# generated using pymatgen data_TaTi6Re12Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.41417060 _cell_length_b 6.24933334 _cell_length_c 13.24005391 _cell_angle_alpha 90.00001273 _cell_angle_beta 90.00004886 _cell_angle_gamma 90.00000190 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi6Re12Mo5 _chemical_formula_sum 'Ta1 Ti6 Re12 Mo5' _cell_volume 365.23514232 _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 0.99999966 0.99999863 0.99999714 1.0 Ti Ti1 1 0.00000042 0.49999843 0.99999576 1.0 Ti Ti2 1 0.49996371 0.00000207 0.16708409 1.0 Ti Ti3 1 0.99995977 0.49999510 0.33347129 1.0 Ti Ti4 1 0.50000012 0.00000531 0.50000366 1.0 Ti Ti5 1 0.00003968 0.49999566 0.66653329 1.0 Ti Ti6 1 0.50003663 0.00000435 0.83291087 1.0 Re Re7 1 0.50000029 0.25373526 0.99999662 1.0 Re Re8 1 0.50000058 0.74626460 0.99999628 1.0 Re Re9 1 0.99996560 0.25148643 0.16898155 1.0 Re Re10 1 0.99996595 0.74851150 0.16898177 1.0 Re Re11 1 0.49996289 0.24997121 0.33411737 1.0 Re Re12 1 0.49996303 0.75002840 0.33411787 1.0 Re Re13 1 0.99999936 0.25031105 0.50000424 1.0 Re Re14 1 0.00000041 0.74968777 0.50000436 1.0 Re Re15 1 0.50003699 0.24997201 0.66588658 1.0 Re Re16 1 0.50003682 0.75002853 0.66588657 1.0 Re Re17 1 0.00003424 0.25148908 0.83101526 1.0 Re Re18 1 0.00003377 0.74851072 0.83101454 1.0 Mo Mo19 1 0.49996303 0.50000034 0.16718655 1.0 Mo Mo20 1 0.99996262 0.99999765 0.33375654 1.0 Mo Mo21 1 0.49999991 0.50000260 0.50000238 1.0 Mo Mo22 1 0.00003734 0.99999714 0.66624540 1.0 Mo Mo23 1 0.50003719 0.50000315 0.83281103 1.0