Ba 1.0000000000000000 -2.5398432956669401 2.5398432956669401 2.5398432956669401 2.5398432956669401 -2.5398432956669401 2.5398432956669401 2.5398432956669401 2.5398432956669401 -2.5398432956669401 Ba 1 Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000