Cu H 1.0000000000000000 2.5160102210246311 0.0000000000000000 -0.0000000000000000 -1.2580051105123156 2.1789287675886286 -0.0000000000000000 0.0000000000000000 -0.0000000000000000 5.3639211018939124 Cu H 2 2 Selective dynamics Cartesian -0.0000000125800519 1.4526191856555160 5.5520421274923226 T T T 1.2580050979322650 0.7263095964593056 2.8700815765453669 T T T -0.0000000125800519 1.4526191856555160 1.8233493876130402 T T T 1.2580050979322650 0.7263095964593056 4.5053099385599955 T T T