# generated using pymatgen data_SmTa5TiSn6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.74476642 _cell_length_b 5.75704208 _cell_length_c 9.61285081 _cell_angle_alpha 89.99994539 _cell_angle_beta 90.00009960 _cell_angle_gamma 119.92948389 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmTa5TiSn6 _chemical_formula_sum 'Sm1 Ta5 Ti1 Sn6' _cell_volume 275.52611596 _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 Sm Sm0 1 0.99998695 0.00000000 0.99876844 1.0 Ta Ta1 1 0.49997600 0.49999988 0.25018918 1.0 Ta Ta2 1 0.99997712 0.50000012 0.25018918 1.0 Ta Ta3 1 0.49998794 0.00000000 0.74985664 1.0 Ta Ta4 1 0.49998656 0.50000128 0.75074035 1.0 Ta Ta5 1 0.99998628 0.49999872 0.75074035 1.0 Ti Ti6 1 0.49998088 1.00000000 0.24960300 1.0 Sn Sn7 1 0.33441726 0.66886483 0.00146806 1.0 Sn Sn8 1 0.66555343 0.33113517 0.00146806 1.0 Sn Sn9 1 0.33434832 0.66872627 0.49967025 1.0 Sn Sn10 1 0.66562305 0.33127373 0.49967025 1.0 Sn Sn11 1 0.99998263 0.00000000 0.32644265 1.0 Sn Sn12 1 0.99999057 1.00000000 0.67119558 1.0