# generated using pymatgen data_MgTa(TiPd6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.55088041 _cell_length_b 5.55088046 _cell_length_c 8.99944232 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000549 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTa(TiPd6)2 _chemical_formula_sum 'Mg1 Ta1 Ti2 Pd12' _cell_volume 240.14301088 _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 Mg Mg0 1 0.33333300 0.66666700 0.25000000 1.0 Ta Ta1 1 0.66666700 0.33333300 0.75000000 1.0 Ti Ti2 1 0.00000000 0.00000000 0.49283836 1.0 Ti Ti3 1 0.00000000 0.00000000 0.00716164 1.0 Pd Pd4 1 0.50158960 0.49841040 0.50382823 1.0 Pd Pd5 1 0.50158960 0.00317721 0.50382823 1.0 Pd Pd6 1 0.99682279 0.49841040 0.50382823 1.0 Pd Pd7 1 0.50158960 0.49841040 0.99617177 1.0 Pd Pd8 1 0.50158960 0.00317721 0.99617177 1.0 Pd Pd9 1 0.99682279 0.49841040 0.99617177 1.0 Pd Pd10 1 0.83299388 0.66598875 0.25000000 1.0 Pd Pd11 1 0.33401125 0.16700612 0.25000000 1.0 Pd Pd12 1 0.83299388 0.16700612 0.25000000 1.0 Pd Pd13 1 0.16566116 0.33132133 0.75000000 1.0 Pd Pd14 1 0.66867867 0.83433884 0.75000000 1.0 Pd Pd15 1 0.16566116 0.83433884 0.75000000 1.0