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=-48.84087791531136 stress="-0.0003620368386805237 -0.00010274795378878424 0.0002155252328528581 -0.00010274795378878424 -0.0004230192246251334 0.0001296427201923612 0.0002155252328528581 0.0001296427201923612 -0.0005032867931551067" pbc="F F F" Zr 20.91225428 20.76941242 20.79535754 0.42863161 0.00375655 0.49241617 Zr 22.75278033 22.85755081 22.38382773 -8.23835183 -6.97347927 7.18242087 Zr 23.96970286 21.29489863 20.93381024 0.20849731 -3.25463042 -1.89113325 Zr 25.23677887 22.51683428 22.92693080 6.60136486 3.58756027 -2.71235118 Zr 20.78902040 23.65400758 20.85906478 -1.40274326 -0.16374631 -1.21469083 Zr 22.08315778 25.38477302 22.56194135 3.72803986 7.44216362 -5.51655466 Zr 23.87455773 23.90855725 20.75979631 5.64976639 6.51858648 -8.86533722 Cu 25.52182551 25.40760342 22.47357721 -0.60535210 -0.49837020 0.32060345 Cu 21.21958587 20.92509457 23.74005554 0.20040984 0.16745347 -0.83459618 Zr 22.78055862 22.22950407 25.29998375 -1.47094071 1.91665603 1.61234385 Cu 24.23232047 21.14379487 23.99596198 -1.51647472 -5.98934432 1.93128503 Cu 25.63690941 22.82384308 25.40527573 -0.45265118 0.56723579 0.34316994 Cu 21.04132417 24.25912702 23.74222034 -5.34766155 -5.19667794 5.13806623 Cu 22.46299858 25.41738309 24.98497289 0.45187392 0.40890513 1.77113622 Cu 23.84268038 24.19673490 23.84323236 2.33437484 2.33502761 3.00740496 Cu 25.61516908 25.59070442 25.25108549 -0.56878326 -0.87109648 -0.76418341