# generated using pymatgen data_Hf8FeTe6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74979621 _cell_length_b 7.66288632 _cell_length_c 25.92636152 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8FeTe6 _chemical_formula_sum 'Hf16 Fe2 Te12' _cell_volume 744.97486671 _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 0.50000000 0.74090391 0.43361019 1.0 Hf Hf1 1 -0.00000000 0.25909609 0.06638981 1.0 Hf Hf2 1 0.50000000 0.07364564 0.50000000 1.0 Hf Hf3 1 0.00000000 0.05755702 0.80189543 1.0 Hf Hf4 1 0.00000000 0.25909609 0.93361019 1.0 Hf Hf5 1 0.50000000 0.94244298 0.69810457 1.0 Hf Hf6 1 0.50000000 0.94074192 0.90148951 1.0 Hf Hf7 1 0.00000000 0.05925808 0.59851049 1.0 Hf Hf8 1 0.00000000 0.05925808 0.40148951 1.0 Hf Hf9 1 0.50000000 0.94244298 0.30189543 1.0 Hf Hf10 1 0.00000000 0.45480691 0.50000000 1.0 Hf Hf11 1 0.00000000 0.92635436 0.00000000 1.0 Hf Hf12 1 0.50000000 0.54519309 0.00000000 1.0 Hf Hf13 1 -0.00000000 0.05755702 0.19810457 1.0 Hf Hf14 1 0.50000000 0.94074192 0.09851049 1.0 Hf Hf15 1 0.50000000 0.74090391 0.56638981 1.0 Fe Fe16 1 0.00000000 0.79740381 0.50000000 1.0 Fe Fe17 1 0.50000000 0.20259619 0.00000000 1.0 Te Te18 1 0.00000000 0.70457859 0.34460689 1.0 Te Te19 1 -0.00000000 0.64748436 0.08146820 1.0 Te Te20 1 0.50000000 0.35251564 0.41853180 1.0 Te Te21 1 0.00000000 0.64748436 0.91853180 1.0 Te Te22 1 0.50000000 0.29542141 0.15539311 1.0 Te Te23 1 0.50000000 0.29542141 0.84460689 1.0 Te Te24 1 0.50000000 0.77943321 0.20243612 1.0 Te Te25 1 -0.00000000 0.22056679 0.70243612 1.0 Te Te26 1 0.00000000 0.22056679 0.29756388 1.0 Te Te27 1 0.50000000 0.35251564 0.58146820 1.0 Te Te28 1 0.50000000 0.77943321 0.79756388 1.0 Te Te29 1 -0.00000000 0.70457859 0.65539311 1.0