# generated using pymatgen data_Ta6Fe16Si7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.85343216 _cell_length_b 7.85343141 _cell_length_c 7.85342702 _cell_angle_alpha 60.00000694 _cell_angle_beta 60.00000223 _cell_angle_gamma 59.99999202 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Fe16Si7 _chemical_formula_sum 'Ta6 Fe16 Si7' _cell_volume 342.50204567 _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 0.20572180 0.79429835 0.20571539 1.0 Ta Ta1 1 0.20571687 0.79428879 0.79427050 1.0 Ta Ta2 1 0.79428784 0.20570736 0.20572429 1.0 Ta Ta3 1 0.79426687 0.79429371 0.20571288 1.0 Ta Ta4 1 0.20572880 0.20570578 0.79429059 1.0 Ta Ta5 1 0.79427705 0.20570305 0.79428622 1.0 Fe Fe6 1 0.17372936 0.17370683 0.17372095 1.0 Fe Fe7 1 0.52113776 0.82629765 0.82628524 1.0 Fe Fe8 1 0.82628583 0.52114364 0.82628834 1.0 Fe Fe9 1 0.82628279 0.82629826 0.52113902 1.0 Fe Fe10 1 0.17371824 0.47884443 0.17371012 1.0 Fe Fe11 1 0.17372236 0.17369907 0.47884561 1.0 Fe Fe12 1 0.47884421 0.17370295 0.17371746 1.0 Fe Fe13 1 0.82628249 0.82629749 0.82628490 1.0 Fe Fe14 1 0.37981869 0.37980583 0.37981364 1.0 Fe Fe15 1 0.13944369 0.62019484 0.62018481 1.0 Fe Fe16 1 0.62018887 0.13943487 0.62019248 1.0 Fe Fe17 1 0.62018279 0.62019675 0.13944233 1.0 Fe Fe18 1 0.37980962 0.86057509 0.37980472 1.0 Fe Fe19 1 0.37981421 0.37980131 0.86056891 1.0 Fe Fe20 1 0.86056602 0.37980421 0.37981174 1.0 Fe Fe21 1 0.62017836 0.62019254 0.62018178 1.0 Si Si22 1 0.49999954 0.49999902 0.49999997 1.0 Si Si23 1 -0.00000825 0.50000772 -0.00000610 1.0 Si Si24 1 0.50000660 -0.00000611 -0.00000756 1.0 Si Si25 1 -0.00000720 0.50000770 0.50000913 1.0 Si Si26 1 0.50000713 -0.00000519 0.50000929 1.0 Si Si27 1 -0.00000896 -0.00000539 0.50000806 1.0 Si Si28 1 0.50000760 0.50000845 -0.00000573 1.0