# generated using pymatgen data_Ba2Ca2Tl2W3O10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.03864400 _cell_length_b 4.18094451 _cell_length_c 19.89459269 _cell_angle_alpha 95.65528471 _cell_angle_beta 94.94536007 _cell_angle_gamma 90.15095004 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Ca2Tl2W3O10 _chemical_formula_sum 'Ba2 Ca2 Tl2 W3 O10' _cell_volume 333.02662440 _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 Ba Ba0 1 0.85684800 0.77245200 0.68199900 1.0 Ba Ba1 1 0.14735600 0.07835300 0.32058600 1.0 Ca Ca2 1 0.04071600 0.97837400 0.09554400 1.0 Ca Ca3 1 0.96448800 0.89275200 0.90516000 1.0 Tl Tl4 1 0.27501800 0.24052100 0.55582500 1.0 Tl Tl5 1 0.72006700 0.68803000 0.44586400 1.0 W W6 1 0.57631400 0.51556700 0.17820300 1.0 W W7 1 0.43038600 0.35063000 0.82275900 1.0 W W8 1 0.50309100 0.43420700 0.00000300 1.0 O O9 1 0.06672000 0.50559300 0.15580900 1.0 O O10 1 0.61721600 0.54691700 0.27629400 1.0 O O11 1 0.56780900 0.00600700 0.16067000 1.0 O O12 1 0.22288100 0.28959900 0.43695000 1.0 O O13 1 0.50332000 0.93422500 0.99999200 1.0 O O14 1 0.43737300 0.85710100 0.83968200 1.0 O O15 1 0.39174300 0.28284600 0.72464900 1.0 O O16 1 0.93875700 0.36332900 0.84454500 1.0 O O17 1 0.76368500 0.84047300 0.56442000 1.0 O O18 1 0.00321200 0.43314800 0.00008000 1.0