# generated using pymatgen data_CaYb4Si8Ni17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.89117908 _cell_length_b 12.89708771 _cell_length_c 3.91195005 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 140.87169185 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaYb4Si8Ni17 _chemical_formula_sum 'Ca1 Yb4 Si8 Ni17' _cell_volume 410.43809644 _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 Ca Ca0 1 0.82555572 0.61130129 0.00000000 1.0 Yb Yb1 1 0.60619450 0.81878710 0.00000000 1.0 Yb Yb2 1 0.18976436 0.79641024 0.50000000 1.0 Yb Yb3 1 0.79614228 0.18731515 0.50000000 1.0 Yb Yb4 1 0.22122416 0.22253973 0.50000000 1.0 Si Si5 1 0.15768723 0.99186306 0.00000000 1.0 Si Si6 1 0.98728319 0.15551921 0.00000000 1.0 Si Si7 1 0.47775571 0.95752004 0.00000000 1.0 Si Si8 1 0.95690990 0.47588708 0.00000000 1.0 Si Si9 1 0.58662390 0.31010973 0.50000000 1.0 Si Si10 1 0.30963276 0.58612242 0.50000000 1.0 Si Si11 1 0.49330844 0.49358229 0.00000000 1.0 Si Si12 1 0.75752751 0.75755445 0.50000000 1.0 Ni Ni13 1 0.37288373 0.03993584 0.00000000 1.0 Ni Ni14 1 0.04231314 0.37462493 0.00000000 1.0 Ni Ni15 1 0.66976138 0.27270382 0.00000000 1.0 Ni Ni16 1 0.27843543 0.67144555 0.00000000 1.0 Ni Ni17 1 0.44782737 0.28168028 0.00000000 1.0 Ni Ni18 1 0.28411727 0.45144217 0.00000000 1.0 Ni Ni19 1 0.01230655 0.88808615 0.50000000 1.0 Ni Ni20 1 0.87926766 0.00843413 0.50000000 1.0 Ni Ni21 1 0.30703648 0.08569929 0.50000000 1.0 Ni Ni22 1 0.08504831 0.30594067 0.50000000 1.0 Ni Ni23 1 0.51719815 0.08513018 0.50000000 1.0 Ni Ni24 1 0.08622642 0.51792858 0.50000000 1.0 Ni Ni25 1 0.84491182 0.44463857 0.50000000 1.0 Ni Ni26 1 0.45035275 0.84693470 0.50000000 1.0 Ni Ni27 1 0.57112070 0.47327582 0.50000000 1.0 Ni Ni28 1 0.47672142 0.57658468 0.50000000 1.0 Ni Ni29 1 0.92510275 0.92724584 0.00000000 1.0