864 Lattice="15.359999968497869 0.0 0.0 15.35999996849787 18.812081185992735 0.0 0.0 0.0 35.47240046625956" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3012.99467271 stress="0.0019602153623216115 -1.8401995338345845e-07 -4.293232984434124e-07 -1.8401995338345845e-07 0.0013602008229219244 3.669319271280991e-06 -4.293232984434124e-07 3.669319271280991e-06 6.775129894310215e-07" pbc="T T F" Cu 0.00127571 0.01457018 0.11047888 0.00000185 0.00000557 -0.00000199 Cu 3.84127592 2.07473229 0.79617047 -0.00000149 0.00000686 0.00000069 Cu 2.56127601 0.01457016 0.11047867 -0.00000136 0.00000589 0.00000055 Cu 6.40127583 2.07473238 0.79617049 -0.00000051 0.00000596 0.00000091 Cu 17.92127560 16.73576297 1.48508086 -0.00000041 0.00000552 0.00000100 Cu 6.40127545 0.00894188 2.24396078 -0.00000108 0.00000569 0.00000215 Cu 20.48127564 16.73576298 1.48508087 -0.00000075 0.00000557 0.00000086 Cu 8.96127534 0.00894187 2.24396127 0.00000005 0.00000562 -0.00000340 Cu 20.48127505 14.63415146 2.95842967 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7.39347473 -0.00000111 0.00000419 -0.00000008 Cu 19.20127012 10.45221350 8.12931519 -0.00000038 0.00000436 -0.00000025 Cu 15.36126925 6.27183607 8.87472685 -0.00000043 0.00000442 0.00000065 Cu 19.20126828 8.36232597 9.61049754 -0.00000138 0.00000395 0.00000114 Cu 17.92126920 6.27183614 8.87472694 -0.00000012 0.00000374 -0.00000040 Cu 21.76126816 8.36232607 9.61049746 -0.00000036 0.00000308 0.00000153 Cu 17.92126708 4.18160729 10.34833694 -0.00000006 0.00000330 0.00000024 Cu 6.40126600 6.27193193 11.09021312 0.00000005 0.00000358 -0.00000039 Cu 5.12126715 4.18160721 10.34833682 -0.00000067 0.00000425 0.00000145 Cu 8.96126612 6.27193201 11.09021299 -0.00000137 0.00000292 0.00000080 Cu 5.12126498 2.09156944 11.82764068 -0.00000222 0.00000340 0.00000107 Cu 8.96126364 4.18170260 12.56618223 -0.00000013 0.00000212 0.00000061 Cu 7.68126465 2.09156950 11.82764073 0.00000125 0.00000282 0.00000079 Cu 11.52126363 4.18170257 12.56618235 0.00000015 0.00000262 -0.00000062 Cu 7.68126226 0.00129276 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16.64123835 12.53024902 33.25576922 0.00000030 -0.00000574 -0.00000150 Cu 12.80123807 8.37919834 33.94467947 0.00000060 -0.00000480 -0.00000003 Cu 16.64123800 10.43936059 34.63037135 0.00000078 -0.00000557 -0.00000085 Cu 15.36123804 8.37919845 33.94467953 0.00000087 -0.00000654 -0.00000113 Cu 19.20123795 10.43936067 34.63037132 0.00000093 -0.00000608 -0.00000091 Cu 5.12127584 6.28526389 0.11047851 0.00000125 0.00000602 0.00000180 Cu 8.96127583 8.34542615 0.79617046 0.00000021 0.00000511 0.00000097 Cu 7.68127609 6.28526384 0.11047846 -0.00000162 0.00000623 0.00000302 Cu 11.52127594 8.34542604 0.79617045 -0.00000090 0.00000626 0.00000162 Cu 7.68127565 4.19437539 1.48508089 -0.00000085 0.00000686 0.00000063 Cu 11.52127551 6.27963559 2.24396094 -0.00000161 0.00000560 0.00000101 Cu 10.24127563 4.19437538 1.48508088 -0.00000071 0.00000689 0.00000139 Cu 14.08127544 6.27963556 2.24396090 -0.00000073 0.00000605 0.00000132 Cu 10.24127502 2.09276381 2.95842967 -0.00000071 0.00000648 0.00000119 Cu 14.08127447 4.18146122 3.67588184 0.00000041 0.00000616 0.00000092 Cu 12.80127494 2.09276393 2.95842968 0.00000008 0.00000507 0.00000069 Cu 16.64127459 4.18146115 3.67588180 -0.00000100 0.00000726 0.00000057 Cu 12.80127402 0.00048880 4.45088147 -0.00000075 0.00000665 0.00000121 Cu 16.64127325 2.09237275 5.17690547 0.00000091 0.00000483 0.00000081 Cu 15.36127391 0.00048895 4.45088168 0.00000006 0.00000519 -0.00000149 Cu 3.84127344 2.09237274 5.17690552 -0.00000099 0.00000501 0.00000020 Cu 15.36127253 16.72256285 5.90859752 0.00000042 0.00000433 0.00000197 Cu 3.84127185 0.00123034 6.66088856 0.00000022 0.00000483 0.00000150 Cu 17.92127263 16.72256289 5.90859770 -0.00000046 0.00000404 0.00000000 Cu 6.40127193 0.00123036 6.66088867 -0.00000060 0.00000461 0.00000063 Cu 17.92127107 14.63314638 7.39347458 -0.00000137 0.00000463 0.00000119 Cu 21.76127007 16.72290722 8.12931505 -0.00000034 0.00000442 0.00000107 Cu 20.48127097 14.63314642 7.39347462 -0.00000010 0.00000439 0.00000088 Cu 24.32127012 16.72290725 8.12931513 -0.00000106 0.00000414 0.00000047 Cu 20.48126916 12.54252980 8.87472680 -0.00000074 0.00000462 0.00000116 Cu 24.32126800 14.63301973 9.61049750 0.00000015 0.00000385 0.00000135 Cu 23.04126908 12.54252984 8.87472674 -0.00000002 0.00000426 0.00000156 Cu 26.88126812 14.63301979 9.61049762 -0.00000144 0.00000316 -0.00000017 Cu 23.04126709 10.45230094 10.34833681 -0.00000063 0.00000429 0.00000143 Cu 11.52126585 12.54262568 11.09021301 0.00000035 0.00000355 0.00000058 Cu 10.24126708 10.45230112 10.34833691 -0.00000049 0.00000243 0.00000001 Cu 14.08126590 12.54262580 11.09021300 -0.00000038 0.00000218 0.00000061 Cu 10.24126484 8.36226319 11.82764063 -0.00000001 0.00000347 0.00000127 Cu 14.08126361 10.45239621 12.56618226 0.00000004 0.00000348 0.00000005 Cu 12.80126486 8.36226336 11.82764068 -0.00000026 0.00000168 0.00000077 Cu 16.64126360 10.45239630 12.56618224 0.00000020 0.00000235 0.00000068 Cu 12.80126240 6.27198647 13.30652971 0.00000074 0.00000235 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10.45269263 23.65063684 0.00000012 -0.00000356 -0.00000015 Cu 19.20124497 12.54301726 24.39251317 -0.00000039 -0.00000339 -0.00000238 Cu 17.92124570 10.45269255 23.65063682 0.00000170 -0.00000278 0.00000001 Cu 21.76124477 12.54301720 24.39251308 0.00000172 -0.00000297 -0.00000122 Cu 17.92124391 8.36229855 25.13035244 0.00000144 -0.00000358 -0.00000148 Cu 21.76124303 10.45278847 25.86612304 0.00000181 -0.00000453 0.00000014 Cu 20.48124407 8.36229857 25.13035239 -0.00000019 -0.00000396 -0.00000076 Cu 8.96124335 10.45278841 25.86612312 -0.00000127 -0.00000402 -0.00000042 Cu 20.48124249 6.27241105 26.61153482 -0.00000011 -0.00000435 -0.00000001 Cu 8.96124165 8.36217188 27.34737545 0.00000112 -0.00000454 -0.00000177 Cu 7.68124234 6.27241106 26.61153487 0.00000186 -0.00000454 -0.00000036 Cu 11.52124175 8.36217187 27.34737549 -0.00000002 -0.00000455 -0.00000211 Cu 7.68124103 4.18200675 28.07996139 0.00000105 -0.00000464 -0.00000145 Cu 11.52124045 6.27275555 28.83225226 0.00000055 -0.00000596 0.00000021 Cu 10.24124103 4.18200682 28.07996142 0.00000078 -0.00000548 -0.00000182 Cu 14.08124036 6.27275551 28.83225237 0.00000122 -0.00000566 -0.00000116 Cu 10.24123981 2.09086445 29.56394455 0.00000156 -0.00000589 -0.00000166 Cu 14.08123931 4.18274817 30.28996861 0.00000142 -0.00000584 -0.00000258 Cu 12.80123991 2.09086444 29.56394448 0.00000032 -0.00000600 -0.00000103 Cu 16.64123938 4.18274819 30.28996842 0.00000081 -0.00000596 -0.00000056 Cu 28.16123900 18.81385691 31.06496810 0.00000046 -0.00000497 -0.00000028 Cu 16.64123860 2.09047315 31.78242041 0.00000114 -0.00000552 -0.00000164 Cu 15.36123897 0.00177577 31.06496824 0.00000120 -0.00000566 -0.00000161 Cu 3.84123874 2.09047318 31.78242037 0.00000021 -0.00000556 -0.00000092 Cu 15.36123835 16.71568265 32.49688912 0.00000219 -0.00000582 -0.00000093 Cu 3.84123837 -0.01113858 33.25576919 0.00000009 -0.00000361 -0.00000123 Cu 17.92123873 16.71568266 32.49688926 -0.00000213 -0.00000584 -0.00000238 Cu 6.40123836 -0.01113833 33.25576917 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10.45215494 3.67588192 -0.00000124 0.00000659 -0.00000008 Cu 17.92127507 8.36345767 2.95842970 -0.00000083 0.00000520 0.00000012 Cu 21.76127452 10.45215523 3.67588175 -0.00000019 0.00000344 0.00000107 Cu 17.92127394 6.27118267 4.45088175 0.00000039 0.00000534 -0.00000225 Cu 21.76127327 8.36306638 5.17690547 0.00000052 0.00000602 0.00000064 Cu 20.48127418 6.27118272 4.45088146 -0.00000261 0.00000503 0.00000086 Cu 8.96127346 8.36306654 5.17690540 -0.00000141 0.00000418 0.00000131 Cu 5.12127261 4.18117532 5.90859762 0.00000034 0.00000543 0.00000056 Cu 8.96127192 6.27192402 6.66088868 -0.00000050 0.00000530 0.00000023 Cu 7.68127273 4.18117537 5.90859767 -0.00000107 0.00000498 0.00000044 Cu 11.52127194 6.27192411 6.66088872 -0.00000042 0.00000420 0.00000013 Cu 7.68127107 2.09175890 7.39347454 -0.00000049 0.00000507 0.00000195 Cu 11.52127020 4.18151973 8.12931513 -0.00000062 0.00000476 0.00000040 Cu 10.24127118 2.09175891 7.39347463 -0.00000158 0.00000494 0.00000126 Cu 14.08127024 4.18151990 8.12931511 -0.00000098 0.00000281 0.00000053 Cu 10.24126909 0.00114231 8.87472682 0.00000023 0.00000506 0.00000131 Cu 14.08126817 2.09163218 9.61049761 -0.00000036 0.00000469 0.00000019 Cu 28.16126920 18.81322363 8.87472681 -0.00000138 0.00000342 0.00000111 Cu 16.64126810 2.09163226 9.61049768 0.00000019 0.00000370 -0.00000093 Cu 28.16126687 16.72299468 10.34833685 0.00000048 0.00000422 0.00000129 Cu 1.28126604 0.00123824 11.09021293 -0.00000155 0.00000318 0.00000134 Cu 15.36126705 16.72299473 10.34833686 -0.00000130 0.00000350 0.00000078 Cu 3.84126584 0.00123819 11.09021300 0.00000043 0.00000365 0.00000064 Cu 15.36126478 14.63295692 11.82764065 -0.00000104 0.00000330 0.00000104 Cu 19.20126355 16.72309003 12.56618207 -0.00000059 0.00000221 0.00000208 Cu 17.92126465 14.63295697 11.82764063 0.00000037 0.00000263 0.00000137 Cu 21.76126344 16.72309009 12.56618226 0.00000063 0.00000163 0.00000053 Cu 17.92126239 12.54268019 13.30652957 -0.00000019 0.00000205 0.00000063 Cu 21.76126125 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