# generated using pymatgen data_HoP2Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.96546494 _cell_length_b 11.13767970 _cell_length_c 12.65305644 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HoP2Ir3 _chemical_formula_sum 'Ho6 P12 Ir18' _cell_volume 558.83588284 _cell_formula_units_Z 6 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 Ho Ho0 1 0.00000000 0.50000000 0.52322995 1.0 Ho Ho1 1 0.50000000 0.00000000 0.47677005 1.0 Ho Ho2 1 0.50000000 0.81681991 0.20539836 1.0 Ho Ho3 1 0.50000000 0.18318009 0.20539836 1.0 Ho Ho4 1 0.00000000 0.68318009 0.79460164 1.0 Ho Ho5 1 0.00000000 0.31681991 0.79460164 1.0 P P6 1 0.50000000 0.31525285 0.61793048 1.0 P P7 1 0.50000000 0.68474715 0.61793048 1.0 P P8 1 0.00000000 0.18474715 0.38206952 1.0 P P9 1 0.00000000 0.81525285 0.38206952 1.0 P P10 1 0.50000000 0.50000000 0.87642033 1.0 P P11 1 0.00000000 0.00000000 0.12357967 1.0 P P12 1 0.50000000 0.84306997 0.89381619 1.0 P P13 1 0.50000000 0.15693003 0.89381619 1.0 P P14 1 0.00000000 0.65693003 0.10618381 1.0 P P15 1 0.00000000 0.34306997 0.10618381 1.0 P P16 1 0.50000000 0.50000000 0.36150414 1.0 P P17 1 0.00000000 0.00000000 0.63849586 1.0 Ir Ir18 1 0.00000000 0.50000000 0.97315430 1.0 Ir Ir19 1 0.50000000 0.00000000 0.02684570 1.0 Ir Ir20 1 0.50000000 0.29656051 0.43013175 1.0 Ir Ir21 1 0.50000000 0.70343949 0.43013175 1.0 Ir Ir22 1 0.00000000 0.20343949 0.56986825 1.0 Ir Ir23 1 0.00000000 0.79656051 0.56986825 1.0 Ir Ir24 1 0.50000000 0.86828799 0.71441382 1.0 Ir Ir25 1 0.50000000 0.13171201 0.71441382 1.0 Ir Ir26 1 0.00000000 0.63171201 0.28558618 1.0 Ir Ir27 1 0.00000000 0.36828799 0.28558618 1.0 Ir Ir28 1 0.50000000 0.33643699 0.00106921 1.0 Ir Ir29 1 0.50000000 0.66356301 0.00106921 1.0 Ir Ir30 1 0.00000000 0.16356301 0.99893079 1.0 Ir Ir31 1 0.00000000 0.83643699 0.99893079 1.0 Ir Ir32 1 0.50000000 0.50000000 0.18256374 1.0 Ir Ir33 1 0.00000000 0.00000000 0.81743626 1.0 Ir Ir34 1 0.50000000 0.50000000 0.69936164 1.0 Ir Ir35 1 0.00000000 0.00000000 0.30063836 1.0