# generated using pymatgen data_Zr4AlFeRe6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.23848103 _cell_length_b 5.23848112 _cell_length_c 8.59794296 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998688 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4AlFeRe6 _chemical_formula_sum 'Zr4 Al1 Fe1 Re6' _cell_volume 204.33182176 _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 Zr Zr0 1 0.33333300 0.66666700 0.43213264 1.0 Zr Zr1 1 0.66666700 0.33333300 0.93609042 1.0 Zr Zr2 1 0.66666700 0.33333300 0.56786736 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06390958 1.0 Al Al4 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe5 1 0.00000000 0.00000000 0.00000000 1.0 Re Re6 1 0.16957021 0.33913942 0.75310128 1.0 Re Re7 1 0.83042979 0.16957021 0.24689872 1.0 Re Re8 1 0.33913942 0.16957021 0.24689872 1.0 Re Re9 1 0.66086058 0.83042979 0.75310128 1.0 Re Re10 1 0.83042979 0.66086058 0.24689872 1.0 Re Re11 1 0.16957021 0.83042979 0.75310128 1.0