108 Lattice="10.630282900465478 0.0 0.0 0.0 10.630282900465478 0.0 0.0 0.0 10.630282900465478" Properties=species:S:1:pos:R:3:forces:R:3 energy=-315.7211893160326 stress="-0.0045657258168078875 0.00025236307675355416 0.0005058112718903515 0.00025236307675355416 -0.004077728377358821 0.0005141126129025954 0.0005058112718903515 0.0005141126129025954 -0.004130304535203791" pbc="F F F" Cu 0.00731853 0.00851263 0.00204808 0.27913932 0.29203555 0.33224549 Cu 1.72069126 1.76650772 0.01741587 0.28261055 0.06697118 -0.16531277 Cu 1.74838614 0.02006640 1.78427094 0.16831911 -0.18976816 -0.05642986 Cu 0.00544447 1.77833178 1.75626145 -0.22001144 0.02050506 0.10486821 Cu 3.53011648 0.02750223 0.02999596 -0.03285267 0.13393751 0.09900450 Cu 5.33615805 1.79600810 0.01965585 -0.00980828 -0.17961117 -0.18109322 Cu 5.31344127 0.02668048 1.79563610 0.08387214 -0.15135033 -0.14292588 Cu 3.51416440 1.77307326 1.77960492 0.02537338 -0.14585573 -0.19258474 Cu 7.12105581 0.01228257 0.02949046 -0.18956754 0.13884210 0.17610195 Cu 8.85135300 1.78860015 0.01420883 -0.12017071 0.15433417 0.09480641 Cu 8.86996807 0.03002073 1.78917869 -0.07123586 0.10294299 0.03383982 Cu 7.11708869 1.78596264 1.74666459 -0.04492248 -0.06448099 0.07549540 Cu 0.00814515 3.50444831 0.00399170 0.04091316 0.07300967 0.08224701 Cu 1.75393016 5.29890217 0.01546899 0.06612275 0.08759560 -0.26579857 Cu 1.76727774 3.55735653 1.79564784 -0.13860649 -0.22462861 -0.37995072 Cu 0.02707499 5.30567797 1.75290560 -0.30672630 0.12739339 0.11936104 Cu 3.58129327 3.54715134 0.00618436 -0.26964355 -0.12501904 -0.26235509 Cu 5.33756980 5.33073719 0.02792461 -0.10213288 0.07530522 -0.28170291 Cu 5.28577935 3.54728501 1.78658408 0.25618268 -0.12738136 -0.24709250 Cu 3.49463837 5.29756711 1.75821909 0.16145877 0.36828886 -0.19379290 Cu 7.05232217 3.55494755 0.02324304 0.07863129 -0.09234120 -0.25695458 Cu 8.82735164 5.28083473 0.00098980 -0.09976488 0.14290285 0.06741708 Cu 8.85446662 3.57181157 1.76141981 0.19985944 -0.16610365 0.13153518 Cu 7.07949407 5.32004245 1.75388362 0.17676437 0.17746227 0.01577627 Cu 0.01583397 7.08417454 0.01474135 0.15565727 -0.02458504 0.08655266 Cu 1.79301208 8.88306185 0.01545122 0.02869628 -0.24690318 0.14325658 Cu 1.72284574 7.09999294 1.79833603 0.19669655 0.08367103 -0.23422250 Cu 0.02125917 8.83729857 1.78098182 0.12512247 -0.06894138 0.12935390 Cu 3.54463668 7.08262085 0.03071329 -0.21222353 -0.04133711 -0.21916836 Cu 5.28440825 8.83108433 0.04281359 -0.02887179 0.03759209 -0.03085808 Cu 5.30826525 7.12102437 1.77084354 0.01297374 -0.08375981 -0.08413679 Cu 3.48864997 8.85033614 1.78665045 0.02487190 0.17982323 0.07517083 Cu 7.07126581 7.09567167 0.00026823 0.13953468 0.03925278 -0.12144186 Cu 8.86865409 8.89146836 0.03441234 -0.36140987 -0.35922389 0.33077498 Cu 8.86060924 7.08676980 1.75563861 0.04714924 0.10398027 -0.01393112 Cu 7.05813604 8.85804717 1.73660935 0.23028866 0.15668981 0.17051418 Cu 0.04232261 0.01204004 3.50866678 0.00018264 0.08762185 0.13837364 Cu 1.73903252 1.80269175 3.53443756 0.03239870 -0.36254077 -0.00636156 Cu 1.80384402 0.01568695 5.33768103 -0.19388148 -0.25213023 -0.13123774 Cu 0.00643199 1.78972711 5.32093417 -0.20029925 -0.11392599 -0.09384851 Cu 3.57883128 0.02397456 3.56026464 -0.26905507 -0.28534378 -0.19574883 Cu 5.33846120 1.79322363 3.55429221 0.07856193 -0.34199469 -0.12941403 Cu 5.28447275 0.00826069 5.34772837 0.29985938 -0.16646067 -0.08879840 Cu 3.50909434 1.73945894 5.29662125 0.07575670 0.15001962 0.14485095 Cu 7.10385570 0.01914512 3.50218933 -0.20862734 -0.19840300 0.15267574 Cu 8.84033288 1.75230984 3.55825697 0.20980939 0.26478407 -0.14602544 Cu 8.82370585 0.02392177 5.30258145 0.04827405 -0.00912975 0.03331382 Cu 7.11675688 1.77687064 5.33636813 -0.13693560 -0.08122586 -0.09657299 Cu 0.03379465 3.56661688 3.55077307 -0.46226098 -0.00552632 -0.03136747 Cu 1.79716207 5.33673876 3.52649141 -0.43541798 0.07653143 0.03340276 Cu 1.78643549 3.56324756 5.27998492 -0.19236377 -0.08747440 0.28097240 Cu 0.02362451 5.34957345 5.34962616 -0.27597212 -0.18975420 -0.13149521 Cu 3.55466043 3.54631748 3.51170968 -0.16921280 -0.13017409 0.15596956 Cu 5.28334911 5.34388388 3.50737901 0.30376055 -0.04334759 0.11801561 Cu 5.27976286 3.51622396 5.30202133 0.16546697 0.22382143 0.14653718 Cu 3.48598459 5.34657805 5.28117988 0.29714485 -0.21402470 0.43804486 Cu 7.06734943 3.56481670 3.52510769 0.31682217 -0.05682852 0.06242015 Cu 8.87223329 5.34828974 3.50823106 0.07132787 -0.02480711 0.17248567 Cu 8.84391402 3.54591827 5.31562724 0.26326405 0.06006248 -0.07736456 Cu 7.05773208 5.32028062 5.34718044 0.39112056 0.11122623 -0.36081442 Cu 0.03117421 7.10033414 3.59458488 -0.30074353 -0.09260912 -0.16721557 Cu 1.77159648 8.86953765 3.58760589 0.10326617 0.11727859 -0.11707984 Cu 1.76952604 7.09090190 5.37155913 0.02756766 0.30154657 -0.22455689 Cu 0.02796250 8.86940748 5.30853310 -0.01350100 -0.07970847 0.12417874 Cu 3.56311363 7.06935829 3.57511429 -0.33831794 0.49163409 -0.31916729 Cu 5.28737082 8.85174581 3.53087729 0.17395418 0.24053210 0.06074318 Cu 5.28899206 7.05574157 5.34266174 0.25914108 0.49972863 -0.13671471 Cu 3.55682325 8.88549505 5.32374085 -0.09891762 0.13529295 0.10578539 Cu 7.08880837 7.10921364 3.52651247 0.09953369 0.08459383 0.10865673 Cu 8.86885268 8.87977434 3.55888580 -0.24814422 -0.18998818 -0.16115489 Cu 8.88764041 7.12138860 5.29777481 0.00055025 -0.11639448 0.05162679 Cu 7.09669495 8.87050039 5.34697164 -0.11418714 0.09747852 -0.21960812 Cu 0.02349754 0.02200260 7.07142994 0.11157224 0.10986372 -0.07665035 Cu 1.73948028 1.80137620 7.06162907 0.15573437 -0.17440108 0.27127626 Cu 1.79101293 0.02542943 8.82684332 0.06835114 0.15974087 -0.12764245 Cu 0.00942855 1.76686353 8.83208519 0.09647480 0.07952744 -0.11656377 Cu 3.52829207 0.02369546 7.08041512 -0.00545867 -0.16273423 0.08932295 Cu 5.31907895 1.79934116 7.08423566 0.15740764 -0.27330928 0.14016882 Cu 5.30401557 0.03333580 8.84765318 0.11735129 0.06555872 -0.19651578 Cu 3.57311063 1.76929318 8.85268498 -0.26283087 0.11090220 0.15546529 Cu 7.11146614 0.00554611 7.05330001 -0.10236024 -0.10605957 0.26682096 Cu 8.84850513 1.78630069 7.07688405 0.18751105 -0.01686926 0.10286859 Cu 8.89117672 0.03089417 8.86145011 -0.33723259 0.31704491 -0.38316177 Cu 7.12108798 1.74820226 8.87137320 -0.12345404 0.13460695 -0.03681790 Cu 0.00421586 3.52006392 7.05963296 -0.18522393 0.19386824 0.08950354 Cu 1.76553535 5.34465253 7.10013089 0.08978464 -0.19353671 0.27725142 Cu 1.74146920 3.54354520 8.85701592 0.19758121 -0.02158819 0.14033619 Cu 0.02939702 5.35114992 8.83652575 -0.01232373 -0.04592043 -0.08522689 Cu 3.53022108 3.53119891 7.08969882 -0.09365886 0.14026833 0.17532559 Cu 5.31827730 5.33102789 7.08470911 -0.08503609 -0.22040293 0.19618597 Cu 5.31830690 3.55028775 8.84646345 0.12413072 -0.07744737 0.24145151 Cu 3.57595791 5.34434090 8.89354594 -0.29112140 -0.04519993 0.09330944 Cu 7.09092518 3.56428691 7.07652911 0.10501432 -0.17027170 0.24433467 Cu 8.85170871 5.35040108 7.05000955 0.17838941 0.01209291 0.13940864 Cu 8.85151094 3.56373402 8.85916038 -0.09918335 -0.07362866 -0.20401690 Cu 7.10886645 5.29829093 8.86114760 -0.07964021 0.18397630 0.07278491 Cu 0.01053349 7.05711411 7.05339486 -0.24914976 0.31302195 0.21122339 Cu 1.73945320 8.88476747 7.07163432 0.21849322 0.01229042 0.15317142 Cu 1.74022786 7.11576847 8.89288812 0.27163556 -0.01650221 -0.09705288 Cu 0.01988409 8.82940599 8.83492425 0.18179446 -0.26801690 -0.28975529 Cu 3.56757732 7.09604229 7.09430308 -0.28216544 0.24272727 0.23104373 Cu 5.34824530 8.89092579 7.07187161 -0.03592611 0.10516092 0.07632721 Cu 5.33349906 7.07279925 8.82387929 0.13198319 0.11776286 0.28192870 Cu 3.58552743 8.85580187 8.85537379 -0.12406975 -0.16600062 -0.19595812 Cu 7.06431523 7.10065597 7.06571477 0.38419731 0.15039862 0.28845107 Cu 8.85594075 8.89346902 7.05255475 -0.25842943 -0.30202546 0.09179045 Cu 8.84596140 7.09108872 8.87161746 -0.26080098 -0.02914775 -0.31362823 Cu 7.06402303 8.87230575 8.89177041 -0.02155558 -0.25735580 -0.33883612