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=-48.004221737322716 stress="-0.0007258910906306736 -6.7703959981496424e-06 0.0002782934178747719 -6.7703959981496424e-06 -0.0006176927747315109 -0.00010928109232770965 0.0002782934178747719 -0.00010928109232770965 -0.0007171782643013371" pbc="F F F"
Zr      20.91225428      20.76941242      20.79535754       0.28903211      -0.02949628       0.46959056 
Zr      22.75278033      22.85755081      22.38382773     -14.35517553     -13.16336378       0.44178672 
Zr      23.96970286      21.29489863      20.93381024       0.04010497      -3.40372427      -1.97085912 
Zr      25.23677887      22.51683428      22.77093457       8.73154354       1.53723251      -4.12666141 
Zr      20.94501663      23.65400758      20.85906478      -2.17424170       0.01105959      -1.24357386 
Zr      22.29375489      25.38477302      22.56194135       3.72762690       6.66060752      -2.63197119 
Zr      23.87455773      23.90855725      20.75979631       5.96489348       6.50805590      -9.36823423 
Cu      25.28394373      25.57842680      22.40643268      -0.55562343      -0.65720329       0.54177550 
Cu      20.88416462      21.16965225      23.67750740       0.46424464       0.62150543      -0.69593950 
Zr      22.78055862      22.22950407      25.29998375     -13.47246008       9.99707073       9.67738103 
Cu      24.23232047      21.14379487      24.24140249       9.81517563     -13.86368792      -5.81317295 
Cu      25.44607119      22.76188005      25.47171949      -0.00299803       0.59843600       0.09257824 
Cu      20.75381041      24.25912702      23.74222034      -3.97490593      -3.98622026       3.28077840 
Cu      22.11299994      25.59309890      25.30460284       0.66790567      -0.69606950      -0.47626154 
Cu      23.84268038      23.99305848      23.84323236       5.47251783      10.61986208      12.64244126 
Cu      25.39618603      25.41489319      25.26048442      -0.63764008      -0.75406446      -0.81965791