# generated using pymatgen data_Ta4Fe5Te12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65426600 _cell_length_b 7.59692000 _cell_length_c 19.09177215 _cell_angle_alpha 88.20148042 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta4Fe5Te12 _chemical_formula_sum 'Ta4 Fe5 Te12' _cell_volume 529.74876675 _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 Ta Ta0 1 0.50000000 0.18027400 0.64733600 1.0 Ta Ta1 1 0.50000000 0.68041800 0.14784400 1.0 Ta Ta2 1 0.00000000 0.31607200 0.85203800 1.0 Ta Ta3 1 0.00000000 0.81874100 0.35204500 1.0 Fe Fe4 1 0.00000000 0.06796800 0.54408400 1.0 Fe Fe5 1 0.00000000 0.56874900 0.04183700 1.0 Fe Fe6 1 0.50000000 0.43135400 0.95863200 1.0 Fe Fe7 1 0.50000000 0.93193600 0.45574700 1.0 Fe Fe8 1 0.50000000 0.75602900 0.00024800 1.0 Te Te9 1 0.00000000 0.39627700 0.57820200 1.0 Te Te10 1 0.00000000 0.91698200 0.08391000 1.0 Te Te11 1 0.50000000 0.10183800 0.92249300 1.0 Te Te12 1 0.50000000 0.60404300 0.42163500 1.0 Te Te13 1 0.50000000 0.84877100 0.58907700 1.0 Te Te14 1 0.50000000 0.34685300 0.09208300 1.0 Te Te15 1 0.00000000 0.65556000 0.90066400 1.0 Te Te16 1 0.00000000 0.15048900 0.41065900 1.0 Te Te17 1 0.50000000 0.46071800 0.74856000 1.0 Te Te18 1 0.50000000 0.96374900 0.24954100 1.0 Te Te19 1 0.00000000 0.03799700 0.75047000 1.0 Te Te20 1 0.00000000 0.53613300 0.25054400 1.0