# generated using pymatgen data_Tb2Fe7Ni5P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.65285835 _cell_length_b 9.01724227 _cell_length_c 9.00255148 _cell_angle_alpha 120.00248640 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2Fe7Ni5P7 _chemical_formula_sum 'Tb2 Fe7 Ni5 P7' _cell_volume 256.79817523 _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 Tb Tb0 1 0.00000000 0.66500174 0.33111515 1.0 Tb Tb1 1 0.50000000 0.33404929 0.66875547 1.0 Fe Fe2 1 0.00000000 0.88159661 0.72482726 1.0 Fe Fe3 1 0.00000000 0.27256784 0.15756764 1.0 Fe Fe4 1 0.00000000 0.84688973 0.11669103 1.0 Fe Fe5 1 0.50000000 0.61542192 0.05060117 1.0 Fe Fe6 1 0.50000000 0.11866698 0.90473223 1.0 Fe Fe7 1 0.50000000 0.09384689 0.20987049 1.0 Fe Fe8 1 0.50000000 0.79139726 0.88294353 1.0 Ni Ni9 1 0.00000000 0.36860518 0.93913870 1.0 Ni Ni10 1 0.00000000 0.06023005 0.43230020 1.0 Ni Ni11 1 0.00000000 0.56729437 0.63109559 1.0 Ni Ni12 1 0.50000000 0.95071440 0.56261870 1.0 Ni Ni13 1 0.50000000 0.43639123 0.39022861 1.0 P P14 1 0.00000000 0.10980542 0.70269364 1.0 P P15 1 0.00000000 0.29676013 0.40932763 1.0 P P16 1 0.00000000 0.59210800 0.89391992 1.0 P P17 1 0.50000000 0.71530078 0.60110257 1.0 P P18 1 0.50000000 0.40073957 0.11310085 1.0 P P19 1 0.50000000 0.88230095 0.27954188 1.0 P P20 1 0.00000000 0.00031263 0.99782775 1.0