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=-39.22735752224441 stress="0.00011762777099393045 0.00010392276413222891 9.2851601583245e-05 0.00010392276413222891 0.0001182619178569176 -9.253062830984425e-06 9.2851601583245e-05 -9.253062830984425e-06 0.00010321391770880233" pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 0.92524877 0.80881674 0.90137452 Cu 22.70960170 22.31143450 22.33833517 -1.58717655 2.06822193 0.07286183 Cu 23.78829595 20.83509776 21.11608958 0.45421396 -0.55567782 -0.30517455 Cu 25.27812781 22.58208812 22.32834452 -0.65671390 0.14515497 0.62165984 Cu 20.87679405 23.95894820 21.20259391 0.70222634 -0.75979064 0.59281288 Cu 22.56504129 25.20865944 22.36550211 -4.21830295 3.56919297 3.23038530 Cu 23.78802619 24.22277084 21.18584377 4.19557854 -2.97400617 -3.36298046 Cu 25.68362810 25.69581920 22.64685009 -1.29626643 -1.17823221 0.61088262 Cu 21.26959405 21.17626233 23.79147921 0.27619149 0.37979810 -0.04694780 Cu 22.48843198 22.48658558 25.65300231 0.40160445 0.41300518 -1.37516919 Cu 23.87975136 20.95774659 23.75992857 0.45373629 0.38410469 0.78372109 Cu 25.45789336 22.38825682 25.27041603 -1.26054419 0.59338579 -1.01489333 Cu 21.19178619 24.17895518 24.10809008 0.77456264 -0.61499758 0.03465688 Cu 22.61455359 25.53253581 25.64904689 0.58104484 -0.82272104 -0.68903931 Cu 23.78091226 24.10609294 23.96603997 1.18344687 -0.77959387 0.97299243 Cu 25.30598025 25.32157598 25.51361598 -0.92885016 -0.67666104 -1.02714274