# generated using pymatgen data_Sm23Cd4Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.92723599 _cell_length_b 9.92723599 _cell_length_c 22.31456307 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999753 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm23Cd4Ir7 _chemical_formula_sum 'Sm46 Cd8 Ir14' _cell_volume 1904.47695613 _cell_formula_units_Z 2 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 Sm Sm0 1 0.20698545 0.41397090 0.72046078 1.0 Sm Sm1 1 0.20698545 0.79301455 0.72046078 1.0 Sm Sm2 1 0.79301455 0.58602910 0.22046078 1.0 Sm Sm3 1 0.58602910 0.79301455 0.72046078 1.0 Sm Sm4 1 0.79301455 0.20698545 0.22046078 1.0 Sm Sm5 1 0.41397090 0.20698545 0.22046078 1.0 Sm Sm6 1 0.79295007 0.58590014 0.94688076 1.0 Sm Sm7 1 0.79295007 0.20704993 0.94688076 1.0 Sm Sm8 1 0.20704993 0.41409986 0.44688076 1.0 Sm Sm9 1 0.41409986 0.20704993 0.94688076 1.0 Sm Sm10 1 0.20704993 0.79295007 0.44688076 1.0 Sm Sm11 1 0.58590014 0.79295007 0.44688076 1.0 Sm Sm12 1 0.20880980 0.41761961 0.98991508 1.0 Sm Sm13 1 0.20880980 0.79119020 0.98991508 1.0 Sm Sm14 1 0.79119020 0.58238039 0.48991508 1.0 Sm Sm15 1 0.58238039 0.79119020 0.98991508 1.0 Sm Sm16 1 0.79119020 0.20880980 0.48991508 1.0 Sm Sm17 1 0.41761961 0.20880980 0.48991508 1.0 Sm Sm18 1 0.87235991 0.74471983 0.63602676 1.0 Sm Sm19 1 0.87235991 0.12764009 0.63602676 1.0 Sm Sm20 1 0.12764009 0.25528017 0.13602676 1.0 Sm Sm21 1 0.25528017 0.12764009 0.63602676 1.0 Sm Sm22 1 0.12764009 0.87235991 0.13602676 1.0 Sm Sm23 1 0.74471983 0.87235991 0.13602676 1.0 Sm Sm24 1 0.45949981 0.91899963 0.85593620 1.0 Sm Sm25 1 0.45949981 0.54050019 0.85593620 1.0 Sm Sm26 1 0.54050019 0.08100037 0.35593620 1.0 Sm Sm27 1 0.08100037 0.54050019 0.85593620 1.0 Sm Sm28 1 0.54050019 0.45949981 0.35593620 1.0 Sm Sm29 1 0.91899963 0.45949981 0.35593620 1.0 Sm Sm30 1 0.00000000 0.00000000 0.99797298 1.0 Sm Sm31 1 0.00000000 0.00000000 0.49797298 1.0 Sm Sm32 1 0.46088073 0.92176146 0.58543373 1.0 Sm Sm33 1 0.46088073 0.53911927 0.58543373 1.0 Sm Sm34 1 0.53911927 0.07823854 0.08543373 1.0 Sm Sm35 1 0.07823854 0.53911927 0.58543373 1.0 Sm Sm36 1 0.53911927 0.46088073 0.08543373 1.0 Sm Sm37 1 0.92176146 0.46088073 0.08543373 1.0 Sm Sm38 1 0.79731011 0.59462022 0.78243069 1.0 Sm Sm39 1 0.79731011 0.20268989 0.78243069 1.0 Sm Sm40 1 0.20268989 0.40537978 0.28243069 1.0 Sm Sm41 1 0.40537978 0.20268989 0.78243069 1.0 Sm Sm42 1 0.20268989 0.79731011 0.28243069 1.0 Sm Sm43 1 0.59462022 0.79731011 0.28243069 1.0 Sm Sm44 1 0.66666700 0.33333300 0.64495024 1.0 Sm Sm45 1 0.33333300 0.66666700 0.14495024 1.0 Cd Cd46 1 0.00000000 0.00000000 0.75005065 1.0 Cd Cd47 1 0.00000000 0.00000000 0.25005065 1.0 Cd Cd48 1 0.10725272 0.21450544 0.86343437 1.0 Cd Cd49 1 0.10725272 0.89274728 0.86343437 1.0 Cd Cd50 1 0.89274728 0.78549456 0.36343437 1.0 Cd Cd51 1 0.78549456 0.89274728 0.86343437 1.0 Cd Cd52 1 0.89274728 0.10725272 0.36343437 1.0 Cd Cd53 1 0.21450544 0.10725272 0.36343437 1.0 Ir Ir54 1 0.52073030 0.04146059 0.70953814 1.0 Ir Ir55 1 0.52073030 0.47926970 0.70953814 1.0 Ir Ir56 1 0.47926970 0.95853941 0.20953814 1.0 Ir Ir57 1 0.95853941 0.47926970 0.70953814 1.0 Ir Ir58 1 0.47926970 0.52073030 0.20953814 1.0 Ir Ir59 1 0.04146059 0.52073030 0.20953814 1.0 Ir Ir60 1 0.66666700 0.33333300 0.86354026 1.0 Ir Ir61 1 0.33333300 0.66666700 0.36354026 1.0 Ir Ir62 1 0.14378899 0.28757797 0.56334545 1.0 Ir Ir63 1 0.14378899 0.85621101 0.56334545 1.0 Ir Ir64 1 0.85621101 0.71242203 0.06334545 1.0 Ir Ir65 1 0.71242203 0.85621101 0.56334545 1.0 Ir Ir66 1 0.85621101 0.14378899 0.06334545 1.0 Ir Ir67 1 0.28757797 0.14378899 0.06334545 1.0