# generated using pymatgen data_KLa3Ti4O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.56464170 _cell_length_b 5.56464104 _cell_length_c 9.57716396 _cell_angle_alpha 73.26897555 _cell_angle_beta 73.26897584 _cell_angle_gamma 60.19901085 _symmetry_Int_Tables_number 1 _chemical_formula_structural KLa3Ti4O12 _chemical_formula_sum 'K1 La3 Ti4 O12' _cell_volume 242.67679809 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K K0 1 0.62594092 0.37405908 0.00000000 1.0 La La1 1 0.12229026 0.87770974 0.50000000 1.0 La La2 1 0.37550839 0.11695403 0.76352829 1.0 La La3 1 0.88304597 0.62449161 0.23647171 1.0 Ti Ti4 1 0.25246943 0.99866200 0.12255321 1.0 Ti Ti5 1 0.74763441 0.50126045 0.62684916 1.0 Ti Ti6 1 0.00133800 0.74753057 0.87744679 1.0 Ti Ti7 1 0.49873955 0.25236559 0.37315084 1.0 O O8 1 0.94653761 0.56860326 0.73969744 1.0 O O9 1 0.43139674 0.05346239 0.26030256 1.0 O O10 1 0.09535807 0.90464193 0.00000000 1.0 O O11 1 0.55983486 0.44016514 0.50000000 1.0 O O12 1 0.65964745 0.89073328 0.51249297 1.0 O O13 1 0.14204104 0.37939836 0.00648998 1.0 O O14 1 0.62060164 0.85795896 0.99351002 1.0 O O15 1 0.10926672 0.34035255 0.48750703 1.0 O O16 1 0.37617898 0.67378321 0.74741656 1.0 O O17 1 0.88561307 0.15965891 0.26563572 1.0 O O18 1 0.32621679 0.62382102 0.25258344 1.0 O O19 1 0.84034109 0.11438693 0.73436428 1.0