# generated using pymatgen data_Y5Tm2P12Ir17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.64177023 _cell_length_b 12.93288873 _cell_length_c 3.96427055 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.25812699 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y5Tm2P12Ir17 _chemical_formula_sum 'Y5 Tm2 P12 Ir17' _cell_volume 565.45189421 _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 Y Y0 1 0.32986093 0.66249473 0.50000000 1.0 Y Y1 1 0.66736619 0.33750527 0.50000000 1.0 Y Y2 1 0.00309286 0.81728144 0.00000000 1.0 Y Y3 1 0.18581042 0.18271856 0.00000000 1.0 Y Y4 1 0.81158918 1.00000000 0.00000000 1.0 Tm Tm5 1 0.99561955 0.44358450 0.50000000 1.0 Tm Tm6 1 0.55203505 0.55641550 0.50000000 1.0 P P7 1 0.01006803 0.65845550 0.50000000 1.0 P P8 1 0.35161252 0.34154450 0.50000000 1.0 P P9 1 0.64392778 0.00000000 0.50000000 1.0 P P10 1 0.51714279 0.69196443 0.00000000 1.0 P P11 1 0.30864056 0.82445696 0.00000000 1.0 P P12 1 0.16710828 0.47996627 0.00000000 1.0 P P13 1 0.48418260 0.17554304 0.00000000 1.0 P P14 1 0.68714301 0.52003373 0.00000000 1.0 P P15 1 0.82517835 0.30803557 0.00000000 1.0 P P16 1 0.99968823 0.17485731 0.50000000 1.0 P P17 1 0.82482991 0.82514269 0.50000000 1.0 P P18 1 0.18172977 1.00000000 0.50000000 1.0 Ir Ir19 1 0.50380081 0.86638378 0.00000000 1.0 Ir Ir20 1 0.12167637 0.64470902 0.00000000 1.0 Ir Ir21 1 0.35922715 0.50417651 0.00000000 1.0 Ir Ir22 1 0.47696835 0.35529098 0.00000000 1.0 Ir Ir23 1 0.85505064 0.49582349 0.00000000 1.0 Ir Ir24 1 0.63741703 0.13361622 0.00000000 1.0 Ir Ir25 1 0.46535188 1.00000000 0.50000000 1.0 Ir Ir26 1 0.99637344 0.27209033 0.00000000 1.0 Ir Ir27 1 0.72428311 0.72790967 0.00000000 1.0 Ir Ir28 1 0.28710770 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62430926 0.81092365 0.50000000 1.0 Ir Ir30 1 0.20817712 0.82853872 0.50000000 1.0 Ir Ir31 1 0.18085903 0.36443659 0.50000000 1.0 Ir Ir32 1 0.37963840 0.17146128 0.50000000 1.0 Ir Ir33 1 0.81642244 0.63556341 0.50000000 1.0 Ir Ir34 1 0.81338562 0.18907635 0.50000000 1.0 Ir Ir35 1 0.00332064 1.00000000 0.50000000 1.0