Ba 1.0000000000000000 4.7329461248860314 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.7329461248860314 0.0000000000000000 -0.0000000000000000 0.0000000000000000 4.7329461248860314 Ba 2 Selective dynamics Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 T T T 2.3664730624430157 2.3664730624430157 2.3664730624430157 T T T