# generated using pymatgen data_Ca3Yb9(PrSn2)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96219859 _cell_length_b 8.48791597 _cell_length_c 15.95966699 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00204790 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Yb9(PrSn2)8 _chemical_formula_sum 'Ca3 Yb9 Pr8 Sn16' _cell_volume 1078.59375550 _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 0.15557965 0.50493527 0.75000000 1.0 Ca Ca1 1 0.65558970 0.99498821 0.75000000 1.0 Ca Ca2 1 0.84442476 0.49551240 0.25000000 1.0 Yb Yb3 1 0.32769925 0.82815925 0.87685648 1.0 Yb Yb4 1 0.82767440 0.67199047 0.62327026 1.0 Yb Yb5 1 0.67192287 0.17163716 0.37606311 1.0 Yb Yb6 1 0.17233576 0.32766112 0.12373147 1.0 Yb Yb7 1 0.67192287 0.17163716 0.12393689 1.0 Yb Yb8 1 0.17233576 0.32766112 0.37626853 1.0 Yb Yb9 1 0.32769925 0.82815925 0.62314352 1.0 Yb Yb10 1 0.82767440 0.67199047 0.87672974 1.0 Yb Yb11 1 0.34460085 0.00641766 0.25000000 1.0 Pr Pr12 1 0.48925991 0.31402575 0.90423138 1.0 Pr Pr13 1 0.98925589 0.18574101 0.59580918 1.0 Pr Pr14 1 0.51054699 0.68604138 0.40375149 1.0 Pr Pr15 1 0.01083063 0.81438011 0.09618712 1.0 Pr Pr16 1 0.51054699 0.68604138 0.09624851 1.0 Pr Pr17 1 0.01083063 0.81438011 0.40381288 1.0 Pr Pr18 1 0.48925991 0.31402575 0.59576862 1.0 Pr Pr19 1 0.98925589 0.18574101 0.90419082 1.0 Sn Sn20 1 0.33482262 0.03601635 0.04066799 1.0 Sn Sn21 1 0.83455019 0.46333299 0.46011380 1.0 Sn Sn22 1 0.66526941 0.96368926 0.53942654 1.0 Sn Sn23 1 0.16538223 0.53619641 0.96061556 1.0 Sn Sn24 1 0.66526941 0.96368926 0.96057346 1.0 Sn Sn25 1 0.16538223 0.53619641 0.53938444 1.0 Sn Sn26 1 0.33482262 0.03601635 0.45933201 1.0 Sn Sn27 1 0.83455019 0.46333299 0.03988620 1.0 Sn Sn28 1 0.52924985 0.60465060 0.75000000 1.0 Sn Sn29 1 0.02930476 0.89527860 0.75000000 1.0 Sn Sn30 1 0.46994968 0.39455162 0.25000000 1.0 Sn Sn31 1 0.97268772 0.10259735 0.25000000 1.0 Sn Sn32 1 0.28077462 0.13852677 0.75000000 1.0 Sn Sn33 1 0.78069333 0.36138874 0.75000000 1.0 Sn Sn34 1 0.71730615 0.86268235 0.25000000 1.0 Sn Sn35 1 0.22073864 0.64072988 0.25000000 1.0