# generated using pymatgen data_Zr3Pa5(As3Rh4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.22102397 _cell_length_b 13.22102447 _cell_length_c 4.01675725 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000120 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Pa5(As3Rh4)4 _chemical_formula_sum 'Zr3 Pa5 As12 Rh16' _cell_volume 608.04596985 _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 Zr Zr0 1 0.55565554 0.55565554 0.00000000 1.0 Zr Zr1 1 0.44434446 1.00000000 0.00000000 1.0 Zr Zr2 1 0.00000000 0.44434446 0.00000000 1.0 Pa Pa3 1 0.18513113 0.18513113 0.50000000 1.0 Pa Pa4 1 0.81486887 0.00000000 0.50000000 1.0 Pa Pa5 1 0.00000000 0.81486887 0.50000000 1.0 Pa Pa6 1 0.33333300 0.66666700 0.00000000 1.0 Pa Pa7 1 0.66666700 0.33333300 0.00000000 1.0 As As8 1 0.82351659 0.82351659 0.00000000 1.0 As As9 1 0.17648341 1.00000000 0.00000000 1.0 As As10 1 0.00000000 0.17648341 0.00000000 1.0 As As11 1 0.16915152 0.48555336 0.50000000 1.0 As As12 1 0.51444664 0.68359816 0.50000000 1.0 As As13 1 0.31640184 0.83084848 0.50000000 1.0 As As14 1 0.68359816 0.51444664 0.50000000 1.0 As As15 1 0.83084848 0.31640184 0.50000000 1.0 As As16 1 0.48555336 0.16915152 0.50000000 1.0 As As17 1 0.35468962 0.35468962 0.00000000 1.0 As As18 1 0.64531038 0.00000000 0.00000000 1.0 As As19 1 0.00000000 0.64531038 0.00000000 1.0 Rh Rh20 1 0.71878047 0.71878047 0.50000000 1.0 Rh Rh21 1 0.28121953 1.00000000 0.50000000 1.0 Rh Rh22 1 0.00000000 0.28121953 0.50000000 1.0 Rh Rh23 1 0.17601240 0.37212943 0.00000000 1.0 Rh Rh24 1 0.62787057 0.80388297 0.00000000 1.0 Rh Rh25 1 0.19611703 0.82398760 0.00000000 1.0 Rh Rh26 1 0.80388297 0.62787057 0.00000000 1.0 Rh Rh27 1 0.82398760 0.19611703 0.00000000 1.0 Rh Rh28 1 0.37212943 0.17601240 0.00000000 1.0 Rh Rh29 1 0.35369260 0.48217546 0.50000000 1.0 Rh Rh30 1 0.51782454 0.87151814 0.50000000 1.0 Rh Rh31 1 0.12848186 0.64630740 0.50000000 1.0 Rh Rh32 1 0.87151814 0.51782454 0.50000000 1.0 Rh Rh33 1 0.64630740 0.12848186 0.50000000 1.0 Rh Rh34 1 0.48217546 0.35369260 0.50000000 1.0 Rh Rh35 1 0.00000000 0.00000000 0.00000000 1.0