# generated using pymatgen data_MgTa3(TiOs3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.43141594 _cell_length_b 6.26260391 _cell_length_c 13.27034908 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00047454 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTa3(TiOs3)2 _chemical_formula_sum 'Mg2 Ta6 Ti4 Os12' _cell_volume 368.28141901 _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 0.00000570 0.49999900 0.00034955 1.0 Mg Mg1 1 0.49996123 0.00000000 0.16634773 1.0 Ta Ta2 1 0.00000504 0.00000000 0.00367167 1.0 Ta Ta3 1 0.49998144 0.49999900 0.16300714 1.0 Ta Ta4 1 0.99996391 0.00000000 0.33025777 1.0 Ta Ta5 1 0.49999598 0.49999900 0.50011646 1.0 Ta Ta6 1 0.00002877 0.00000000 0.66653606 1.0 Ta Ta7 1 0.50003682 0.49999900 0.83641169 1.0 Ti Ti8 1 0.99997354 0.49999900 0.33295162 1.0 Ti Ti9 1 0.49999700 0.00000000 0.50014602 1.0 Ti Ti10 1 0.00002334 0.49999900 0.66649538 1.0 Ti Ti11 1 0.50002776 0.00000000 0.83371277 1.0 Os Os12 1 0.50000630 0.24720563 0.99711621 1.0 Os Os13 1 0.50000630 0.75279437 0.99711621 1.0 Os Os14 1 0.99997624 0.25279284 0.16956198 1.0 Os Os15 1 0.99997624 0.74720716 0.16956198 1.0 Os Os16 1 0.49997257 0.25262578 0.33561055 1.0 Os Os17 1 0.49997257 0.74737422 0.33561055 1.0 Os Os18 1 0.99999583 0.25009459 0.49972378 1.0 Os Os19 1 0.99999583 0.74990541 0.49972378 1.0 Os Os20 1 0.50002266 0.24991964 0.66693414 1.0 Os Os21 1 0.50002266 0.75008036 0.66693414 1.0 Os Os22 1 0.00002814 0.24737345 0.83104992 1.0 Os Os23 1 0.00002814 0.75262655 0.83104992 1.0