# generated using pymatgen data_Ca5Yb(LuSb3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.14863059 _cell_length_b 8.12334569 _cell_length_c 8.05880294 _cell_angle_alpha 109.47017356 _cell_angle_beta 109.62589638 _cell_angle_gamma 109.80012967 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Yb(LuSb3)2 _chemical_formula_sum 'Ca5 Yb1 Lu2 Sb6' _cell_volume 408.18026631 _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 0.00440560 0.35627719 0.49884505 1.0 Ca Ca1 1 0.35232897 0.49253685 0.99649772 1.0 Ca Ca2 1 0.00452720 0.85688827 0.50049319 1.0 Ca Ca3 1 0.85636434 0.49698924 0.00380350 1.0 Ca Ca4 1 0.49841311 0.00389744 0.85901382 1.0 Yb Yb5 1 0.13906537 0.14460855 0.14079617 1.0 Lu Lu6 1 0.49718067 0.99997744 0.35214539 1.0 Lu Lu7 1 0.64612920 0.64787669 0.64821391 1.0 Sb Sb8 1 0.86069110 0.11106319 0.73539143 1.0 Sb Sb9 1 0.38522638 0.25419033 0.61688356 1.0 Sb Sb10 1 0.12158891 0.75308129 0.88175995 1.0 Sb Sb11 1 0.74209360 0.87170475 0.11924150 1.0 Sb Sb12 1 0.26764939 0.63479470 0.38110988 1.0 Sb Sb13 1 0.62433415 0.37611505 0.26580495 1.0