# generated using pymatgen data_Tm2Fe17C3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.32795800 _cell_length_b 8.59920303 _cell_length_c 8.59920303 _cell_angle_alpha 119.99999256 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm2Fe17C3 _chemical_formula_sum 'Tm4 Fe34 C6' _cell_volume 533.31720774 _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 0.75000000 0.66666700 0.33333300 1.0 Tm Tm1 1 0.25000000 0.33333300 0.66666700 1.0 Tm Tm2 1 0.75000000 0.00000000 0.00000000 1.0 Tm Tm3 1 0.25000000 0.00000000 0.00000000 1.0 Fe Fe4 1 0.75000000 0.62203700 0.67418200 1.0 Fe Fe5 1 0.25000000 0.37796300 0.32581800 1.0 Fe Fe6 1 0.75000000 0.05214500 0.37796300 1.0 Fe Fe7 1 0.25000000 0.94785500 0.32581800 1.0 Fe Fe8 1 0.25000000 0.94785500 0.62203700 1.0 Fe Fe9 1 0.75000000 0.05214500 0.67418200 1.0 Fe Fe10 1 0.75000000 0.32581800 0.94785500 1.0 Fe Fe11 1 0.25000000 0.67418200 0.62203700 1.0 Fe Fe12 1 0.25000000 0.67418200 0.05214500 1.0 Fe Fe13 1 0.75000000 0.32581800 0.37796300 1.0 Fe Fe14 1 0.25000000 0.37796300 0.05214500 1.0 Fe Fe15 1 0.75000000 0.62203700 0.94785500 1.0 Fe Fe16 1 0.39321300 0.66666700 0.33333300 1.0 Fe Fe17 1 0.60678700 0.33333300 0.66666700 1.0 Fe Fe18 1 0.89321300 0.33333300 0.66666700 1.0 Fe Fe19 1 0.10678700 0.66666700 0.33333300 1.0 Fe Fe20 1 0.97999500 0.83205400 0.16794600 1.0 Fe Fe21 1 0.02000500 0.16794600 0.83205400 1.0 Fe Fe22 1 0.97999500 0.33589200 0.16794600 1.0 Fe Fe23 1 0.47999500 0.16794600 0.83205400 1.0 Fe Fe24 1 0.02000500 0.66410800 0.83205400 1.0 Fe Fe25 1 0.52000500 0.83205400 0.16794600 1.0 Fe Fe26 1 0.97999500 0.83205400 0.66410800 1.0 Fe Fe27 1 0.47999500 0.66410800 0.83205400 1.0 Fe Fe28 1 0.02000500 0.16794600 0.33589200 1.0 Fe Fe29 1 0.52000500 0.33589200 0.16794600 1.0 Fe Fe30 1 0.47999500 0.16794600 0.33589200 1.0 Fe Fe31 1 0.52000500 0.83205400 0.66410800 1.0 Fe Fe32 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe33 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe34 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe35 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe36 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe37 1 0.50000000 0.50000000 0.00000000 1.0 C C38 1 0.75000000 0.83454900 0.16545100 1.0 C C39 1 0.25000000 0.16545100 0.83454900 1.0 C C40 1 0.75000000 0.33090300 0.16545100 1.0 C C41 1 0.25000000 0.66909700 0.83454900 1.0 C C42 1 0.75000000 0.83454900 0.66909700 1.0 C C43 1 0.25000000 0.16545100 0.33090300 1.0