# generated using pymatgen data_Tm6Zn23C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.79227523 _cell_length_b 8.79227485 _cell_length_c 8.79227493 _cell_angle_alpha 59.99999969 _cell_angle_beta 60.00000112 _cell_angle_gamma 60.00000138 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm6Zn23C _chemical_formula_sum 'Tm6 Zn23 C1' _cell_volume 480.60556937 _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 0.69456610 0.30543390 0.30543390 1.0 Tm Tm1 1 0.69456610 0.30543390 0.69456610 1.0 Tm Tm2 1 0.69456610 0.69456610 0.30543390 1.0 Tm Tm3 1 0.30543390 0.69456610 0.69456610 1.0 Tm Tm4 1 0.30543390 0.69456610 0.30543390 1.0 Tm Tm5 1 0.30543390 0.30543390 0.69456610 1.0 Zn Zn6 1 0.63331049 0.12223084 0.12223084 1.0 Zn Zn7 1 0.12223084 0.63331049 0.12223084 1.0 Zn Zn8 1 0.12223084 0.12223084 0.63331049 1.0 Zn Zn9 1 0.12223084 0.12223084 0.12223084 1.0 Zn Zn10 1 0.36668951 0.87776916 0.87776916 1.0 Zn Zn11 1 0.87776916 0.36668951 0.87776916 1.0 Zn Zn12 1 0.87776916 0.87776916 0.36668951 1.0 Zn Zn13 1 0.87776916 0.87776916 0.87776916 1.0 Zn Zn14 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn15 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn16 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn17 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn18 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn19 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn20 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn21 1 0.01656728 0.32781124 0.32781124 1.0 Zn Zn22 1 0.32781124 0.01656728 0.32781124 1.0 Zn Zn23 1 0.32781124 0.32781124 0.01656728 1.0 Zn Zn24 1 0.32781124 0.32781124 0.32781124 1.0 Zn Zn25 1 0.98343272 0.67218876 0.67218876 1.0 Zn Zn26 1 0.67218876 0.98343272 0.67218876 1.0 Zn Zn27 1 0.67218876 0.67218876 0.98343272 1.0 Zn Zn28 1 0.67218876 0.67218876 0.67218876 1.0 C C29 1 0.50000000 0.50000000 0.50000000 1.0