# generated using pymatgen data_TmMnSn2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.98017200 _cell_length_b 10.32179700 _cell_length_c 11.31893100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmMnSn2 _chemical_formula_sum 'Tm12 Mn12 Sn24' _cell_volume 1049.16883324 _cell_formula_units_Z 12 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 0.24287700 0.83068900 0.45410400 1.0 Tm Tm1 1 0.24287700 0.16931100 0.54589600 1.0 Tm Tm2 1 0.75712300 0.33068900 0.04589600 1.0 Tm Tm3 1 0.75712300 0.66931100 0.95410400 1.0 Tm Tm4 1 0.75712300 0.16931100 0.54589600 1.0 Tm Tm5 1 0.75712300 0.83068900 0.45410400 1.0 Tm Tm6 1 0.24287700 0.66931100 0.95410400 1.0 Tm Tm7 1 0.24287700 0.33068900 0.04589600 1.0 Tm Tm8 1 0.00000000 0.83577700 0.18017100 1.0 Tm Tm9 1 0.00000000 0.16422300 0.81982900 1.0 Tm Tm10 1 0.00000000 0.33577700 0.31982900 1.0 Tm Tm11 1 0.00000000 0.66422300 0.68017100 1.0 Mn Mn12 1 0.24725900 0.58771600 0.25707900 1.0 Mn Mn13 1 0.24725900 0.41228400 0.74292100 1.0 Mn Mn14 1 0.75274100 0.08771600 0.24292100 1.0 Mn Mn15 1 0.75274100 0.91228400 0.75707900 1.0 Mn Mn16 1 0.75274100 0.41228400 0.74292100 1.0 Mn Mn17 1 0.75274100 0.58771600 0.25707900 1.0 Mn Mn18 1 0.24725900 0.91228400 0.75707900 1.0 Mn Mn19 1 0.24725900 0.08771600 0.24292100 1.0 Mn Mn20 1 0.24374700 0.50000000 0.50000000 1.0 Mn Mn21 1 0.75625300 0.00000000 0.00000000 1.0 Mn Mn22 1 0.75625300 0.50000000 0.50000000 1.0 Mn Mn23 1 0.24374700 0.00000000 0.00000000 1.0 Sn Sn24 1 0.33664100 0.83683100 0.18219300 1.0 Sn Sn25 1 0.33664100 0.16316900 0.81780700 1.0 Sn Sn26 1 0.66335900 0.33683100 0.31780700 1.0 Sn Sn27 1 0.66335900 0.66316900 0.68219300 1.0 Sn Sn28 1 0.66335900 0.16316900 0.81780700 1.0 Sn Sn29 1 0.66335900 0.83683100 0.18219300 1.0 Sn Sn30 1 0.33664100 0.66316900 0.68219300 1.0 Sn Sn31 1 0.33664100 0.33683100 0.31780700 1.0 Sn Sn32 1 0.50000000 0.54483800 0.12619900 1.0 Sn Sn33 1 0.50000000 0.45516200 0.87380100 1.0 Sn Sn34 1 0.50000000 0.04483800 0.37380100 1.0 Sn Sn35 1 0.50000000 0.95516200 0.62619900 1.0 Sn Sn36 1 0.00000000 0.54139600 0.12364300 1.0 Sn Sn37 1 0.00000000 0.45860400 0.87635700 1.0 Sn Sn38 1 0.00000000 0.04139600 0.37635700 1.0 Sn Sn39 1 0.00000000 0.95860400 0.62364300 1.0 Sn Sn40 1 0.50000000 0.62767300 0.40764900 1.0 Sn Sn41 1 0.50000000 0.37232700 0.59235100 1.0 Sn Sn42 1 0.50000000 0.12767300 0.09235100 1.0 Sn Sn43 1 0.50000000 0.87232700 0.90764900 1.0 Sn Sn44 1 0.00000000 0.63137600 0.40114300 1.0 Sn Sn45 1 0.00000000 0.36862400 0.59885700 1.0 Sn Sn46 1 0.00000000 0.13137600 0.09885700 1.0 Sn Sn47 1 0.00000000 0.86862400 0.90114300 1.0