# generated using pymatgen data_Nb6Ir5PtRh12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.52561443 _cell_length_b 5.51686412 _cell_length_c 13.44517760 _cell_angle_alpha 89.88376092 _cell_angle_beta 90.00220096 _cell_angle_gamma 120.07074654 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb6Ir5PtRh12 _chemical_formula_sum 'Nb6 Ir5 Pt1 Rh12' _cell_volume 354.69806843 _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 Nb Nb0 1 0.99996016 0.00096036 0.25046141 1.0 Nb Nb1 1 0.99996144 0.99648948 0.74776281 1.0 Nb Nb2 1 0.33314319 0.66649881 0.41092369 1.0 Nb Nb3 1 0.66576211 0.33268505 0.58894322 1.0 Nb Nb4 1 0.66554039 0.33209443 0.91026062 1.0 Nb Nb5 1 0.33520138 0.67065299 0.09085401 1.0 Ir Ir6 1 0.50496049 0.49655956 0.25033612 1.0 Ir Ir7 1 0.50551651 0.01176234 0.25003035 1.0 Ir Ir8 1 0.99098249 0.49671721 0.25032342 1.0 Ir Ir9 1 0.49490145 0.50389448 0.74923252 1.0 Ir Ir10 1 0.49415831 0.98872294 0.74962228 1.0 Pt Pt11 1 0.16600340 0.33185655 0.91841165 1.0 Rh Rh12 1 0.00698801 0.50267297 0.74933292 1.0 Rh Rh13 1 0.66975540 0.83451015 0.91720948 1.0 Rh Rh14 1 0.16602503 0.83527674 0.91772501 1.0 Rh Rh15 1 0.83520884 0.67054589 0.08269714 1.0 Rh Rh16 1 0.33129655 0.16512054 0.08316037 1.0 Rh Rh17 1 0.83377721 0.16515440 0.08307156 1.0 Rh Rh18 1 0.83465404 0.66945170 0.41770787 1.0 Rh Rh19 1 0.33051572 0.16496730 0.41773838 1.0 Rh Rh20 1 0.83432249 0.16485445 0.41766527 1.0 Rh Rh21 1 0.16583215 0.33001833 0.58193741 1.0 Rh Rh22 1 0.66952240 0.83421566 0.58254636 1.0 Rh Rh23 1 0.16600986 0.83431769 0.58204413 1.0