# generated using pymatgen data_Zr9FeRe3W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.69388667 _cell_length_b 8.69388723 _cell_length_c 8.45851584 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000165 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr9FeRe3W _chemical_formula_sum 'Zr18 Fe2 Re6 W2' _cell_volume 553.67226481 _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 0.20081489 0.79918511 0.44087263 1.0 Zr Zr1 1 0.20081489 0.40163078 0.44087263 1.0 Zr Zr2 1 0.59836922 0.79918511 0.44087263 1.0 Zr Zr3 1 0.79918511 0.20081489 0.55912737 1.0 Zr Zr4 1 0.79918511 0.59836922 0.55912737 1.0 Zr Zr5 1 0.40163078 0.20081489 0.55912737 1.0 Zr Zr6 1 0.79918511 0.20081489 0.94087263 1.0 Zr Zr7 1 0.79918511 0.59836922 0.94087263 1.0 Zr Zr8 1 0.40163078 0.20081489 0.94087263 1.0 Zr Zr9 1 0.20081489 0.79918511 0.05912737 1.0 Zr Zr10 1 0.20081489 0.40163078 0.05912737 1.0 Zr Zr11 1 0.59836922 0.79918511 0.05912737 1.0 Zr Zr12 1 0.54136834 0.45863166 0.25000000 1.0 Zr Zr13 1 0.54136834 0.08273868 0.25000000 1.0 Zr Zr14 1 0.91726132 0.45863166 0.25000000 1.0 Zr Zr15 1 0.45863166 0.54136834 0.75000000 1.0 Zr Zr16 1 0.45863166 0.91726132 0.75000000 1.0 Zr Zr17 1 0.08273868 0.54136834 0.75000000 1.0 Fe Fe18 1 0.33333300 0.66666700 0.25000000 1.0 Fe Fe19 1 0.66666700 0.33333300 0.75000000 1.0 Re Re20 1 0.89030624 0.10969376 0.25000000 1.0 Re Re21 1 0.89030624 0.78061349 0.25000000 1.0 Re Re22 1 0.21938651 0.10969376 0.25000000 1.0 Re Re23 1 0.10969376 0.89030624 0.75000000 1.0 Re Re24 1 0.10969376 0.21938651 0.75000000 1.0 Re Re25 1 0.78061349 0.89030624 0.75000000 1.0 W W26 1 0.00000000 0.00000000 0.50000000 1.0 W W27 1 0.00000000 0.00000000 0.00000000 1.0