# generated using pymatgen data_Fe3Cu2Te(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.66793059 _cell_length_b 8.66793059 _cell_length_c 8.66793031 _cell_angle_alpha 59.97424509 _cell_angle_beta 59.97424509 _cell_angle_gamma 59.97424451 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe3Cu2Te(PO4)6 _chemical_formula_sum 'Fe3 Cu2 Te1 P6 O24' _cell_volume 460.23278152 _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 Fe Fe0 1 0.14460000 0.14460000 0.14460000 1.0 Fe Fe1 1 0.35547800 0.35547800 0.35547800 1.0 Fe Fe2 1 0.64290500 0.64290500 0.64290500 1.0 Cu Cu3 1 0.00931800 0.00931800 0.00931800 1.0 Cu Cu4 1 0.50012700 0.50012700 0.50012700 1.0 Te Te5 1 0.85701600 0.85701600 0.85701600 1.0 P P6 1 0.25291800 0.95520400 0.53686900 1.0 P P7 1 0.53686900 0.25291800 0.95520400 1.0 P P8 1 0.95520400 0.53686900 0.25291800 1.0 P P9 1 0.04517500 0.45373300 0.74486500 1.0 P P10 1 0.45373300 0.74486500 0.04517500 1.0 P P11 1 0.74486500 0.04517500 0.45373300 1.0 O O12 1 0.11574600 0.51163000 0.29937700 1.0 O O13 1 0.29937700 0.11574600 0.51163000 1.0 O O14 1 0.05692500 0.26856300 0.91419900 1.0 O O15 1 0.51163000 0.29937700 0.11574600 1.0 O O16 1 0.01414900 0.61951900 0.80394400 1.0 O O17 1 0.23653700 0.44577300 0.58334700 1.0 O O18 1 0.26856300 0.91419900 0.05692500 1.0 O O19 1 0.44577300 0.58334700 0.23653700 1.0 O O20 1 0.18563900 0.99392100 0.38611400 1.0 O O21 1 0.58334700 0.23653700 0.44577300 1.0 O O22 1 0.07909600 0.94134400 0.73897600 1.0 O O23 1 0.38611400 0.18563900 0.99392100 1.0 O O24 1 0.61951900 0.80394400 0.01414900 1.0 O O25 1 0.91419900 0.05692500 0.26856300 1.0 O O26 1 0.40905600 0.76032400 0.56344700 1.0 O O27 1 0.80394400 0.01414900 0.61951900 1.0 O O28 1 0.56344700 0.40905600 0.76032400 1.0 O O29 1 0.73897600 0.07909600 0.94134400 1.0 O O30 1 0.76032400 0.56344700 0.40905600 1.0 O O31 1 0.99392100 0.38611400 0.18563900 1.0 O O32 1 0.50246400 0.68866100 0.88304400 1.0 O O33 1 0.94134400 0.73897600 0.07909600 1.0 O O34 1 0.68866100 0.88304400 0.50246400 1.0 O O35 1 0.88304400 0.50246400 0.68866100 1.0