# generated using pymatgen data_Ta6Tc5B6Pt _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.17184214 _cell_length_b 9.02441132 _cell_length_c 15.60193203 _cell_angle_alpha 89.54353910 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Tc5B6Pt _chemical_formula_sum 'Ta12 Tc10 B12 Pt2' _cell_volume 446.57565687 _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 Ta Ta0 1 0.00000000 0.80419107 0.49444239 1.0 Ta Ta1 1 0.00000000 0.19580893 0.50555761 1.0 Ta Ta2 1 0.00000000 0.30501832 0.00788198 1.0 Ta Ta3 1 0.00000000 0.69498168 0.99211802 1.0 Ta Ta4 1 0.00000000 0.51498094 0.59531953 1.0 Ta Ta5 1 0.00000000 0.48501906 0.40468047 1.0 Ta Ta6 1 0.00000000 0.01589839 0.90656631 1.0 Ta Ta7 1 0.00000000 0.98410161 0.09343369 1.0 Ta Ta8 1 0.00000000 0.67254319 0.20593049 1.0 Ta Ta9 1 0.00000000 0.32745681 0.79406951 1.0 Ta Ta10 1 0.00000000 0.18891986 0.29632441 1.0 Ta Ta11 1 0.00000000 0.81108014 0.70367559 1.0 Tc Tc12 1 0.50000000 0.71976725 0.35718061 1.0 Tc Tc13 1 0.50000000 0.28023275 0.64281939 1.0 Tc Tc14 1 0.50000000 0.21365496 0.14316992 1.0 Tc Tc15 1 0.50000000 0.78634504 0.85683008 1.0 Tc Tc16 1 0.50000000 0.51869531 0.09538565 1.0 Tc Tc17 1 0.50000000 0.48130469 0.90461435 1.0 Tc Tc18 1 0.50000000 0.01938411 0.40366036 1.0 Tc Tc19 1 0.50000000 0.98061589 0.59633964 1.0 Tc Tc20 1 0.50000000 0.56870457 0.73202750 1.0 Tc Tc21 1 0.50000000 0.43129543 0.26797250 1.0 B B22 1 0.50000000 0.60584501 0.49446462 1.0 B B23 1 0.50000000 0.39415499 0.50553538 1.0 B B24 1 0.50000000 0.10531568 0.00422744 1.0 B B25 1 0.50000000 0.89468432 0.99577256 1.0 B B26 1 0.00000000 0.61172277 0.83259883 1.0 B B27 1 0.00000000 0.38827723 0.16740117 1.0 B B28 1 0.00000000 0.11267811 0.66095452 1.0 B B29 1 0.00000000 0.88732189 0.33904548 1.0 B B30 1 0.50000000 0.71470437 0.60070491 1.0 B B31 1 0.50000000 0.28529563 0.39929509 1.0 B B32 1 0.50000000 0.21905725 0.90158170 1.0 B B33 1 0.50000000 0.78094275 0.09841830 1.0 Pt Pt34 1 0.50000000 0.06706676 0.76716643 1.0 Pt Pt35 1 0.50000000 0.93293324 0.23283357 1.0