16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-32.74769602397639 stress="0.00027454075837934086 4.269754585959528e-05 3.4192920472684824e-06 4.269754585959528e-05 0.00030559925198323017 3.206827858074878e-05 3.4192920472684824e-06 3.206827858074878e-05 0.00026405428321872636" pbc="F F F" Cu 21.12990665 20.78220450 21.28278197 0.99692441 1.14725965 0.95443905 Cu 22.67252859 22.63362859 22.32702941 -0.29563323 -0.35604274 0.11500802 Cu 24.07034430 21.04852473 21.05473499 -0.64568839 1.03829599 1.14163001 Cu 25.41561068 22.84608739 22.40480033 -0.83052875 -0.16442023 0.57600340 Cu 20.87719504 23.79869006 21.11041876 1.01869878 -0.46711601 0.89331472 Cu 22.26735611 25.33533445 22.24148635 0.48854101 -1.32461989 0.47807635 Cu 24.08611608 24.03369179 21.02598936 -0.66216620 -0.16252661 0.56549616 Cu 25.22329650 25.46375436 22.40583543 -0.65231428 -0.94994848 0.83185141 Cu 20.75559716 20.70178472 24.29874826 1.10502068 1.05188406 -0.53783503 Cu 22.27290972 22.23603037 25.36136659 0.19030779 0.21498710 -1.34265478 Cu 24.05835534 20.74645637 23.98193431 -0.51313693 1.68653007 -0.43232207 Cu 25.42001865 22.70070203 25.20342959 -0.52797988 0.21847525 -0.69222639 Cu 20.90085166 23.99793547 24.28187239 1.55529744 -0.25889997 -0.35058110 Cu 22.51001192 25.48453339 25.60170120 0.33549223 -1.24045916 -1.18338830 Cu 23.87793365 23.71904386 24.00082602 -0.52185908 0.68496975 -0.08824828 Cu 25.74624097 25.64302402 25.35498893 -1.04097561 -1.11836878 -0.92856316