# generated using pymatgen data_Tc6BiO18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.23939826 _cell_length_b 7.23939826 _cell_length_c 16.17961670 _cell_angle_alpha 77.13625307 _cell_angle_beta 77.13625307 _cell_angle_gamma 89.94441701 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tc6BiO18 _chemical_formula_sum 'Tc12 Bi2 O36' _cell_volume 804.87214591 _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 Tc Tc0 1 0.00000000 0.50000000 0.00000000 1.0 Tc Tc1 1 0.50000000 0.50000000 0.00000000 1.0 Tc Tc2 1 0.16356900 0.16544700 0.66780700 1.0 Tc Tc3 1 0.83499100 0.33453100 0.83365200 1.0 Tc Tc4 1 0.83643100 0.83455300 0.33219300 1.0 Tc Tc5 1 0.66547000 0.16500900 0.66634800 1.0 Tc Tc6 1 0.50000000 0.50000000 0.50000000 1.0 Tc Tc7 1 0.50000000 0.00000000 0.50000000 1.0 Tc Tc8 1 0.33453100 0.83499100 0.33365200 1.0 Tc Tc9 1 0.16544700 0.16356900 0.16780700 1.0 Tc Tc10 1 0.16500900 0.66547000 0.16634800 1.0 Tc Tc11 1 0.83455300 0.83643100 0.83219300 1.0 Bi Bi12 1 0.00000000 0.50000000 0.50000000 1.0 Bi Bi13 1 0.50000000 0.00000000 0.00000000 1.0 O O14 1 0.70107800 0.29892200 0.75000000 1.0 O O15 1 0.24968100 0.41162300 0.57899900 1.0 O O16 1 0.35271100 0.97430900 0.41829500 1.0 O O17 1 0.05290500 0.30287800 0.74900900 1.0 O O18 1 0.15434200 0.40050000 0.19866200 1.0 O O19 1 0.94760300 0.20122500 0.60667100 1.0 O O20 1 0.94599900 0.05400100 0.25000000 1.0 O O21 1 0.02655800 0.27834900 0.08077000 1.0 O O22 1 0.02569100 0.64728900 0.08170500 1.0 O O23 1 0.72165100 0.97344200 0.41923000 1.0 O O24 1 0.67170300 0.41226500 0.58069000 1.0 O O25 1 0.52049600 0.27621500 0.46250500 1.0 O O26 1 0.59950000 0.84565800 0.30133800 1.0 O O27 1 0.72378500 0.47950400 0.03749500 1.0 O O28 1 0.79877500 0.05239700 0.89332900 1.0 O O29 1 0.58773500 0.32829700 0.91931000 1.0 O O30 1 0.58837700 0.75031900 0.92100100 1.0 O O31 1 0.69712200 0.94709500 0.75099100 1.0 O O32 1 0.41226500 0.67170300 0.08069000 1.0 O O33 1 0.30287800 0.05290500 0.24900900 1.0 O O34 1 0.41162300 0.24968100 0.07899900 1.0 O O35 1 0.20122500 0.94760300 0.10667100 1.0 O O36 1 0.40050000 0.15434200 0.69866200 1.0 O O37 1 0.47950400 0.72378500 0.53749500 1.0 O O38 1 0.27621500 0.52049600 0.96250500 1.0 O O39 1 0.27834900 0.02655800 0.58077000 1.0 O O40 1 0.32829700 0.58773500 0.41931000 1.0 O O41 1 0.05400100 0.94599900 0.75000000 1.0 O O42 1 0.97430900 0.35271100 0.91829500 1.0 O O43 1 0.97344200 0.72165100 0.91923000 1.0 O O44 1 0.84565800 0.59950000 0.80133800 1.0 O O45 1 0.05239700 0.79877500 0.39332900 1.0 O O46 1 0.94709500 0.69712200 0.25099100 1.0 O O47 1 0.75031900 0.58837700 0.42100100 1.0 O O48 1 0.64728900 0.02569100 0.58170500 1.0 O O49 1 0.29892200 0.70107800 0.25000000 1.0