# generated using pymatgen data_VCdO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58967774 _cell_length_b 5.26484532 _cell_length_c 14.28396924 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural VCdO3 _chemical_formula_sum 'V4 Cd4 O12' _cell_volume 269.95413521 _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 V V0 1 0.75000000 0.58099694 0.41860907 1.0 V V1 1 0.75000000 0.91900306 0.91860907 1.0 V V2 1 0.25000000 0.41900306 0.58139093 1.0 V V3 1 0.25000000 0.08099694 0.08139093 1.0 Cd Cd4 1 0.75000000 0.62572419 0.17921407 1.0 Cd Cd5 1 0.25000000 0.12572419 0.32078593 1.0 Cd Cd6 1 0.25000000 0.37427581 0.82078593 1.0 Cd Cd7 1 0.75000000 0.87427581 0.67921407 1.0 O O8 1 0.25000000 0.88731582 0.19250523 1.0 O O9 1 0.75000000 0.89100680 0.38929182 1.0 O O10 1 0.75000000 0.53898042 0.55593697 1.0 O O11 1 0.75000000 0.96101958 0.05593697 1.0 O O12 1 0.25000000 0.46101958 0.44406303 1.0 O O13 1 0.75000000 0.11268418 0.80749477 1.0 O O14 1 0.25000000 0.39100680 0.11070818 1.0 O O15 1 0.25000000 0.03898042 0.94406303 1.0 O O16 1 0.25000000 0.61268418 0.69250523 1.0 O O17 1 0.25000000 0.10899320 0.61070818 1.0 O O18 1 0.75000000 0.38731582 0.30749577 1.0 O O19 1 0.75000000 0.60899320 0.88929182 1.0