# generated using pymatgen data_Ca3CeTi4O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.70367190 _cell_length_b 5.41181284 _cell_length_c 5.49378155 _cell_angle_alpha 89.86516587 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3CeTi4O12 _chemical_formula_sum 'Ca3 Ce1 Ti4 O12' _cell_volume 229.03968087 _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 Ca Ca0 1 0.50000000 0.49129040 0.54275515 1.0 Ca Ca1 1 0.00000000 0.99202535 0.95509882 1.0 Ca Ca2 1 0.00000000 0.50820523 0.46028606 1.0 Ce Ce3 1 0.50000000 0.00749014 0.04080266 1.0 Ti Ti4 1 0.24658932 0.99907309 0.49965399 1.0 Ti Ti5 1 0.75425522 0.50081476 0.99981554 1.0 Ti Ti6 1 0.75341068 0.99907309 0.49965399 1.0 Ti Ti7 1 0.24574478 0.50081476 0.99981554 1.0 O O8 1 0.50000000 0.57121750 0.97979120 1.0 O O9 1 0.50000000 0.92384642 0.48865301 1.0 O O10 1 0.00000000 0.42380123 0.02381747 1.0 O O11 1 0.00000000 0.07689672 0.51618034 1.0 O O12 1 0.78646417 0.79454916 0.20670651 1.0 O O13 1 0.20972660 0.70974902 0.71092107 1.0 O O14 1 0.28724944 0.20870396 0.79082790 1.0 O O15 1 0.70629882 0.28972403 0.28838262 1.0 O O16 1 0.71275056 0.20870396 0.79082790 1.0 O O17 1 0.29370118 0.28972403 0.28838262 1.0 O O18 1 0.21353583 0.79454916 0.20670651 1.0 O O19 1 0.79027340 0.70974902 0.71092107 1.0