# generated using pymatgen data_Ce2TiO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.87397687 _cell_length_b 10.82381768 _cell_length_c 11.44536998 _cell_angle_alpha 90.02188381 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2TiO5 _chemical_formula_sum 'Ce8 Ti4 O20' _cell_volume 479.91828375 _cell_formula_units_Z 4 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 Ce Ce0 1 0.25000000 0.10215051 0.28061832 1.0 Ce Ce1 1 0.25000000 0.13698924 0.94048798 1.0 Ce Ce2 1 0.75000000 0.36260397 0.44065487 1.0 Ce Ce3 1 0.75000000 0.39773749 0.78137394 1.0 Ce Ce4 1 0.25000000 0.60226251 0.21862606 1.0 Ce Ce5 1 0.25000000 0.63739603 0.55934513 1.0 Ce Ce6 1 0.75000000 0.86301076 0.05951202 1.0 Ce Ce7 1 0.75000000 0.89784949 0.71938168 1.0 Ti Ti8 1 0.25000000 0.18644858 0.62473675 1.0 Ti Ti9 1 0.75000000 0.31334513 0.12415723 1.0 Ti Ti10 1 0.25000000 0.68665487 0.87584277 1.0 Ti Ti11 1 0.75000000 0.81355142 0.37526325 1.0 O O12 1 0.75000000 0.00699241 0.89678840 1.0 O O13 1 0.25000000 0.02665222 0.66419996 1.0 O O14 1 0.25000000 0.22539444 0.46220995 1.0 O O15 1 0.75000000 0.23378146 0.62079365 1.0 O O16 1 0.75000000 0.22847117 0.27004095 1.0 O O17 1 0.25000000 0.27145552 0.77064259 1.0 O O18 1 0.25000000 0.26569784 0.12009466 1.0 O O19 1 0.75000000 0.27390737 0.96185549 1.0 O O20 1 0.75000000 0.47337154 0.16267006 1.0 O O21 1 0.25000000 0.49305272 0.39630654 1.0 O O22 1 0.75000000 0.50694728 0.60369346 1.0 O O23 1 0.25000000 0.52662846 0.83732994 1.0 O O24 1 0.25000000 0.72609263 0.03814451 1.0 O O25 1 0.75000000 0.73430216 0.87990534 1.0 O O26 1 0.75000000 0.72854448 0.22935741 1.0 O O27 1 0.25000000 0.77152883 0.72995905 1.0 O O28 1 0.25000000 0.76621854 0.37920635 1.0 O O29 1 0.75000000 0.77460556 0.53779005 1.0 O O30 1 0.75000000 0.97334778 0.33580004 1.0 O O31 1 0.25000000 0.99300759 0.10321160 1.0