# generated using pymatgen data_Ca3Tb9(PrSn2)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.05648492 _cell_length_b 8.35007387 _cell_length_c 15.85826595 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.74183470 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca3Tb9(PrSn2)8 _chemical_formula_sum 'Ca3 Tb9 Pr8 Sn16' _cell_volume 1066.81031005 _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 0.67868188 0.00203820 0.75000000 1.0 Ca Ca1 1 0.81975309 0.50266696 0.25000000 1.0 Ca Ca2 1 0.32088164 0.99929189 0.25000000 1.0 Tb Tb3 1 0.34820946 0.83047369 0.87496530 1.0 Tb Tb4 1 0.84486802 0.66946616 0.62359915 1.0 Tb Tb5 1 0.65244381 0.17250595 0.37637840 1.0 Tb Tb6 1 0.15308971 0.33120926 0.12139161 1.0 Tb Tb7 1 0.65244381 0.17250595 0.12362160 1.0 Tb Tb8 1 0.15308971 0.33120926 0.37860839 1.0 Tb Tb9 1 0.34820946 0.83047369 0.62503470 1.0 Tb Tb10 1 0.84486802 0.66946616 0.87640085 1.0 Tb Tb11 1 0.17769253 0.49904941 0.75000000 1.0 Pr Pr12 1 0.50465223 0.32034249 0.90243910 1.0 Pr Pr13 1 0.00019247 0.17959698 0.59581584 1.0 Pr Pr14 1 0.49827177 0.68028604 0.40361083 1.0 Pr Pr15 1 0.00076031 0.81701943 0.09509242 1.0 Pr Pr16 1 0.49827177 0.68028604 0.09638917 1.0 Pr Pr17 1 0.00076031 0.81701943 0.40490758 1.0 Pr Pr18 1 0.50465223 0.32034249 0.59756090 1.0 Pr Pr19 1 0.00019247 0.17959698 0.90418416 1.0 Sn Sn20 1 0.31903621 0.04021977 0.03671995 1.0 Sn Sn21 1 0.81234330 0.45963758 0.46252100 1.0 Sn Sn22 1 0.68052180 0.95878905 0.53669766 1.0 Sn Sn23 1 0.18688424 0.53889046 0.95830370 1.0 Sn Sn24 1 0.68052180 0.95878905 0.96330234 1.0 Sn Sn25 1 0.18688424 0.53889046 0.54169630 1.0 Sn Sn26 1 0.31903621 0.04021977 0.46328005 1.0 Sn Sn27 1 0.81234330 0.45963758 0.03747900 1.0 Sn Sn28 1 0.54478295 0.61417833 0.75000000 1.0 Sn Sn29 1 0.04586216 0.87449260 0.75000000 1.0 Sn Sn30 1 0.45011296 0.38276433 0.25000000 1.0 Sn Sn31 1 0.95286372 0.11996409 0.25000000 1.0 Sn Sn32 1 0.30050654 0.14170611 0.75000000 1.0 Sn Sn33 1 0.81343652 0.36557857 0.75000000 1.0 Sn Sn34 1 0.69782969 0.86736365 0.25000000 1.0 Sn Sn35 1 0.19505070 0.63403112 0.25000000 1.0