# generated using pymatgen data_Ce(Ni2B)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.00141879 _cell_length_b 6.00401863 _cell_length_c 10.96842655 _cell_angle_alpha 90.00461247 _cell_angle_beta 90.00476620 _cell_angle_gamma 104.74238702 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce(Ni2B)6 _chemical_formula_sum 'Ce2 Ni24 B12' _cell_volume 382.21047575 _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 Ce Ce0 1 0.83150744 0.83204968 0.49767088 1.0 Ce Ce1 1 0.16845983 0.16803180 0.99771049 1.0 Ni Ni2 1 0.14708458 0.87943022 0.75606012 1.0 Ni Ni3 1 0.12072464 0.85306037 0.25599171 1.0 Ni Ni4 1 0.34362098 0.72753166 0.06744378 1.0 Ni Ni5 1 0.65639221 0.27262311 0.56745098 1.0 Ni Ni6 1 0.27374437 0.65656351 0.56737896 1.0 Ni Ni7 1 0.87919601 0.14692486 0.75596071 1.0 Ni Ni8 1 0.63000006 0.99300375 0.93725850 1.0 Ni Ni9 1 0.37005533 0.00698772 0.43725190 1.0 Ni Ni10 1 0.00712645 0.37063456 0.43717940 1.0 Ni Ni11 1 0.99285892 0.62936405 0.93722469 1.0 Ni Ni12 1 0.52658916 0.78943069 0.27519816 1.0 Ni Ni13 1 0.47347570 0.21057321 0.77515330 1.0 Ni Ni14 1 0.21036583 0.47359582 0.77503313 1.0 Ni Ni15 1 0.78963622 0.52638467 0.27508694 1.0 Ni Ni16 1 0.19599127 0.46069314 0.23492062 1.0 Ni Ni17 1 0.80400454 0.53923630 0.73497960 1.0 Ni Ni18 1 0.53946660 0.80411105 0.73508052 1.0 Ni Ni19 1 0.46048613 0.19584132 0.23505551 1.0 Ni Ni20 1 0.22267349 0.22275188 0.59905729 1.0 Ni Ni21 1 0.77729879 0.77720689 0.09912549 1.0 Ni Ni22 1 0.43225349 0.43205990 0.41670547 1.0 Ni Ni23 1 0.56778226 0.56799114 0.91671875 1.0 Ni Ni24 1 0.72626960 0.34343671 0.06737647 1.0 Ni Ni25 1 0.85290239 0.12054937 0.25606780 1.0 B B26 1 0.01401615 0.60230187 0.12200441 1.0 B B27 1 0.98597092 0.39771781 0.62196232 1.0 B B28 1 0.24897634 0.67696370 0.38599571 1.0 B B29 1 0.75101424 0.32302287 0.88601265 1.0 B B30 1 0.32306223 0.75097342 0.88604891 1.0 B B31 1 0.67691075 0.24893333 0.38603777 1.0 B B32 1 0.48691225 0.48685453 0.65914799 1.0 B B33 1 0.51308275 0.51315695 0.15917508 1.0 B B34 1 0.83645985 0.83629318 0.83269572 1.0 B B35 1 0.16356372 0.16371718 0.33271275 1.0 B B36 1 0.39764262 0.98587840 0.62202585 1.0 B B37 1 0.60242092 0.01411838 0.12204868 1.0