864 Lattice="15.337142109897114 0.0 0.0 15.337142109897114 18.784086140900463 0.0 0.0 0.0 35.419612502994575" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3006.99218575 stress="0.004438156626485621 -3.734838010794444e-07 -8.801920999084927e-07 -3.734838010794444e-07 0.0035639593959067534 5.392350622742485e-06 -8.801920999084927e-07 5.392350622742485e-06 7.254113627093962e-07" pbc="T T F" Cu 0.00129715 0.00961770 0.11213591 -0.00000116 0.00000840 0.00000137 Cu 3.83558252 2.08855749 0.77364048 -0.00000113 0.00000834 0.00000092 Cu 2.55748748 0.00961797 0.11213578 -0.00000118 0.00000833 0.00000122 Cu 6.39177293 2.08855684 0.77364088 -0.00000132 0.00000854 0.00000084 Cu 17.89462923 16.70731631 1.46763561 -0.00000134 0.00000834 0.00000141 Cu 6.39177207 0.01045697 2.25930036 -0.00000153 0.00000822 0.00000093 Cu 20.45081972 16.70731589 1.46763595 -0.00000129 0.00000868 0.00000133 Cu 8.94796239 0.01045651 2.25930069 -0.00000084 0.00000834 0.00000098 Cu 20.45081902 14.61753087 2.95272019 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7.38062623 -0.00000104 0.00000648 0.00000116 Cu 19.17271472 10.43634465 8.11867066 -0.00000120 0.00000628 0.00000076 Cu 15.33842699 6.26247991 8.86141823 -0.00000107 0.00000622 0.00000118 Cu 19.17271058 8.34984661 9.59538033 -0.00000080 0.00000481 0.00000073 Cu 17.89461731 6.26248009 8.86141809 -0.00000090 0.00000602 0.00000144 Cu 21.72890095 8.34984611 9.59538068 -0.00000110 0.00000505 0.00000069 Cu 17.89461301 4.17523231 10.33372730 -0.00000063 0.00000494 0.00000062 Cu 6.39175428 6.26255678 11.07351766 -0.00000067 0.00000485 0.00000030 Cu 5.11366127 4.17523199 10.33372754 -0.00000104 0.00000480 0.00000060 Cu 8.94794466 6.26255642 11.07351794 -0.00000089 0.00000477 -0.00000002 Cu 5.11365668 2.08840870 11.80968656 -0.00000084 0.00000430 0.00000048 Cu 8.94793979 4.17538916 12.54792442 -0.00000053 0.00000326 0.00000012 Cu 7.66984701 2.08840824 11.80968688 -0.00000052 0.00000434 0.00000063 Cu 11.50413017 4.17538925 12.54792433 -0.00000071 0.00000343 0.00000043 Cu 7.66984204 0.00126353 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