# generated using pymatgen data_Nd6TlFe13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.07536800 _cell_length_b 8.07536800 _cell_length_c 13.04421097 _cell_angle_alpha 108.03141365 _cell_angle_beta 108.03141365 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6TlFe13 _chemical_formula_sum 'Nd12 Tl2 Fe26' _cell_volume 764.80036048 _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 Nd Nd0 1 0.60483600 0.60483600 0.20967200 1.0 Nd Nd1 1 0.10483600 0.10483600 0.20967200 1.0 Nd Nd2 1 0.39516400 0.39516400 0.79032800 1.0 Nd Nd3 1 0.89516400 0.89516400 0.79032800 1.0 Nd Nd4 1 0.97784000 0.47784000 0.63005400 1.0 Nd Nd5 1 0.65221400 0.15221400 0.63005400 1.0 Nd Nd6 1 0.15221400 0.97784000 0.63005400 1.0 Nd Nd7 1 0.47784000 0.65221400 0.63005400 1.0 Nd Nd8 1 0.02216000 0.52216000 0.36994600 1.0 Nd Nd9 1 0.34778600 0.84778600 0.36994600 1.0 Nd Nd10 1 0.84778600 0.02216000 0.36994600 1.0 Nd Nd11 1 0.52216000 0.34778600 0.36994600 1.0 Tl Tl12 1 0.25000000 0.25000000 0.50000000 1.0 Tl Tl13 1 0.75000000 0.75000000 0.50000000 1.0 Fe Fe14 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe15 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe16 1 0.71016900 0.56606600 0.00000000 1.0 Fe Fe17 1 0.28983100 0.43393400 0.00000000 1.0 Fe Fe18 1 0.78983100 0.06606600 0.00000000 1.0 Fe Fe19 1 0.21016900 0.93393400 0.00000000 1.0 Fe Fe20 1 0.56606600 0.28983100 0.00000000 1.0 Fe Fe21 1 0.43393400 0.71016900 0.00000000 1.0 Fe Fe22 1 0.06606600 0.21016900 0.00000000 1.0 Fe Fe23 1 0.93393400 0.78983100 0.00000000 1.0 Fe Fe24 1 0.12048300 0.62048300 0.88279500 1.0 Fe Fe25 1 0.76231200 0.26231200 0.88279500 1.0 Fe Fe26 1 0.26231200 0.12048300 0.88279500 1.0 Fe Fe27 1 0.62048300 0.76231200 0.88279500 1.0 Fe Fe28 1 0.87951700 0.37951700 0.11720500 1.0 Fe Fe29 1 0.23768800 0.73768800 0.11720500 1.0 Fe Fe30 1 0.73768800 0.87951700 0.11720500 1.0 Fe Fe31 1 0.37951700 0.23768800 0.11720500 1.0 Fe Fe32 1 0.29328700 0.79328800 0.81244900 1.0 Fe Fe33 1 0.51916200 0.01916200 0.81244900 1.0 Fe Fe34 1 0.01916200 0.29328700 0.81244900 1.0 Fe Fe35 1 0.79328800 0.51916200 0.81244900 1.0 Fe Fe36 1 0.70671200 0.20671200 0.18755100 1.0 Fe Fe37 1 0.48083800 0.98083800 0.18755100 1.0 Fe Fe38 1 0.98083800 0.70671200 0.18755100 1.0 Fe Fe39 1 0.20671200 0.48083800 0.18755100 1.0