# generated using pymatgen data_TmTa4(TiSn3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.72239792 _cell_length_b 5.72239905 _cell_length_c 9.60035813 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.18806497 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmTa4(TiSn3)2 _chemical_formula_sum 'Tm1 Ta4 Ti2 Sn6' _cell_volume 271.73658881 _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 Tm Tm0 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta1 1 0.00000000 0.50000000 0.75170245 1.0 Ta Ta2 1 0.50000000 0.00000000 0.24829755 1.0 Ta Ta3 1 0.00000000 0.50000000 0.24829755 1.0 Ta Ta4 1 0.50000000 0.00000000 0.75170245 1.0 Ti Ti5 1 0.50000000 0.50000000 0.24970302 1.0 Ti Ti6 1 0.50000000 0.50000000 0.75029698 1.0 Sn Sn7 1 0.66419347 0.33580653 0.50000000 1.0 Sn Sn8 1 0.00000000 0.00000000 0.32035602 1.0 Sn Sn9 1 0.00000000 0.00000000 0.67964398 1.0 Sn Sn10 1 0.33591626 0.66408374 0.00000000 1.0 Sn Sn11 1 0.66408374 0.33591626 0.00000000 1.0 Sn Sn12 1 0.33580653 0.66419347 0.50000000 1.0