864 Lattice="15.439330505331174 0.0 0.0 15.439330505331174 18.909240854124068 0.0 0.0 0.0 35.655606493442214" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2796.8876441619723 stress="49.684578093859216 -0.0014178476654334027 -0.00319874788805663 -0.0014178476654334027 47.01070276134698 0.0532467031954198 -0.00319874788805663 0.0532467031954198 0.007756964229010954" pbc="T T F" Cu 0.00126991 0.04309398 0.12990689 -0.00000051 0.00000849 0.00000118 Cu 3.86110243 2.11824454 0.80908099 -0.00000054 0.00000852 0.00000128 Cu 2.57449167 0.04309394 0.12990691 -0.00000055 0.00000851 0.00000117 Cu 6.43432418 2.11824459 0.80908095 -0.00000051 0.00000846 0.00000132 Cu 18.01382183 16.82579058 1.48951630 -0.00000046 0.00000835 0.00000112 Cu 6.43432389 0.00716059 2.26539431 -0.00000053 0.00000843 0.00000130 Cu 20.58704357 16.82579061 1.48951628 -0.00000054 0.00000836 0.00000113 Cu 9.00754564 0.00716065 2.26539427 -0.00000049 0.00000831 0.00000139 Cu 20.58704331 14.71335683 2.97123408 -0.00000039 0.00000807 0.00000105 Cu 24.44687567 16.80582157 3.70492279 -0.00000051 0.00000820 0.00000128 Cu 23.16026507 14.71335689 2.97123404 -0.00000059 0.00000807 0.00000105 Cu 27.02009741 16.80582158 3.70492278 -0.00000045 0.00000802 0.00000139 Cu 23.16026442 12.60382471 4.47047169 -0.00000033 0.00000765 0.00000093 Cu 27.02009669 14.70864320 5.19980749 -0.00000047 0.00000783 0.00000124 Cu 25.73348619 12.60382474 4.47047168 -0.00000061 0.00000767 0.00000092 Cu 14.15398793 14.70864317 5.19980752 -0.00000044 0.00000760 0.00000139 Cu 10.29415485 10.50500666 5.94296687 -0.00000028 0.00000709 0.00000083 Cu 14.15398696 12.60709338 6.69316326 -0.00000043 0.00000731 0.00000115 Cu 12.86737662 10.50500663 5.94296689 -0.00000059 0.00000713 0.00000081 Cu 16.72720871 12.60709336 6.69316327 -0.00000040 0.00000704 0.00000135 Cu 12.86737557 8.40572623 7.43012600 -0.00000020 0.00000641 0.00000071 Cu 16.72720761 10.50595694 8.17423682 -0.00000040 0.00000665 0.00000107 Cu 15.44059734 8.40572617 7.43012603 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0.00000010 0.00000263 0.00000007 Cu 11.58075808 2.10231467 14.11725754 -0.00000021 0.00000301 0.00000066 Cu 10.29414805 0.00128452 13.37466345 -0.00000045 0.00000273 -0.00000001 Cu 14.15397982 2.10231467 14.11725754 -0.00000007 0.00000253 0.00000099 Cu 25.73347684 16.80950222 14.86028458 0.00000018 0.00000153 -0.00000011 Cu 14.15397811 0.00134089 15.60305375 -0.00000016 0.00000197 0.00000049 Cu 28.30669863 16.80950220 14.86028459 -0.00000041 0.00000166 -0.00000020 Cu 1.28786935 0.00134091 15.60305375 -0.00000000 0.00000146 0.00000083 Cu 12.86736634 14.70853962 16.34584451 0.00000026 0.00000043 -0.00000031 Cu 16.72719811 16.80958052 17.08873632 -0.00000009 0.00000088 0.00000031 Cu 15.44058814 14.70853959 16.34584453 -0.00000036 0.00000055 -0.00000039 Cu 19.30041985 16.80958057 17.08873630 0.00000005 0.00000035 0.00000067 Cu 15.44058633 12.60756869 17.83150291 0.00000033 -0.00000065 -0.00000048 Cu 19.30041810 14.70860964 18.57439471 -0.00000003 -0.00000025 0.00000016 Cu 18.01380812 12.60756868 17.83150292 -0.00000030 -0.00000054 -0.00000054 Cu 21.87363985 14.70860969 18.57439467 0.00000012 -0.00000077 0.00000052 Cu 18.01380632 10.50656749 19.31718546 0.00000040 -0.00000176 -0.00000063 Cu 21.87363811 12.60764707 20.05995460 0.00000006 -0.00000135 -0.00000001 Cu 20.58702811 10.50656750 19.31718545 -0.00000023 -0.00000167 -0.00000070 Cu 24.44685985 12.60764711 20.05995457 0.00000017 -0.00000185 0.00000034 Cu 20.58702635 8.40559376 20.80298163 0.00000047 -0.00000282 -0.00000079 Cu 9.00752766 10.50662392 21.54557571 0.00000011 -0.00000245 -0.00000017 Cu 7.72091763 8.40559377 20.80298162 -0.00000017 -0.00000273 -0.00000084 Cu 11.58074940 10.50662394 21.54557570 0.00000025 -0.00000293 0.00000015 Cu 7.72091593 6.30466608 22.28840655 0.00000049 -0.00000387 -0.00000089 Cu 11.58074779 8.40563246 23.03169995 0.00000019 -0.00000350 -0.00000034 Cu 10.29413772 6.30466607 22.28840656 -0.00000007 -0.00000378 -0.00000096 Cu 14.15396953 8.40563247 23.03169993 0.00000029 -0.00000394 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0.00000041 -0.00000700 -0.00000092 Cu 20.58701927 16.81005589 28.22707597 0.00000022 -0.00000714 -0.00000128 Cu 9.00752085 0.00290182 28.97727230 0.00000047 -0.00000726 -0.00000074 Cu 20.58701829 14.70850613 29.72043170 0.00000059 -0.00000775 -0.00000130 Cu 24.44685055 16.81332458 30.44976752 0.00000044 -0.00000757 -0.00000101 Cu 23.16024006 14.70850612 29.72043170 0.00000031 -0.00000771 -0.00000135 Cu 27.02007230 16.81332457 30.44976751 0.00000048 -0.00000776 -0.00000085 Cu 23.16023932 12.61132776 31.21531638 0.00000057 -0.00000816 -0.00000131 Cu 27.02007168 14.70379238 31.94900517 0.00000045 -0.00000799 -0.00000111 Cu 25.73346108 12.61132773 31.21531639 0.00000038 -0.00000810 -0.00000134 Cu 14.15396292 14.70379239 31.94900517 0.00000051 -0.00000814 -0.00000101 Cu 10.29413009 10.50074780 32.65484487 0.00000056 -0.00000838 -0.00000133 Cu 14.15396266 12.59135859 33.43072296 0.00000049 -0.00000829 -0.00000116 Cu 12.86735185 10.50074779 32.65484488 0.00000045 -0.00000835 -0.00000135 Cu 16.72718441 12.59135862 33.43072295 0.00000051 -0.00000838 -0.00000111 Cu 12.86735154 8.38966379 34.11115820 0.00000055 -0.00000848 -0.00000128 Cu 16.72718406 10.46481438 34.79033231 0.00000052 -0.00000847 -0.00000119 Cu 15.44057329 8.38966380 34.11115820 0.00000050 -0.00000847 -0.00000129 Cu 19.30040581 10.46481440 34.79033230 0.00000053 -0.00000850 -0.00000116 Cu 5.14771336 6.34617433 0.12990686 -0.00000049 0.00000847 0.00000119 Cu 9.00754587 8.42132497 0.80908098 -0.00000051 0.00000848 0.00000128 Cu 7.72093511 6.34617440 0.12990682 -0.00000053 0.00000846 0.00000119 Cu 11.58076763 8.42132498 0.80908099 -0.00000050 0.00000843 0.00000131 Cu 7.72093486 4.21963012 1.48951612 -0.00000048 0.00000831 0.00000118 Cu 11.58076737 6.31024094 2.26539426 -0.00000053 0.00000841 0.00000132 Cu 10.29415663 4.21963016 1.48951610 -0.00000055 0.00000833 0.00000117 Cu 14.15398912 6.31024090 2.26539428 -0.00000047 0.00000831 0.00000138 Cu 10.29415636 2.10719636 2.97123389 -0.00000042 0.00000803 0.00000111 Cu 14.15398870 4.19966096 3.70492273 -0.00000053 0.00000821 0.00000129 Cu 12.86737812 2.10719633 2.97123392 -0.00000059 0.00000808 0.00000107 Cu 16.72721045 4.19966092 3.70492276 -0.00000046 0.00000806 0.00000140 Cu 12.86737745 -0.00233585 4.47047160 -0.00000034 0.00000763 0.00000097 Cu 16.72720973 2.10248255 5.19980743 -0.00000051 0.00000785 0.00000126 Cu 0.00126871 -0.00233591 4.47047164 -0.00000060 0.00000770 0.00000092 Cu 3.86110097 2.10248256 5.19980742 -0.00000041 0.00000763 0.00000141 Cu 15.44059835 16.80808688 5.94296689 -0.00000027 0.00000711 0.00000084 Cu 3.86109997 0.00093278 6.69316318 -0.00000046 0.00000731 0.00000118 Cu 18.01382012 16.80808684 5.94296691 -0.00000059 0.00000717 0.00000080 Cu 6.43432172 0.00093284 6.69316314 -0.00000037 0.00000704 0.00000138 Cu 18.01381905 14.70880644 7.43012607 -0.00000022 0.00000643 0.00000070 Cu 21.87365110 16.80903728 8.17423674 -0.00000043 0.00000663 0.00000111 Cu 20.58704083 14.70880646 7.43012606 -0.00000057 0.00000648 0.00000067 Cu 24.44687284 16.80903734 8.17423670 -0.00000031 0.00000632 0.00000134 Cu 20.58703954 12.60736668 8.91898342 -0.00000013 0.00000562 0.00000054 Cu 24.44687152 14.70849206 9.65954377 -0.00000037 0.00000585 0.00000102 Cu 23.16026132 12.60736672 8.91898339 -0.00000056 0.00000566 0.00000050 Cu 27.02009326 14.70849209 9.65954376 -0.00000028 0.00000549 0.00000125 Cu 23.16025993 10.50617996 10.40328654 -0.00000007 0.00000468 0.00000038 Cu 11.58076131 12.60739829 11.14649282 -0.00000030 0.00000498 0.00000089 Cu 10.29415120 10.50617999 10.40328653 -0.00000053 0.00000472 0.00000034 Cu 14.15398306 12.60739828 11.14649283 -0.00000023 0.00000458 0.00000117 Cu 10.29414965 8.40535625 11.88853929 0.00000004 0.00000370 0.00000019 Cu 14.15398150 10.50632261 12.63183271 -0.00000025 0.00000403 0.00000074 Cu 12.86737144 8.40535623 11.88853930 -0.00000051 0.00000376 0.00000015 Cu 16.72720325 10.50632261 12.63183271 -0.00000017 0.00000359 0.00000104 Cu 12.86736978 6.30436479 13.37466350 0.00000011 0.00000263 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10.50274118 3.70492289 -0.00000049 0.00000824 0.00000124 Cu 18.01382158 8.41027652 2.97123404 -0.00000060 0.00000811 0.00000105 Cu 21.87365390 10.50274124 3.70492284 -0.00000046 0.00000803 0.00000137 Cu 18.01382096 6.30074435 4.47047164 -0.00000035 0.00000766 0.00000097 Cu 21.87365321 8.40556287 5.19980747 -0.00000048 0.00000785 0.00000125 Cu 5.14771222 6.30074437 4.47047162 -0.00000059 0.00000771 0.00000093 Cu 9.00754445 8.40556293 5.19980743 -0.00000043 0.00000761 0.00000143 Cu 5.14771138 4.20192631 5.94296680 -0.00000029 0.00000710 0.00000088 Cu 9.00754350 6.30401315 6.69316313 -0.00000046 0.00000729 0.00000121 Cu 7.72093315 4.20192636 5.94296677 -0.00000059 0.00000716 0.00000083 Cu 11.58076524 6.30401317 6.69316312 -0.00000038 0.00000701 0.00000139 Cu 7.72093207 2.10264595 7.43012591 -0.00000023 0.00000638 0.00000076 Cu 11.58076412 4.20287676 8.17423666 -0.00000043 0.00000662 0.00000114 Cu 10.29415384 2.10264598 7.43012590 -0.00000056 0.00000646 0.00000069 Cu 14.15398586 4.20287673 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