# generated using pymatgen data_Tm6Al7Pd16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.86484670 _cell_length_b 8.86484766 _cell_length_c 8.86484670 _cell_angle_alpha 120.00000004 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000004 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm6Al7Pd16 _chemical_formula_sum 'Tm6 Al7 Pd16' _cell_volume 492.60491139 _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 0.28716405 1.00000000 0.28716405 1.0 Tm Tm1 1 0.28716405 0.57432811 0.28716405 1.0 Tm Tm2 1 0.71283695 0.00000000 0.28716505 1.0 Tm Tm3 1 0.71283595 0.00000000 0.71283595 1.0 Tm Tm4 1 0.28716505 0.00000000 0.71283695 1.0 Tm Tm5 1 0.71283695 0.42567189 0.71283695 1.0 Al Al6 1 0.00000000 0.00000000 0.00000000 1.0 Al Al7 1 0.50000100 0.00000000 0.00000000 1.0 Al Al8 1 0.00000000 0.50000100 0.00000000 1.0 Al Al9 1 0.50000100 0.50000100 0.00000000 1.0 Al Al10 1 0.00000000 0.00000000 0.50000100 1.0 Al Al11 1 0.00000000 0.50000100 0.50000100 1.0 Al Al12 1 0.50000100 0.50000100 0.50000100 1.0 Pd Pd13 1 0.66391362 0.32782823 0.99174185 1.0 Pd Pd14 1 0.35675503 0.23783702 0.11891801 1.0 Pd Pd15 1 0.88108199 0.23783702 0.11891801 1.0 Pd Pd16 1 0.88108199 0.76216298 0.11891801 1.0 Pd Pd17 1 0.66391362 0.32782823 0.33608638 1.0 Pd Pd18 1 0.66391362 0.67217177 0.33608638 1.0 Pd Pd19 1 0.00825815 0.67217177 0.33608638 1.0 Pd Pd20 1 0.11891801 0.23783702 0.35675503 1.0 Pd Pd21 1 0.88108199 0.76216298 0.64324497 1.0 Pd Pd22 1 0.99174185 0.32782823 0.66391362 1.0 Pd Pd23 1 0.33608638 0.32782823 0.66391362 1.0 Pd Pd24 1 0.33608638 0.67217177 0.66391362 1.0 Pd Pd25 1 0.11891801 0.23783702 0.88108199 1.0 Pd Pd26 1 0.11891801 0.76216298 0.88108199 1.0 Pd Pd27 1 0.64324497 0.76216298 0.88108199 1.0 Pd Pd28 1 0.33608638 0.67217177 0.00825815 1.0