# generated using pymatgen data_VCuO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.04986116 _cell_length_b 3.04986116 _cell_length_c 11.58814700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998178 _symmetry_Int_Tables_number 1 _chemical_formula_structural VCuO2 _chemical_formula_sum 'V2 Cu2 O4' _cell_volume 93.34796306 _cell_formula_units_Z 2 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 0.00000000 0.00000000 0.00000000 1.0 V V1 1 0.00000000 0.00000000 0.50000000 1.0 Cu Cu2 1 0.66666700 0.33333300 0.75000000 1.0 Cu Cu3 1 0.33333300 0.66666700 0.25000000 1.0 O O4 1 0.66666700 0.33333300 0.59055300 1.0 O O5 1 0.66666700 0.33333300 0.90944700 1.0 O O6 1 0.33333300 0.66666700 0.09055300 1.0 O O7 1 0.33333300 0.66666700 0.40944700 1.0