# generated using pymatgen data_Nb12B12Os5Ru7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.10726380 _cell_length_b 9.05422823 _cell_length_c 15.78386921 _cell_angle_alpha 90.01740691 _cell_angle_beta 89.99999282 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb12B12Os5Ru7 _chemical_formula_sum 'Nb12 B12 Os5 Ru7' _cell_volume 444.06139221 _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 1.00000000 0.80008712 0.49530970 1.0 Nb Nb1 1 0.00000000 0.19915900 0.50402032 1.0 Nb Nb2 1 1.00000000 0.30102061 0.00413258 1.0 Nb Nb3 1 0.00000000 0.69906707 0.99607406 1.0 Nb Nb4 1 1.00000000 0.51384326 0.59467305 1.0 Nb Nb5 1 0.00000000 0.48648504 0.40511484 1.0 Nb Nb6 1 0.00000000 0.01317436 0.90540602 1.0 Nb Nb7 1 1.00000000 0.98688233 0.09479012 1.0 Nb Nb8 1 1.00000000 0.68625878 0.20272634 1.0 Nb Nb9 1 0.00000000 0.31377443 0.79727874 1.0 Nb Nb10 1 0.00000000 0.18639335 0.29701490 1.0 Nb Nb11 1 1.00000000 0.81278649 0.70340542 1.0 B B12 1 0.50000000 0.60394821 0.49798599 1.0 B B13 1 0.50000000 0.39587862 0.50163927 1.0 B B14 1 0.50000000 0.10445157 0.00180206 1.0 B B15 1 0.50000000 0.89562409 0.99841926 1.0 B B16 1 0.00000000 0.60825292 0.83261507 1.0 B B17 1 1.00000000 0.39152697 0.16763115 1.0 B B18 1 1.00000000 0.10899811 0.66752800 1.0 B B19 1 0.00000000 0.89116159 0.33209940 1.0 B B20 1 0.50000000 0.71484170 0.59804820 1.0 B B21 1 0.50000000 0.28620774 0.40152307 1.0 B B22 1 0.50000000 0.21376999 0.90178390 1.0 B B23 1 0.50000000 0.78621843 0.09842195 1.0 Os Os24 1 0.50000000 0.98438007 0.59461262 1.0 Os Os25 1 0.50000000 0.56136508 0.73569205 1.0 Os Os26 1 0.50000000 0.43862559 0.26438209 1.0 Os Os27 1 0.50000000 0.06166160 0.76499217 1.0 Os Os28 1 0.50000000 0.93877002 0.23549117 1.0 Ru Ru29 1 0.50000000 0.72186460 0.35554607 1.0 Ru Ru30 1 0.50000000 0.27874211 0.64431198 1.0 Ru Ru31 1 0.50000000 0.22229112 0.14391764 1.0 Ru Ru32 1 0.50000100 0.77772155 0.85630546 1.0 Ru Ru33 1 0.50000000 0.51480085 0.09465666 1.0 Ru Ru34 1 0.50000000 0.48520731 0.90541543 1.0 Ru Ru35 1 0.49999900 0.01475933 0.40523026 1.0