864 Lattice="15.33688742706166 0.0 0.0 15.336887427061662 18.783774219403913 0.0 0.0 0.0 35.41902433818014" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2997.21115092017 stress="60.6382956260801 -0.004279805717018803 -0.010097585715737267 -0.004279805717018803 53.90188144445731 0.05437122104932257 -0.010097585715737267 0.05437122104932257 0.0072952685152216645" pbc="T T F" Cu 0.00130587 -0.00692157 0.11641092 -0.00000168 0.00000878 0.00000115 Cu 3.83552754 2.09753761 0.74929214 -0.00000163 0.00000874 0.00000128 Cu 2.55745377 -0.00692162 0.11641095 -0.00000166 0.00000880 0.00000110 Cu 6.39167543 2.09753774 0.74929205 -0.00000167 0.00000871 0.00000129 Cu 17.89434045 16.70864982 1.45239570 -0.00000161 0.00000850 0.00000124 Cu 6.39167431 0.01641973 2.27157341 -0.00000169 0.00000853 0.00000109 Cu 20.45048833 16.70864990 1.45239562 -0.00000160 0.00000851 0.00000127 Cu 8.94782221 0.01641983 2.27157334 -0.00000153 0.00000849 0.00000109 Cu 20.45048710 14.61638109 2.94896772 -0.00000150 0.00000903 0.00000082 Cu 24.28470807 16.69730985 3.67280989 -0.00000151 0.00000803 0.00000081 Cu 23.00663501 14.61638121 2.94896761 -0.00000163 0.00000889 0.00000088 Cu 26.84085598 16.69730984 3.67280991 -0.00000154 0.00000786 0.00000086 Cu 23.00663265 12.52263796 4.45252950 -0.00000133 0.00000778 0.00000230 Cu 26.84085333 14.61257638 5.16189784 -0.00000144 0.00000765 0.00000114 Cu 10.22589313 12.52263800 4.45252948 -0.00000158 0.00000767 0.00000222 Cu 14.06011380 14.61257627 5.16189793 -0.00000142 0.00000758 0.00000125 Cu 10.22589028 10.43525974 5.89811441 -0.00000131 0.00000806 0.00000044 Cu 14.06011020 12.52359389 6.65500723 -0.00000138 0.00000713 -0.00000019 Cu 12.78203818 10.43525966 5.89811447 -0.00000140 0.00000811 0.00000046 Cu 16.61625810 12.52359380 6.65500730 -0.00000125 0.00000716 -0.00000023 Cu 12.78203458 8.35012355 7.37878054 -0.00000126 0.00000647 0.00000181 Cu 16.61625424 10.43602968 8.11699038 -0.00000116 0.00000606 0.00000144 Cu 15.33818249 8.35012343 7.37878063 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13.28694090 -0.00000070 0.00000300 0.00000092 Cu 11.50393667 2.08840921 14.02322869 -0.00000052 0.00000228 0.00000101 Cu 10.22586577 0.00126791 13.28694088 -0.00000049 0.00000307 0.00000095 Cu 14.06008456 2.08840910 14.02322877 -0.00000044 0.00000239 0.00000087 Cu 25.56274695 16.69791934 14.76133691 -0.00000043 0.00000216 0.00000038 Cu 14.06007807 0.00134649 15.50007309 -0.00000031 0.00000147 -0.00000031 Cu 28.11889485 16.69791927 14.76133696 -0.00000032 0.00000222 0.00000031 Cu 1.27933855 0.00134642 15.50007314 -0.00000025 0.00000160 -0.00000039 Cu 12.78200087 14.61096387 16.23729276 -0.00000022 0.00000107 0.00000011 Cu 16.61621942 16.69802616 16.97504014 -0.00000002 0.00000012 0.00000008 Cu 15.33814877 14.61096378 16.23729283 -0.00000014 0.00000110 0.00000005 Cu 19.17236733 16.69802618 16.97504012 -0.00000014 0.00000028 0.00000004 Cu 15.33814203 12.52395266 17.71354578 0.00000003 -0.00000041 0.00000053 Cu 19.17236061 14.61101506 18.45129312 0.00000018 -0.00000101 -0.00000012 Cu 17.89428994 12.52395264 17.71354580 0.00000003 -0.00000032 0.00000045 Cu 21.72850852 14.61101514 18.45129306 0.00000010 -0.00000103 -0.00000017 Cu 17.89428329 10.43685813 19.18851286 0.00000029 -0.00000121 -0.00000075 Cu 21.72850189 12.52405974 19.92724886 0.00000035 -0.00000207 -0.00000076 Cu 20.45043119 10.43685819 19.18851282 0.00000030 -0.00000114 -0.00000076 Cu 24.28464979 12.52405980 19.92724882 0.00000042 -0.00000212 -0.00000073 Cu 20.45042463 8.34979561 20.66535697 0.00000065 -0.00000285 0.00000043 Cu 8.94775603 10.43693701 21.40164474 0.00000058 -0.00000325 0.00000011 Cu 7.66968513 8.34979569 20.66535692 0.00000036 -0.00000293 0.00000042 Cu 11.50390393 10.43693698 21.40164476 0.00000063 -0.00000336 0.00000009 Cu 7.66967903 6.26293901 22.14123502 0.00000074 -0.00000332 -0.00000123 Cu 11.50389785 8.34978997 22.87963407 0.00000078 -0.00000401 -0.00000146 Cu 10.22582694 6.26293901 22.14123501 0.00000063 -0.00000328 -0.00000120 Cu 14.06004576 8.34978990 22.87963412 0.00000078 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0.00000838 0.00000097 Cu 14.06011652 4.17479357 3.67280977 -0.00000159 0.00000831 0.00000080 Cu 12.78204354 2.09386507 2.94896737 -0.00000151 0.00000847 0.00000098 Cu 16.61626442 4.17479347 3.67280986 -0.00000153 0.00000856 0.00000076 Cu 12.78204117 0.00012178 4.45252940 -0.00000144 0.00000804 0.00000141 Cu 16.61626183 2.09006006 5.16189774 -0.00000144 0.00000756 0.00000137 Cu 0.00130165 0.00012166 4.45252950 -0.00000148 0.00000815 0.00000121 Cu 3.83552232 2.09006008 5.16189772 -0.00000149 0.00000763 0.00000129 Cu 15.33818616 16.69651768 5.89811446 -0.00000136 0.00000739 0.00000127 Cu 3.83551868 0.00107771 6.65500704 -0.00000131 0.00000719 0.00000085 Cu 17.89433407 16.69651764 5.89811449 -0.00000143 0.00000742 0.00000125 Cu 6.39166659 0.00107782 6.65500696 -0.00000136 0.00000710 0.00000076 Cu 17.89433039 14.61138144 7.37878081 -0.00000124 0.00000720 0.00000059 Cu 21.72855010 16.69728790 8.11699025 -0.00000128 0.00000639 0.00000050 Cu 20.45047830 14.61138151 7.37878075 -0.00000130 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