# generated using pymatgen data_FeRe3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.40429596 _cell_length_b 5.40430510 _cell_length_c 4.40422398 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000172 _symmetry_Int_Tables_number 1 _chemical_formula_structural FeRe3 _chemical_formula_sum 'Fe2 Re6' _cell_volume 111.39841336 _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 Fe Fe0 1 0.33332953 0.66667341 0.75000000 1.0 Fe Fe1 1 0.66665918 0.33331724 0.25000000 1.0 Re Re2 1 0.16697595 0.33395210 0.25000000 1.0 Re Re3 1 0.66604252 0.83303297 0.25000000 1.0 Re Re4 1 0.16699053 0.83303197 0.25000000 1.0 Re Re5 1 0.83303163 0.66605278 0.75000000 1.0 Re Re6 1 0.33395040 0.16696721 0.75000000 1.0 Re Re7 1 0.83302126 0.16697433 0.75000000 1.0