# generated using pymatgen data_Tm4GeI6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.17297998 _cell_length_b 13.81009910 _cell_length_c 14.47129834 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4GeI6 _chemical_formula_sum 'Tm8 Ge2 I12' _cell_volume 833.97031610 _cell_formula_units_Z 2 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 0.50000000 0.11674857 0.34853724 1.0 Tm Tm1 1 0.50000000 0.88325143 0.65146276 1.0 Tm Tm2 1 0.50000000 0.61674857 0.15146276 1.0 Tm Tm3 1 0.50000000 0.38325143 0.84853724 1.0 Tm Tm4 1 0.00000000 0.10804426 0.57600691 1.0 Tm Tm5 1 0.00000000 0.89195574 0.42399309 1.0 Tm Tm6 1 0.00000000 0.60804426 0.92399309 1.0 Tm Tm7 1 0.00000000 0.39195574 0.07600691 1.0 Ge Ge8 1 0.50000000 0.00000000 0.50000000 1.0 Ge Ge9 1 0.50000000 0.50000000 0.00000000 1.0 I I10 1 0.50000000 0.25232483 0.16711211 1.0 I I11 1 0.50000000 0.74767517 0.83288789 1.0 I I12 1 0.50000000 0.75232483 0.33288789 1.0 I I13 1 0.50000000 0.24767517 0.66711211 1.0 I I14 1 0.00000000 0.25881740 0.41844001 1.0 I I15 1 0.00000000 0.74118260 0.58155999 1.0 I I16 1 0.00000000 0.75881740 0.08155999 1.0 I I17 1 0.00000000 0.24118260 0.91844001 1.0 I I18 1 0.00000000 0.00454679 0.23902519 1.0 I I19 1 0.00000000 0.99545321 0.76097481 1.0 I I20 1 0.00000000 0.50454679 0.26097481 1.0 I I21 1 0.00000000 0.49545321 0.73902519 1.0