864 Lattice="15.329999926034638 0.0 0.0 15.329999926034638 18.775338787844362 0.0 0.0 0.0 70.80623667178433" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3009.333901901594 stress="0.0009837713885794048 -1.6124467551336253e-07 -3.8226398449288845e-07 -1.6124467551336253e-07 0.0006209749078755536 2.0585189295629125e-06 -3.8226398449288845e-07 2.0585189295629125e-06 3.303662707670056e-07" free_energy=-3009.333901901594 pbc="T T F" Cu 0.00129117 0.00905363 17.80948745 0.00000005 0.00000665 -0.00000117 Cu 3.83379112 2.06778234 18.49459849 -0.00000103 0.00000811 0.00000141 Cu 2.55629134 0.00905361 17.80948734 -0.00000192 0.00000666 0.00000016 Cu 6.38879119 2.06778234 18.49459855 -0.00000174 0.00000807 0.00000128 Cu 17.88629066 16.70107118 19.17878540 -0.00000133 0.00000625 0.00000128 Cu 6.38879035 0.00864954 19.94469871 -0.00000099 0.00000605 0.00000361 Cu 20.44129066 16.70107120 19.17878537 -0.00000122 0.00000585 0.00000127 Cu 8.94379034 0.00864949 19.94469912 -0.00000113 0.00000673 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14.60444912 36.14444319 0.00000017 -0.00000065 0.00000001 Cu 17.88625464 12.51829844 35.40720138 0.00000009 -0.00000024 -0.00000000 Cu 21.71875234 14.60444913 36.14444321 0.00000023 -0.00000067 -0.00000002 Cu 17.88625014 10.43217469 36.88153295 0.00000028 -0.00000113 -0.00000018 Cu 21.71874794 12.51836538 37.62002214 0.00000034 -0.00000148 -0.00000026 Cu 20.44125015 10.43217468 36.88153297 0.00000025 -0.00000110 -0.00000019 Cu 24.27374793 12.51836539 37.62002217 0.00000035 -0.00000151 -0.00000026 Cu 20.44124577 8.34603704 38.35720468 0.00000045 -0.00000193 -0.00000043 Cu 8.94374372 10.43223641 39.09387433 0.00000049 -0.00000233 -0.00000039 Cu 7.66624584 8.34603703 38.35720468 0.00000040 -0.00000193 -0.00000037 Cu 11.49874370 10.43223641 39.09387432 0.00000049 -0.00000235 -0.00000036 Cu 7.66624166 6.25999104 39.83314629 0.00000055 -0.00000280 -0.00000039 Cu 11.49873964 8.34605417 40.56996836 0.00000061 -0.00000310 -0.00000053 Cu 10.22124163 6.25999103 39.83314626 0.00000057 -0.00000276 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