# generated using pymatgen data_Tl3(MoO3)10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.40179878 _cell_length_b 10.40179878 _cell_length_c 10.45588354 _cell_angle_alpha 62.20921978 _cell_angle_beta 62.20921978 _cell_angle_gamma 43.41316881 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tl3(MoO3)10 _chemical_formula_sum 'Tl3 Mo10 O30' _cell_volume 672.50373145 _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 Tl Tl0 1 0.18848200 0.18848200 0.25932700 1.0 Tl Tl1 1 0.81151800 0.81151800 0.74067300 1.0 Tl Tl2 1 0.50000000 0.50000000 0.50000000 1.0 Mo Mo3 1 0.66813900 0.17953100 0.95965100 1.0 Mo Mo4 1 0.10926400 0.60987800 0.34298400 1.0 Mo Mo5 1 0.60987800 0.10926400 0.34298400 1.0 Mo Mo6 1 0.33186100 0.82046900 0.04034900 1.0 Mo Mo7 1 0.22163700 0.22163700 0.82813300 1.0 Mo Mo8 1 0.89073600 0.39012200 0.65701600 1.0 Mo Mo9 1 0.39012200 0.89073600 0.65701600 1.0 Mo Mo10 1 0.82046900 0.33186100 0.04034900 1.0 Mo Mo11 1 0.17953100 0.66813900 0.95965100 1.0 Mo Mo12 1 0.77836300 0.77836300 0.17186700 1.0 O O13 1 0.84307800 0.84307800 0.30908000 1.0 O O14 1 0.83878900 0.35212400 0.18460700 1.0 O O15 1 0.42351700 0.42351700 0.98736300 1.0 O O16 1 0.12941100 0.68611200 0.44185600 1.0 O O17 1 0.08714100 0.08714100 0.00597200 1.0 O O18 1 0.24441700 0.24441700 0.97013100 1.0 O O19 1 0.87058900 0.31388800 0.55814400 1.0 O O20 1 0.35689900 0.35689900 0.32767000 1.0 O O21 1 0.28582100 0.79610900 0.85578900 1.0 O O22 1 0.79610900 0.28582100 0.85578900 1.0 O O23 1 0.15692200 0.15692200 0.69092000 1.0 O O24 1 0.68611200 0.12941100 0.44185600 1.0 O O25 1 0.31388800 0.87058900 0.55814400 1.0 O O26 1 0.71417900 0.20389100 0.14421100 1.0 O O27 1 0.20389100 0.71417900 0.14421100 1.0 O O28 1 0.64310100 0.64310100 0.67233000 1.0 O O29 1 0.42616800 0.94121900 0.84087100 1.0 O O30 1 0.57383200 0.05878100 0.15912900 1.0 O O31 1 0.57648300 0.57648300 0.01263700 1.0 O O32 1 0.91285900 0.91285900 0.99402800 1.0 O O33 1 0.31424800 0.31424800 0.66778600 1.0 O O34 1 0.68575200 0.68575200 0.33221400 1.0 O O35 1 0.75558300 0.75558300 0.02986900 1.0 O O36 1 0.64787600 0.16121100 0.81539300 1.0 O O37 1 0.94121900 0.42616800 0.84087100 1.0 O O38 1 0.16121100 0.64787600 0.81539300 1.0 O O39 1 0.50000000 0.00000000 0.50000000 1.0 O O40 1 0.35212400 0.83878900 0.18460700 1.0 O O41 1 0.05878100 0.57383200 0.15912900 1.0 O O42 1 0.00000000 0.50000000 0.50000000 1.0