864 Lattice="15.337146756599918 0.0 0.0 15.337146756599918 18.784091831925895 0.0 0.0 0.0 70.83924646819005" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3009.35243910528 stress="0.0018837143460109038 -3.2070004922518225e-07 -7.159325822949782e-07 -3.2070004922518225e-07 0.0013410276312904668 2.8269202066242347e-06 -7.159325822949782e-07 2.8269202066242347e-06 3.9582100424932764e-07" pbc="T T F" Cu 0.00132674 0.00201421 17.81192502 -0.00000238 0.00000937 0.00000124 Cu 3.83561278 2.08035136 18.47391565 -0.00000239 0.00000938 0.00000134 Cu 2.55751788 0.00201411 17.81192507 -0.00000242 0.00000941 0.00000120 Cu 6.39180390 2.08035157 18.47391552 -0.00000235 0.00000931 0.00000145 Cu 17.89466294 16.70293644 19.17191104 -0.00000232 0.00000918 0.00000113 Cu 21.72894926 18.79090510 19.96343000 -0.00000244 0.00000916 0.00000143 Cu 20.45085402 16.70293656 19.17191093 -0.00000233 0.00000925 0.00000114 Cu 24.28514037 18.79090527 19.96342988 -0.00000220 0.00000898 0.00000163 Cu 20.45085243 14.61624168 20.65964396 -0.00000210 0.00000872 0.00000111 Cu 24.28513757 16.69746039 21.38853535 -0.00000224 0.00000897 0.00000127 Cu 23.00704358 14.61624186 20.65964382 -0.00000242 0.00000875 0.00000107 Cu 26.84132870 16.69746039 21.38853537 -0.00000217 0.00000866 0.00000137 Cu 23.00704030 12.52343581 22.15593710 -0.00000195 0.00000834 0.00000094 Cu 26.84132497 14.61230414 22.87461191 -0.00000215 0.00000846 0.00000120 Cu 10.22608469 12.52343588 22.15593706 -0.00000234 0.00000836 0.00000092 Cu 14.06036933 14.61230398 22.87461203 -0.00000197 0.00000837 0.00000137 Cu 10.22608027 10.43587405 23.61121935 -0.00000191 0.00000764 0.00000099 Cu 14.06036449 12.52372869 24.36153495 -0.00000201 0.00000776 0.00000126 Cu 12.78227140 10.43587393 23.61121945 -0.00000208 0.00000786 0.00000083 Cu 16.61655561 12.52372856 24.36153504 -0.00000186 0.00000763 0.00000136 Cu 12.78226610 8.35008977 25.09018251 -0.00000159 0.00000684 0.00000078 Cu 16.61654975 10.43631292 25.82842785 -0.00000183 0.00000721 0.00000103 Cu 15.33845726 8.35008958 25.09018264 -0.00000199 0.00000713 0.00000065 Cu 19.17274087 10.43631296 25.82842782 -0.00000163 0.00000692 0.00000116 Cu 15.33845098 6.26246050 26.57147091 -0.00000148 0.00000612 0.00000074 Cu 19.17273420 8.34981749 27.30502454 -0.00000152 0.00000630 0.00000098 Cu 17.89464213 6.26246043 26.57147096 -0.00000174 0.00000625 0.00000056 Cu 21.72892533 8.34981766 27.30502441 -0.00000143 0.00000599 0.00000128 Cu 17.89463494 4.17519661 28.04348701 -0.00000117 0.00000520 0.00000051 Cu 6.39177111 6.26253814 28.78348707 -0.00000134 0.00000530 0.00000094 Cu 5.11367935 4.17519670 28.04348694 -0.00000158 0.00000531 0.00000047 Cu 8.94796222 6.26253829 28.78348699 -0.00000111 0.00000492 0.00000104 Cu 5.11367155 2.08838969 29.51939785 -0.00000099 0.00000409 0.00000036 Cu 8.94795410 4.17536353 30.25770554 -0.00000110 0.00000413 0.00000079 Cu 7.66986268 2.08838983 29.51939775 -0.00000118 0.00000423 0.00000034 Cu 11.50414520 4.17536352 30.25770554 -0.00000079 0.00000398 0.00000107 Cu 23.00700111 18.78534203 30.99645899 -0.00000063 0.00000301 0.00000024 Cu 11.50413668 2.08841409 31.73349061 -0.00000076 0.00000307 0.00000076 Cu 25.56319226 18.78534207 30.99645897 -0.00000102 0.00000307 0.00000004 Cu 14.06032779 2.08841398 31.73349070 -0.00000056 0.00000283 0.00000077 Cu 25.56318349 16.69821643 32.47159059 -0.00000039 0.00000171 0.00000003 Cu 29.39746570 18.78542455 33.20986410 -0.00000056 0.00000180 0.00000051 Cu 28.11937463 16.69821632 32.47159066 -0.00000070 0.00000204 -0.00000005 Cu 16.61651005 18.78542447 33.20986416 -0.00000026 0.00000167 0.00000063 Cu 12.78221882 14.61120182 33.94744285 -0.00000018 0.00000052 -0.00000014 Cu 16.61650096 16.69832029 34.68532290 -0.00000016 0.00000069 0.00000027 Cu 15.33840995 14.61120169 33.94744295 -0.00000030 0.00000075 -0.00000036 Cu 19.17269208 16.69832034 34.68532286 -0.00000006 0.00000048 0.00000052 Cu 15.33840074 12.52415253 35.42347276 0.00000019 -0.00000059 -0.00000035 Cu 19.17268291 14.61127117 36.16135270 0.00000011 -0.00000048 0.00000026 Cu 17.89459188 12.52415250 35.42347279 -0.00000008 -0.00000049 -0.00000050 Cu 21.72887402 14.61127129 36.16135261 0.00000036 -0.00000071 0.00000036 Cu 17.89458267 10.43704835 36.89893147 0.00000050 -0.00000186 -0.00000064 Cu 21.72886493 12.52425677 37.63720479 0.00000046 -0.00000183 -0.00000001 Cu 20.45077382 10.43704842 36.89893142 0.00000029 -0.00000168 -0.00000068 Cu 24.28505605 12.52425684 37.63720474 0.00000062 -0.00000197 0.00000011 Cu 20.45076487 8.34996718 38.37530476 0.00000084 -0.00000307 -0.00000080 Cu 8.94790047 10.43713117 39.11233632 0.00000075 -0.00000290 -0.00000006 Cu 7.66980925 8.34996726 38.37530470 0.00000059 -0.00000297 -0.00000089 Cu 11.50409158 10.43713113 39.11233635 0.00000091 -0.00000297 -0.00000008 Cu 7.66980073 6.26301785 39.85108972 0.00000086 -0.00000421 -0.00000080 Cu 11.50408326 8.34999149 40.58939754 0.00000109 -0.00000419 -0.00000017 Cu 10.22599183 6.26301785 39.85108973 0.00000111 -0.00000412 -0.00000092 Cu 14.06027437 8.34999138 40.58939761 0.00000119 -0.00000403 -0.00000011 Cu 10.22598379 4.17584312 41.32530830 0.00000133 -0.00000531 -0.00000118 Cu 14.06026666 6.26318435 42.06530852 0.00000133 -0.00000511 -0.00000042 Cu 12.78217492 4.17584303 41.32530836 0.00000114 -0.00000515 -0.00000121 Cu 16.61645778 6.26318431 42.06530856 0.00000139 -0.00000515 -0.00000055 Cu 12.78216751 2.08856353 42.80377106 0.00000147 -0.00000626 -0.00000122 Cu 16.61645070 4.17592047 43.53732463 0.00000153 -0.00000607 -0.00000039 Cu 15.33835863 2.08856345 42.80377112 0.00000148 -0.00000617 -0.00000121 Cu 3.83549507 4.17592051 43.53732459 0.00000162 -0.00000601 -0.00000038 Cu 15.33835195 18.78615983 44.28036791 0.00000161 -0.00000707 -0.00000120 Cu 3.83548882 2.08829143 45.01861298 0.00000183 -0.00000692 -0.00000063 Cu 17.89454306 18.78615984 44.28036792 0.00000182 -0.00000711 -0.00000136 Cu 6.39167995 2.08829150 45.01861291 0.00000181 -0.00000681 -0.00000062 Cu 17.89453715 16.69874423 45.74726075 0.00000189 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10.43156790 50.14536545 0.00000241 -0.00000913 -0.00000180 Cu 16.61642987 12.51953625 50.93688474 0.00000232 -0.00000898 -0.00000120 Cu 12.78214220 8.35802958 51.63487981 0.00000235 -0.00000940 -0.00000139 Cu 16.61642828 10.43636665 52.29687055 0.00000238 -0.00000929 -0.00000108 Cu 15.33833333 8.35802952 51.63487986 0.00000237 -0.00000937 -0.00000141 Cu 19.17261940 10.43636671 52.29687052 0.00000239 -0.00000928 -0.00000115 Cu 5.11370880 6.26337843 17.81192486 -0.00000235 0.00000929 0.00000131 Cu 8.94799484 8.34171583 18.47391556 -0.00000234 0.00000929 0.00000135 Cu 7.66989993 6.26337867 17.81192473 -0.00000240 0.00000924 0.00000124 Cu 11.50418600 8.34171581 18.47391558 -0.00000234 0.00000920 0.00000143 Cu 7.66989847 4.18020894 19.17191041 -0.00000229 0.00000901 0.00000134 Cu 11.50418465 6.26817737 19.96342980 -0.00000246 0.00000919 0.00000152 Cu 10.22608965 4.18020902 19.17191036 -0.00000240 0.00000912 0.00000130 Cu 14.06037575 6.26817721 19.96342993 -0.00000217 0.00000905 0.00000154 Cu 10.22608806 2.09351408 20.65964340 -0.00000211 0.00000865 0.00000123 Cu 14.06037315 4.17473233 21.38853523 -0.00000228 0.00000896 0.00000134 Cu 12.78227921 2.09351396 20.65964350 -0.00000243 0.00000879 0.00000113 Cu 16.61656427 4.17473219 21.38853535 -0.00000217 0.00000884 0.00000140 Cu 28.11942263 18.78479975 22.15593688 -0.00000200 0.00000828 0.00000102 Cu 16.61656055 2.08957597 22.87461181 -0.00000215 0.00000846 0.00000129 Cu 15.33846702 18.78479956 22.15593703 -0.00000231 0.00000847 0.00000088 Cu 3.83560492 2.08957600 22.87461178 -0.00000209 0.00000830 0.00000136 Cu 15.33846254 16.69723774 23.61121949 -0.00000197 0.00000762 0.00000091 Cu 19.17274679 18.78509255 24.36153477 -0.00000205 0.00000779 0.00000123 Cu 17.89465368 16.69723766 23.61121954 -0.00000200 0.00000789 0.00000083 Cu 21.72893791 18.78509273 24.36153463 -0.00000178 0.00000755 0.00000148 Cu 17.89464835 14.61145348 25.09018277 -0.00000162 0.00000701 0.00000076 Cu 21.72893200 16.69767707 25.82842758 -0.00000172 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2.08854346 36.16135247 0.00000014 -0.00000058 0.00000033 Cu 23.00697420 18.78551666 35.42347250 -0.00000002 -0.00000051 -0.00000050 Cu 11.50410950 2.08854343 36.16135250 0.00000027 -0.00000070 0.00000026 Cu 23.00696506 16.69841251 36.89893120 0.00000051 -0.00000200 -0.00000055 Cu 26.84124728 18.78562075 37.63720464 0.00000039 -0.00000186 0.00000007 Cu 25.56315620 16.69841251 36.89893119 0.00000026 -0.00000175 -0.00000058 Cu 29.39743839 18.78562065 37.63720471 0.00000062 -0.00000189 0.00000009 Cu 25.56314722 14.61133124 38.37530461 0.00000072 -0.00000304 -0.00000072 Cu 14.06028284 16.69849500 39.11233629 0.00000077 -0.00000294 -0.00000006 Cu 12.78219160 14.61133115 38.37530467 0.00000063 -0.00000293 -0.00000085 Cu 16.61647397 16.69849495 39.11233633 0.00000084 -0.00000297 0.00000002 Cu 12.78218296 12.52438173 39.85108977 0.00000097 -0.00000420 -0.00000086 Cu 16.61646557 14.61135531 40.58939756 0.00000103 -0.00000409 -0.00000015 Cu 15.33837409 12.52438164 39.85108984 0.00000096 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45.74726073 0.00000189 -0.00000788 -0.00000162 Cu 11.50405686 6.26387124 46.49757615 0.00000198 -0.00000767 -0.00000085 Cu 10.22596380 4.17601645 45.74726074 0.00000193 -0.00000779 -0.00000162 Cu 14.06024798 6.26387115 46.49757622 0.00000201 -0.00000756 -0.00000093 Cu 10.22595895 2.08744118 47.23418359 0.00000208 -0.00000853 -0.00000144 Cu 14.06024359 4.17630933 47.95285854 0.00000204 -0.00000825 -0.00000066 Cu 12.78215008 2.08744110 47.23418364 0.00000207 -0.00000846 -0.00000143 Cu 16.61643470 4.17630931 47.95285857 0.00000225 -0.00000821 -0.00000069 Cu 28.11929312 18.78637671 48.72026004 0.00000216 -0.00000890 -0.00000135 Cu 16.61643146 2.08350328 49.44915182 0.00000228 -0.00000871 -0.00000108 Cu 30.67548424 18.78637665 48.72026010 0.00000226 -0.00000885 -0.00000146 Cu 3.83547584 2.08350333 49.44915179 0.00000223 -0.00000862 -0.00000110 Cu 15.33833477 16.69293180 50.14536544 0.00000225 -0.00000926 -0.00000168 Cu 19.17262102 18.78090025 50.93688471 0.00000232 -0.00000911 -0.00000117 Cu 17.89452588 16.69293181 50.14536544 0.00000237 -0.00000919 -0.00000167 Cu 21.72881215 18.78090032 50.93688464 0.00000231 -0.00000907 -0.00000117 Cu 17.89452449 14.61939347 51.63487977 0.00000232 -0.00000935 -0.00000141 Cu 21.72881056 16.69773071 52.29687043 0.00000236 -0.00000931 -0.00000112 Cu 20.45071563 14.61939356 51.63487972 0.00000236 -0.00000937 -0.00000137 Cu 24.28500169 16.69773074 52.29687041 0.00000236 -0.00000931 -0.00000112 Cu 10.22609109 12.52474261 17.81192503 -0.00000234 0.00000922 0.00000122 Cu 14.06037722 14.60307943 18.47391593 -0.00000240 0.00000935 0.00000125 Cu 12.78228220 12.52474246 17.81192511 -0.00000238 0.00000928 0.00000122 Cu 16.61656831 14.60307925 18.47391603 -0.00000233 0.00000939 0.00000129 Cu 12.78228064 10.44157285 19.17191086 -0.00000227 0.00000911 0.00000121 Cu 16.61656685 12.52954096 19.96343039 -0.00000228 0.00000923 0.00000150 Cu 15.33847176 10.44157264 19.17191104 -0.00000234 0.00000915 0.00000113 Cu 19.17275798 12.52954099 19.96343036 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