# generated using pymatgen data_MgTa3(SiRu3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.31868214 _cell_length_b 6.20875901 _cell_length_c 12.93101366 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.99994194 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTa3(SiRu3)2 _chemical_formula_sum 'Mg2 Ta6 Si4 Ru12' _cell_volume 346.72776105 _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 Mg Mg0 1 0.99999488 0.50000100 0.66595396 1.0 Mg Mg1 1 0.49999638 0.00000000 0.83405463 1.0 Ta Ta2 1 0.00000276 0.00000000 0.00123245 1.0 Ta Ta3 1 0.50000206 0.50000100 0.16774674 1.0 Ta Ta4 1 0.99999921 0.00000000 0.33225084 1.0 Ta Ta5 1 0.49999731 0.50000100 0.49876540 1.0 Ta Ta6 1 0.99999997 0.00000000 0.66669218 1.0 Ta Ta7 1 0.49999950 0.50000100 0.83331956 1.0 Si Si8 1 0.00000253 0.50000100 0.99944916 1.0 Si Si9 1 0.50000174 0.00000000 0.16674811 1.0 Si Si10 1 0.99999967 0.50000100 0.33325314 1.0 Si Si11 1 0.49999940 0.00000000 0.50054834 1.0 Ru Ru12 1 0.50000227 0.25236331 0.00645845 1.0 Ru Ru13 1 0.50000227 0.74763669 0.00645845 1.0 Ru Ru14 1 0.00000128 0.25088665 0.16864510 1.0 Ru Ru15 1 0.00000128 0.74911335 0.16864510 1.0 Ru Ru16 1 0.50000071 0.24911493 0.33137266 1.0 Ru Ru17 1 0.50000071 0.75088507 0.33137266 1.0 Ru Ru18 1 0.99999837 0.24759957 0.49353054 1.0 Ru Ru19 1 0.99999837 0.75240043 0.49353054 1.0 Ru Ru20 1 0.49999919 0.24604135 0.66159334 1.0 Ru Ru21 1 0.49999919 0.75395865 0.66159334 1.0 Ru Ru22 1 0.00000049 0.25393532 0.83839316 1.0 Ru Ru23 1 0.00000049 0.74606468 0.83839316 1.0