# generated using pymatgen data_Ta11(CoSe4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.43777800 _cell_length_b 12.19471300 _cell_length_c 19.64119500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta11(CoSe4)2 _chemical_formula_sum 'Ta22 Co4 Se16' _cell_volume 823.41224122 _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 0.50000000 0.82005200 0.05338800 1.0 Ta Ta1 1 0.50000000 0.17994800 0.94661200 1.0 Ta Ta2 1 0.00000000 0.67994800 0.55338800 1.0 Ta Ta3 1 0.00000000 0.32005200 0.44661200 1.0 Ta Ta4 1 0.50000000 0.44614300 0.74228500 1.0 Ta Ta5 1 0.50000000 0.55385700 0.25771500 1.0 Ta Ta6 1 0.00000000 0.94614300 0.75771500 1.0 Ta Ta7 1 0.00000000 0.05385700 0.24228500 1.0 Ta Ta8 1 0.50000000 0.06070600 0.11579200 1.0 Ta Ta9 1 0.50000000 0.93929400 0.88420800 1.0 Ta Ta10 1 0.00000000 0.56070600 0.38420800 1.0 Ta Ta11 1 0.00000000 0.43929400 0.61579200 1.0 Ta Ta12 1 0.50000000 0.17403600 0.35317600 1.0 Ta Ta13 1 0.50000000 0.82596400 0.64682400 1.0 Ta Ta14 1 0.00000000 0.67403600 0.14682400 1.0 Ta Ta15 1 0.00000000 0.32596400 0.85317600 1.0 Ta Ta16 1 0.50000000 0.15259500 0.78840900 1.0 Ta Ta17 1 0.50000000 0.84740500 0.21159100 1.0 Ta Ta18 1 0.00000000 0.65259500 0.71159100 1.0 Ta Ta19 1 0.00000000 0.34740500 0.28840900 1.0 Ta Ta20 1 0.50000000 0.50000000 0.50000000 1.0 Ta Ta21 1 0.00000000 0.00000000 0.00000000 1.0 Co Co22 1 0.00000000 0.09342100 0.87158300 1.0 Co Co23 1 0.00000000 0.90657900 0.12841700 1.0 Co Co24 1 0.50000000 0.59342100 0.62841700 1.0 Co Co25 1 0.50000000 0.40657900 0.37158300 1.0 Se Se26 1 0.50000000 0.29560700 0.55475600 1.0 Se Se27 1 0.50000000 0.70439300 0.44524400 1.0 Se Se28 1 0.00000000 0.79560700 0.94524400 1.0 Se Se29 1 0.00000000 0.20439300 0.05475600 1.0 Se Se30 1 0.50000000 0.04032300 0.67438400 1.0 Se Se31 1 0.50000000 0.95967700 0.32561600 1.0 Se Se32 1 0.00000000 0.54032300 0.82561600 1.0 Se Se33 1 0.00000000 0.45967700 0.17438400 1.0 Se Se34 1 0.50000000 0.39005300 0.94574000 1.0 Se Se35 1 0.50000000 0.60994700 0.05426000 1.0 Se Se36 1 0.00000000 0.89005300 0.55426000 1.0 Se Se37 1 0.00000000 0.10994700 0.44574000 1.0 Se Se38 1 0.00000000 0.28372300 0.71429900 1.0 Se Se39 1 0.00000000 0.71627700 0.28570100 1.0 Se Se40 1 0.50000000 0.78372300 0.78570100 1.0 Se Se41 1 0.50000000 0.21627700 0.21429900 1.0