# generated using pymatgen data_Ta6Tc5B6Os _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.14810605 _cell_length_b 9.01399539 _cell_length_c 15.64940262 _cell_angle_alpha 89.93965864 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta6Tc5B6Os _chemical_formula_sum 'Ta12 Tc10 B12 Os2' _cell_volume 444.08306133 _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 0.80641993 0.49367484 1.0 Ta Ta1 1 0.00000000 0.19358007 0.50632516 1.0 Ta Ta2 1 0.00000000 0.30633764 0.00663948 1.0 Ta Ta3 1 0.00000000 0.69366236 0.99336052 1.0 Ta Ta4 1 0.00000000 0.51681976 0.59573550 1.0 Ta Ta5 1 0.00000000 0.48318024 0.40426450 1.0 Ta Ta6 1 0.00000000 0.01664506 0.90469559 1.0 Ta Ta7 1 0.00000000 0.98335494 0.09530441 1.0 Ta Ta8 1 0.00000000 0.67670585 0.20675861 1.0 Ta Ta9 1 0.00000000 0.32329415 0.79324139 1.0 Ta Ta10 1 0.00000000 0.18106420 0.29337483 1.0 Ta Ta11 1 0.00000000 0.81893580 0.70662517 1.0 Tc Tc12 1 0.50000000 0.71706237 0.35839389 1.0 Tc Tc13 1 0.50000000 0.28293763 0.64160611 1.0 Tc Tc14 1 0.50000000 0.21547417 0.14166209 1.0 Tc Tc15 1 0.50000000 0.78452583 0.85833791 1.0 Tc Tc16 1 0.50000000 0.51824708 0.09502239 1.0 Tc Tc17 1 0.50000000 0.48175292 0.90497761 1.0 Tc Tc18 1 0.50000000 0.01837055 0.40473688 1.0 Tc Tc19 1 0.50000000 0.98162945 0.59526312 1.0 Tc Tc20 1 0.50000000 0.56932803 0.73239991 1.0 Tc Tc21 1 0.50000000 0.43067197 0.26760009 1.0 B B22 1 0.50000000 0.60484038 0.49385626 1.0 B B23 1 0.50000000 0.39515962 0.50614374 1.0 B B24 1 0.50000000 0.10488288 0.00552362 1.0 B B25 1 0.50000000 0.89511712 0.99447638 1.0 B B26 1 0.00000000 0.61089288 0.83257601 1.0 B B27 1 0.00000000 0.38910712 0.16742399 1.0 B B28 1 0.00000000 0.11112276 0.66605668 1.0 B B29 1 0.00000000 0.88887724 0.33394332 1.0 B B30 1 0.50000000 0.71747011 0.60277925 1.0 B B31 1 0.50000000 0.28252989 0.39722075 1.0 B B32 1 0.50000000 0.21832400 0.89779030 1.0 B B33 1 0.50000000 0.78167600 0.10220970 1.0 Os Os34 1 0.50000000 0.06997473 0.76747671 1.0 Os Os35 1 0.50000000 0.93002527 0.23252329 1.0