# generated using pymatgen data_Nd2Tl(MoO4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.92141226 _cell_length_b 6.92141226 _cell_length_c 19.84510769 _cell_angle_alpha 88.94784148 _cell_angle_beta 88.94784148 _cell_angle_gamma 133.79000894 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Tl(MoO4)4 _chemical_formula_sum 'Nd4 Tl2 Mo8 O32' _cell_volume 685.53946053 _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 Nd Nd0 1 0.85381700 0.14865100 0.46674400 1.0 Nd Nd1 1 0.85134900 0.14618300 0.03325600 1.0 Nd Nd2 1 0.14865100 0.85381700 0.96674400 1.0 Nd Nd3 1 0.14618300 0.85134900 0.53325600 1.0 Tl Tl4 1 0.97498500 0.02501500 0.25000000 1.0 Tl Tl5 1 0.02501500 0.97498500 0.75000000 1.0 Mo Mo6 1 0.57228200 0.45298600 0.40787000 1.0 Mo Mo7 1 0.27341800 0.75519500 0.34806100 1.0 Mo Mo8 1 0.24480500 0.72658200 0.15193900 1.0 Mo Mo9 1 0.54701400 0.42771800 0.09213000 1.0 Mo Mo10 1 0.45298600 0.57228200 0.90787000 1.0 Mo Mo11 1 0.75519500 0.27341800 0.84806100 1.0 Mo Mo12 1 0.72658200 0.24480500 0.65193900 1.0 Mo Mo13 1 0.42771800 0.54701400 0.59213000 1.0 O O14 1 0.53284900 0.91424500 0.28492800 1.0 O O15 1 0.68026200 0.77420700 0.39692900 1.0 O O16 1 0.59127600 0.89642100 0.13567200 1.0 O O17 1 0.40870900 0.92765000 0.42959500 1.0 O O18 1 0.77332800 0.73783000 0.03741800 1.0 O O19 1 0.82587200 0.48669500 0.45414000 1.0 O O20 1 0.91424500 0.53284900 0.78492800 1.0 O O21 1 0.77420700 0.68026200 0.89692900 1.0 O O22 1 0.89642100 0.59127600 0.63567200 1.0 O O23 1 0.92765000 0.40870900 0.92959500 1.0 O O24 1 0.73783000 0.77332800 0.53741800 1.0 O O25 1 0.24059600 0.97149000 0.17580500 1.0 O O26 1 0.48669500 0.82587200 0.95414000 1.0 O O27 1 0.69360800 0.51459700 0.16979400 1.0 O O28 1 0.97149000 0.24059600 0.67580500 1.0 O O29 1 0.51459700 0.69360800 0.66979400 1.0 O O30 1 0.48540300 0.30639200 0.33020600 1.0 O O31 1 0.02851000 0.75940400 0.32419500 1.0 O O32 1 0.30639200 0.48540300 0.83020600 1.0 O O33 1 0.51330500 0.17412800 0.04586000 1.0 O O34 1 0.75940400 0.02851000 0.82419500 1.0 O O35 1 0.26217000 0.22667200 0.46258200 1.0 O O36 1 0.07235000 0.59129100 0.07040500 1.0 O O37 1 0.10357900 0.40872400 0.36432800 1.0 O O38 1 0.22579300 0.31973800 0.10307100 1.0 O O39 1 0.08575500 0.46715100 0.21507200 1.0 O O40 1 0.17412800 0.51330500 0.54586000 1.0 O O41 1 0.22667200 0.26217000 0.96258200 1.0 O O42 1 0.59129100 0.07235000 0.57040500 1.0 O O43 1 0.40872400 0.10357900 0.86432800 1.0 O O44 1 0.31973800 0.22579300 0.60307100 1.0 O O45 1 0.46715100 0.08575500 0.71507200 1.0