# generated using pymatgen data_TaTi6Tc12Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.39205389 _cell_length_b 6.21618167 _cell_length_c 13.17082129 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99970465 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi6Tc12Mo5 _chemical_formula_sum 'Ta1 Ti6 Tc12 Mo5' _cell_volume 359.58719309 _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 0.00000000 0.00000000 0.00000000 1.0 Ti Ti1 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti2 1 0.49994618 0.00000000 0.16722054 1.0 Ti Ti3 1 0.99994373 0.50000000 0.33328662 1.0 Ti Ti4 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti5 1 0.00005627 0.50000000 0.66671338 1.0 Ti Ti6 1 0.50005282 0.00000000 0.83277946 1.0 Tc Tc7 1 0.50000000 0.25360820 0.00000000 1.0 Tc Tc8 1 0.50000000 0.74639180 0.00000000 1.0 Tc Tc9 1 0.99994643 0.25137589 0.16901676 1.0 Tc Tc10 1 0.99994643 0.74862411 0.16901676 1.0 Tc Tc11 1 0.49994317 0.24989137 0.33423799 1.0 Tc Tc12 1 0.49994317 0.75010763 0.33423799 1.0 Tc Tc13 1 0.00000000 0.25022555 0.50000000 1.0 Tc Tc14 1 0.00000000 0.74977445 0.50000000 1.0 Tc Tc15 1 0.50005783 0.24989137 0.66576201 1.0 Tc Tc16 1 0.50005783 0.75010763 0.66576201 1.0 Tc Tc17 1 0.00005157 0.25137589 0.83098324 1.0 Tc Tc18 1 0.00005157 0.74862411 0.83098324 1.0 Mo Mo19 1 0.49994432 0.50000000 0.16702399 1.0 Mo Mo20 1 0.99994494 0.00000000 0.33392467 1.0 Mo Mo21 1 0.50000000 0.50000000 0.50000000 1.0 Mo Mo22 1 0.00005606 0.00000000 0.66607533 1.0 Mo Mo23 1 0.50005568 0.50000000 0.83297601 1.0