612 Lattice="15.424212325407728 0.0 0.0 7.712106162703863 13.357759707168144 0.0 0.0 0.0 71.36496088745932" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2479.519357043063 stress="0.0012196799801196573 -4.520944999529949e-07 -7.74131533925483e-07 -4.520944999529949e-07 0.0012229331830294918 -2.783497459142465e-06 -7.74131533925483e-07 -2.783497459142465e-06 2.7734088224755928e-08" free_energy=-2479.519357043063 pbc="T T F" Cu 0.00399546 0.00410828 17.86768303 -0.00000259 -0.00000943 0.00000011 Cu 3.86004853 2.23040151 17.86768296 -0.00000260 -0.00000931 0.00000016 Cu 10.28680369 13.36186795 17.86768302 -0.00000261 -0.00000940 0.00000013 Cu 16.71355880 2.23040153 17.86768296 -0.00000258 -0.00000933 0.00000014 Cu 10.28679897 11.87765528 19.94307541 -0.00000248 -0.00000874 -0.00000009 Cu 6.43074590 0.74618891 19.94307537 -0.00000236 -0.00000901 0.00000002 Cu 12.85750103 11.87765531 19.94307542 -0.00000247 -0.00000887 -0.00000011 Cu 3.86004386 0.74618888 19.94307536 -0.00000253 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8.16701216 28.34009691 -0.00000138 -0.00000539 0.00000006 Cu 7.71605415 5.94071879 28.34009693 -0.00000104 -0.00000431 0.00000003 Cu 6.43070316 8.16701206 28.34009689 -0.00000118 -0.00000490 0.00000030 Cu 7.71603793 4.45646517 30.43906653 -0.00000055 -0.00000356 0.00000014 Cu 11.57209103 6.68275843 30.43906655 -0.00000100 -0.00000277 0.00000001 Cu 10.28674006 4.45646525 30.43906652 -0.00000113 -0.00000368 0.00000009 Cu 9.00138892 6.68275841 30.43906659 -0.00000087 -0.00000297 -0.00000040 Cu 10.28672273 2.97220729 32.53803609 -0.00000086 -0.00000133 -0.00000012 Cu 14.14277571 5.19850059 32.53803618 -0.00000052 -0.00000222 -0.00000043 Cu 12.85742477 2.97220726 32.53803612 -0.00000026 -0.00000127 -0.00000044 Cu 11.57207363 5.19850059 32.53803614 -0.00000044 -0.00000201 0.00000014 Cu 12.85740669 1.48794728 34.63700560 0.00000043 -0.00000054 0.00000062 Cu 16.71345975 3.71424044 34.63700570 0.00000016 0.00000084 0.00000061 Cu 15.42810883 1.48794723 34.63700562 -0.00000081 -0.00000066 0.00000067 Cu 14.14275775 3.71424050 34.63700571 -0.00000023 0.00000019 0.00000014 Cu 7.71598444 13.36144684 36.73597532 -0.00000031 0.00000214 -0.00000071 Cu 3.85993139 2.22998055 36.73597536 -0.00000011 0.00000071 -0.00000049 Cu 10.28668635 13.36144679 36.73597534 0.00000118 0.00000255 -0.00000068 Cu 1.28922930 2.22998050 36.73597532 0.00000082 0.00000148 -0.00000011 Cu 10.28666876 11.87718905 38.83494487 0.00000164 0.00000263 0.00000069 Cu 6.43061578 0.74572251 38.83494487 0.00000124 0.00000399 0.00000023 Cu 12.85737086 11.87718906 38.83494489 0.00000065 0.00000254 0.00000035 Cu 3.85991377 0.74572258 38.83494491 0.00000066 0.00000350 -0.00000004 Cu 12.85735464 10.39293532 40.93391459 0.00000116 0.00000512 -0.00000048 Cu 16.71340773 12.61922860 40.93391450 0.00000131 0.00000427 -0.00000009 Cu 15.42805667 10.39293530 40.93391455 0.00000169 0.00000517 -0.00000012 Cu 14.14270564 12.61922862 40.93391451 0.00000164 0.00000449 0.00000010 Cu 15.42804233 8.90868780 43.03288398 0.00000194 0.00000609 0.00000019 Cu 19.28409537 11.13498102 43.03288396 0.00000198 0.00000665 0.00000002 Cu 17.99874443 8.90868780 43.03288400 0.00000142 0.00000575 -0.00000017 Cu 16.71339334 11.13498105 43.03288398 0.00000159 0.00000621 -0.00000027 Cu 17.99873228 7.42444820 45.13185670 0.00000168 0.00000731 -0.00000030 Cu 6.43057299 9.65074157 45.13185668 0.00000187 0.00000657 -0.00000011 Cu 5.14522194 7.42444816 45.13185666 0.00000251 0.00000783 0.00000013 Cu 19.28408324 9.65074150 45.13185666 0.00000225 0.00000730 0.00000022 Cu 5.14521241 5.94021812 47.23076497 0.00000270 0.00000831 0.00000007 Cu 9.00126550 8.16651138 47.23076496 0.00000254 0.00000881 -0.00000008 Cu 7.71591453 5.94021815 47.23076497 0.00000189 0.00000786 0.00000001 Cu 6.43056349 8.16651142 47.23076499 0.00000202 0.00000825 -0.00000043 Cu 7.71590803 4.45599877 49.33093608 0.00000221 0.00000912 -0.00000018 Cu 11.57196107 6.68229208 49.33093603 0.00000240 0.00000864 -0.00000008 Cu 10.28661006 4.45599876 49.33093608 0.00000264 0.00000917 -0.00000015 Cu 9.00125900 6.68229206 49.33093601 0.00000254 0.00000885 0.00000011 Cu 10.28660543 2.97178607 51.40632846 0.00000257 0.00000941 -0.00000011 Cu 14.14265850 5.19807940 51.40632842 0.00000256 0.00000946 -0.00000008 Cu 12.85730749 2.97178610 51.40632847 0.00000246 0.00000938 -0.00000010 Cu 11.57195645 5.19807937 51.40632840 0.00000250 0.00000946 -0.00000011 Cu 17.99890975 4.45669481 17.86768293 -0.00000253 -0.00000940 0.00000020 Cu 6.43075044 6.68298814 17.86768297 -0.00000248 -0.00000937 0.00000014 Cu 5.14539947 4.45669482 17.86768293 -0.00000253 -0.00000939 0.00000021 Cu 3.86004840 6.68298812 17.86768296 -0.00000248 -0.00000936 0.00000015 Cu 5.14539488 2.97248216 19.94307532 -0.00000250 -0.00000877 0.00000002 Cu 9.00144791 5.19877547 19.94307532 -0.00000232 -0.00000902 0.00000015 Cu 7.71609693 2.97248219 19.94307534 -0.00000247 -0.00000892 0.00000005 Cu 6.43074586 5.19877546 19.94307531 -0.00000251 -0.00000900 0.00000012 Cu 7.71609041 1.48826288 22.04324644 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10.28675635 10.39330534 28.34009690 -0.00000111 -0.00000426 -0.00000033 Cu 9.00140535 12.61959863 28.34009685 -0.00000126 -0.00000494 0.00000012 Cu 10.28673999 8.90905171 30.43906650 -0.00000055 -0.00000377 0.00000034 Cu 14.14279329 11.13534494 30.43906642 -0.00000118 -0.00000286 0.00000040 Cu 12.85744214 8.90905171 30.43906647 -0.00000114 -0.00000351 0.00000053 Cu 11.57209118 11.13534489 30.43906646 -0.00000098 -0.00000294 0.00000011 Cu 12.85742460 7.42479377 32.53803619 -0.00000063 -0.00000114 -0.00000040 Cu 16.71347770 9.65108717 32.53803609 -0.00000044 -0.00000198 -0.00000021 Cu 15.42812664 7.42479382 32.53803619 -0.00000024 -0.00000137 -0.00000056 Cu 14.14277566 9.65108710 32.53803611 -0.00000052 -0.00000189 -0.00000012 Cu 15.42810860 5.94053386 34.63700573 0.00000036 -0.00000042 0.00000064 Cu 19.28416155 8.16682710 34.63700576 0.00000035 0.00000058 0.00000004 Cu 17.99881068 5.94053389 34.63700578 -0.00000043 -0.00000068 0.00000017 Cu 16.71345954 8.16682715 34.63700574 -0.00000002 0.00000007 0.00000009 Cu 2.57458037 4.45627382 36.73597543 -0.00000015 0.00000168 -0.00000086 Cu 6.43063333 6.68256712 36.73597541 -0.00000002 0.00000069 -0.00000000 Cu 5.14528232 4.45627372 36.73597539 0.00000100 0.00000250 -0.00000022 Cu 3.85993120 6.68256714 36.73597538 0.00000105 0.00000145 0.00000015 Cu 5.14526484 2.97201589 38.83494489 0.00000145 0.00000300 0.00000064 Cu 9.00131797 5.19830901 38.83494499 0.00000112 0.00000429 -0.00000005 Cu 7.71596698 2.97201586 38.83494492 0.00000036 0.00000259 0.00000011 Cu 6.43061596 5.19830912 38.83494503 0.00000043 0.00000351 -0.00000053 Cu 7.71595064 1.48776210 40.93391454 0.00000092 0.00000511 -0.00000034 Cu 11.57200376 3.71405547 40.93391457 0.00000125 0.00000393 -0.00000041 Cu 10.28665262 1.48776208 40.93391452 0.00000192 0.00000524 -0.00000033 Cu 9.00130171 3.71405541 40.93391453 0.00000150 0.00000455 0.00000027 Cu 17.99874430 13.36127434 43.03288394 0.00000224 0.00000589 0.00000015 Cu 14.14269125 2.22980789 43.03288392 0.00000194 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0.00000941 -0.00000008 Cu 11.57195641 0.74549279 51.40632848 0.00000256 0.00000951 -0.00000015 Cu 17.99871148 11.87695923 51.40632844 0.00000257 0.00000940 -0.00000009 Cu 9.00125433 0.74549280 51.40632847 0.00000255 0.00000945 -0.00000018 Cu 12.85750577 13.36186797 17.86768304 -0.00000264 -0.00000942 0.00000009 Cu 9.00145266 2.23040164 17.86768301 -0.00000263 -0.00000945 0.00000010 Cu 15.42820784 13.36186804 17.86768306 -0.00000264 -0.00000944 0.00000010 Cu 6.43075059 2.23040156 17.86768298 -0.00000258 -0.00000937 0.00000013 Cu 15.42820308 11.87765533 19.94307542 -0.00000244 -0.00000878 -0.00000006 Cu 11.57215003 0.74618895 19.94307538 -0.00000240 -0.00000906 0.00000007 Cu 17.99890514 11.87765536 19.94307542 -0.00000246 -0.00000895 -0.00000007 Cu 9.00144799 0.74618894 19.94307539 -0.00000261 -0.00000905 0.00000001 Cu 17.99889862 10.39343599 22.04324646 -0.00000232 -0.00000842 0.00000021 Cu 21.85495171 12.61972926 22.04324646 -0.00000224 -0.00000801 0.00000014 Cu 20.56960068 10.39343599 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