# generated using pymatgen data_ZrCo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.36556200 _cell_length_b 5.36556200 _cell_length_c 4.21575900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000003 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrCo3 _chemical_formula_sum 'Zr2 Co6' _cell_volume 105.10825909 _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 Zr Zr0 1 0.33333300 0.66666700 0.75000000 1.0 Zr Zr1 1 0.66666700 0.33333300 0.25000000 1.0 Co Co2 1 0.15142100 0.30284200 0.25000000 1.0 Co Co3 1 0.69715800 0.84857900 0.25000000 1.0 Co Co4 1 0.15142100 0.84857900 0.25000000 1.0 Co Co5 1 0.84857900 0.69715800 0.75000000 1.0 Co Co6 1 0.30284200 0.15142100 0.75000000 1.0 Co Co7 1 0.84857900 0.15142100 0.75000000 1.0