# generated using pymatgen data_Ta(NiTe)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57647700 _cell_length_b 6.47133700 _cell_length_c 18.02380700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta(NiTe)2 _chemical_formula_sum 'Ta4 Ni8 Te8' _cell_volume 417.15358612 _cell_formula_units_Z 4 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 0.25000000 0.90578000 0.72484500 1.0 Ta Ta1 1 0.75000000 0.09422000 0.27515500 1.0 Ta Ta2 1 0.25000000 0.40578000 0.77515500 1.0 Ta Ta3 1 0.75000000 0.59422000 0.22484500 1.0 Ni Ni4 1 0.25000000 0.28871300 0.18556000 1.0 Ni Ni5 1 0.75000000 0.71128700 0.81444000 1.0 Ni Ni6 1 0.75000000 0.21128700 0.68556000 1.0 Ni Ni7 1 0.25000000 0.78871300 0.31444000 1.0 Ni Ni8 1 0.25000000 0.89787100 0.18680500 1.0 Ni Ni9 1 0.75000000 0.10212900 0.81319500 1.0 Ni Ni10 1 0.25000000 0.39787100 0.31319500 1.0 Ni Ni11 1 0.75000000 0.60212900 0.68680500 1.0 Te Te12 1 0.25000000 0.59434100 0.09782600 1.0 Te Te13 1 0.75000000 0.40565900 0.90217400 1.0 Te Te14 1 0.75000000 0.90565900 0.59782600 1.0 Te Te15 1 0.25000000 0.09434100 0.40217400 1.0 Te Te16 1 0.75000000 0.59159700 0.38835400 1.0 Te Te17 1 0.25000000 0.40840300 0.61164600 1.0 Te Te18 1 0.75000000 0.09159700 0.11164600 1.0 Te Te19 1 0.25000000 0.90840300 0.88835400 1.0