# generated using pymatgen data_Pr5P12Ru16Rh3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.59455057 _cell_length_b 12.59455089 _cell_length_c 4.01499871 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999914 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr5P12Ru16Rh3 _chemical_formula_sum 'Pr5 P12 Ru16 Rh3' _cell_volume 551.54557604 _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 Pr Pr0 1 0.18327813 0.18327813 0.50000000 1.0 Pr Pr1 1 0.81672187 0.00000000 0.50000000 1.0 Pr Pr2 1 1.00000000 0.81672187 0.50000000 1.0 Pr Pr3 1 0.33333300 0.66666700 0.00000000 1.0 Pr Pr4 1 0.66666700 0.33333300 0.00000000 1.0 P P5 1 0.81051496 0.81051496 0.00000000 1.0 P P6 1 0.18948504 0.00000000 0.00000000 1.0 P P7 1 1.00000000 0.18948504 0.00000000 1.0 P P8 1 0.17531724 0.47602677 0.50000000 1.0 P P9 1 0.52397323 0.69928847 0.50000000 1.0 P P10 1 0.30071153 0.82468276 0.50000000 1.0 P P11 1 0.69928847 0.52397323 0.50000000 1.0 P P12 1 0.82468276 0.30071153 0.50000000 1.0 P P13 1 0.47602677 0.17531724 0.50000000 1.0 P P14 1 0.37372478 0.37372478 0.00000000 1.0 P P15 1 0.62627522 0.00000000 0.00000000 1.0 P P16 1 0.00000000 0.62627522 0.00000000 1.0 Ru Ru17 1 0.71198571 0.71198571 0.50000000 1.0 Ru Ru18 1 0.28801429 0.00000000 0.50000000 1.0 Ru Ru19 1 1.00000000 0.28801429 0.50000000 1.0 Ru Ru20 1 0.18538323 0.37950706 0.00000000 1.0 Ru Ru21 1 0.62049294 0.80587617 0.00000000 1.0 Ru Ru22 1 0.19412383 0.81461677 0.00000000 1.0 Ru Ru23 1 0.80587617 0.62049294 0.00000000 1.0 Ru Ru24 1 0.81461677 0.19412383 0.00000000 1.0 Ru Ru25 1 0.37950706 0.18538323 0.00000000 1.0 Ru Ru26 1 0.36933225 0.49233515 0.50000000 1.0 Ru Ru27 1 0.50766485 0.87699810 0.50000000 1.0 Ru Ru28 1 0.12300190 0.63066775 0.50000000 1.0 Ru Ru29 1 0.87699810 0.50766485 0.50000000 1.0 Ru Ru30 1 0.63066775 0.12300190 0.50000000 1.0 Ru Ru31 1 0.49233515 0.36933225 0.50000000 1.0 Ru Ru32 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh33 1 0.55329261 0.55329261 0.00000000 1.0 Rh Rh34 1 0.44670739 0.00000000 0.00000000 1.0 Rh Rh35 1 1.00000000 0.44670739 0.00000000 1.0