# generated using pymatgen data_Nd12Si8(Ir3Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.73940107 _cell_length_b 7.74656490 _cell_length_c 14.86530896 _cell_angle_alpha 89.99561415 _cell_angle_beta 89.94492742 _cell_angle_gamma 89.97222848 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd12Si8(Ir3Rh)3 _chemical_formula_sum 'Nd12 Si8 Ir9 Rh3' _cell_volume 660.92080794 _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 Nd Nd0 1 0.13738030 0.47244093 0.89150292 1.0 Nd Nd1 1 0.36217521 0.97460984 0.89184223 1.0 Nd Nd2 1 0.59993654 0.33106189 0.75016452 1.0 Nd Nd3 1 0.40127543 0.66911335 0.24993111 1.0 Nd Nd4 1 0.63807832 0.02594159 0.39097458 1.0 Nd Nd5 1 0.86343280 0.52591997 0.10944927 1.0 Nd Nd6 1 0.86214689 0.52623485 0.39093584 1.0 Nd Nd7 1 0.36164046 0.97310770 0.60845703 1.0 Nd Nd8 1 0.89989593 0.83023511 0.74989070 1.0 Nd Nd9 1 0.13786125 0.47242889 0.60846752 1.0 Nd Nd10 1 0.63806274 0.02651419 0.10915965 1.0 Nd Nd11 1 0.09922632 0.16970073 0.25002866 1.0 Si Si12 1 0.37192619 0.37131513 0.09738300 1.0 Si Si13 1 0.62730808 0.62889054 0.90137660 1.0 Si Si14 1 0.87147097 0.12740362 0.90164316 1.0 Si Si15 1 0.36940867 0.37194378 0.40234303 1.0 Si Si16 1 0.87076021 0.12784207 0.59820255 1.0 Si Si17 1 0.62827025 0.62810259 0.59839221 1.0 Si Si18 1 0.13111884 0.87201082 0.40226737 1.0 Si Si19 1 0.13030332 0.87231445 0.09801575 1.0 Ir Ir20 1 0.60725756 0.33917261 0.96039023 1.0 Ir Ir21 1 0.39688830 0.66248076 0.03933074 1.0 Ir Ir22 1 0.56737912 0.32112351 0.25044341 1.0 Ir Ir23 1 0.39762013 0.66144555 0.46100409 1.0 Ir Ir24 1 0.07050090 0.17862100 0.74957739 1.0 Ir Ir25 1 0.10232624 0.16147954 0.46089392 1.0 Ir Ir26 1 0.42708958 0.67980284 0.74982549 1.0 Ir Ir27 1 0.93389875 0.82110766 0.25025475 1.0 Ir Ir28 1 0.10186691 0.16151385 0.03967289 1.0 Rh Rh29 1 0.60670581 0.33886564 0.53830053 1.0 Rh Rh30 1 0.89337749 0.83868001 0.53834947 1.0 Rh Rh31 1 0.89341048 0.83857401 0.96152839 1.0