534421 -0.94732618 0.15353850 -0.90318398 Cu 39.73333753 37.00409575 43.00005349 1.70659929 4.48649018 -5.48573020 Cu 41.03695434 38.28719268 43.94632733 0.99696237 1.18326151 -0.02546918 Cu 34.94292271 39.80099153 40.20999044 -0.61220785 -0.01243400 0.68855544 Cu 36.26332309 41.49467021 41.17665376 -0.17116562 -0.25203871 0.57251493 Cu 37.82350393 42.21827495 39.80335328 -3.51574950 -4.95573516 -6.09593425 Cu 38.63834321 43.28337470 40.87827378 3.81014227 4.86363575 5.17184757 Cu 37.36102597 39.94186987 42.87644269 6.31572775 5.92677287 -4.74861237 Cu 39.23911782 40.86547492 43.69892213 0.60005764 -0.09938487 -0.14386336 Cu 35.06236183 42.74812411 42.77511221 0.16727879 -0.48389721 -0.43779839 Cu 36.48115325 43.96771709 43.78828861 0.59567005 -0.25882913 -0.37027092 Cu 39.68857725 39.62342496 39.94578024 1.52614882 -0.35587902 -0.06327824 Cu 40.89974943 41.22892384 41.12165250 7.67525581 -13.94050569 -16.57520034 Cu 42.34497277 42.80178516 39.71375535 9.89104314 -1.50541170 6.85957122 Cu 43.94674946 43.83088558 41.99939752 -1.02219353 -1.18168875 0.04235713 Cu 42.80425086 40.90660926 42.38824999 -4.93808241 -2.88845305 -7.23908633 Cu 43.73378564 41.43478714 43.66957874 4.75632771 3.45644128 6.63154394 Cu 40.39757659 42.11536967 42.13716159 -7.77071501 14.08860959 15.70788601 Cu 40.99934153 43.70821989 43.60820831 0.37316710 -0.41455146 -0.36410472