# generated using pymatgen data_Hf2Zr3Sn3As _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.64600502 _cell_length_b 8.64600530 _cell_length_c 5.89234933 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999895 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Zr3Sn3As _chemical_formula_sum 'Hf4 Zr6 Sn6 As2' _cell_volume 381.46096530 _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 Hf Hf0 1 0.66666700 0.33333300 0.00000000 1.0 Hf Hf1 1 0.33333300 0.66666700 0.00000000 1.0 Hf Hf2 1 0.33333300 0.66666700 0.50000000 1.0 Hf Hf3 1 0.66666700 0.33333300 0.50000000 1.0 Zr Zr4 1 0.73867551 0.73867551 0.75000000 1.0 Zr Zr5 1 0.26132449 0.00000000 0.75000000 1.0 Zr Zr6 1 0.00000000 0.26132449 0.75000000 1.0 Zr Zr7 1 0.26132449 0.26132449 0.25000000 1.0 Zr Zr8 1 0.73867551 0.00000000 0.25000000 1.0 Zr Zr9 1 1.00000000 0.73867551 0.25000000 1.0 Sn Sn10 1 0.39683206 0.39683206 0.75000000 1.0 Sn Sn11 1 0.60316794 0.00000000 0.75000000 1.0 Sn Sn12 1 0.00000000 0.60316794 0.75000000 1.0 Sn Sn13 1 0.60316794 0.60316794 0.25000000 1.0 Sn Sn14 1 0.39683206 0.00000000 0.25000000 1.0 Sn Sn15 1 1.00000000 0.39683206 0.25000000 1.0 As As16 1 0.00000000 0.00000000 0.00000000 1.0 As As17 1 0.00000000 0.00000000 0.50000000 1.0