# generated using pymatgen data_Ca11Tb8YbSn16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.89381114 _cell_length_b 8.45524939 _cell_length_c 16.08268116 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.99302885 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca11Tb8YbSn16 _chemical_formula_sum 'Ca11 Tb8 Yb1 Sn16' _cell_volume 1073.42474377 _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 0.50988055 0.68851366 0.59321189 1.0 Ca Ca1 1 0.00981538 0.81172299 0.90678566 1.0 Ca Ca2 1 0.49057167 0.31150958 0.09349681 1.0 Ca Ca3 1 0.98988195 0.18800291 0.40641370 1.0 Ca Ca4 1 0.49057167 0.31150958 0.40650319 1.0 Ca Ca5 1 0.98988195 0.18800291 0.09358630 1.0 Ca Ca6 1 0.50988055 0.68851366 0.90678811 1.0 Ca Ca7 1 0.00981538 0.81172299 0.59321434 1.0 Ca Ca8 1 0.84026114 0.51151907 0.75000000 1.0 Ca Ca9 1 0.34015334 0.98837523 0.75000000 1.0 Ca Ca10 1 0.15997727 0.48812443 0.25000000 1.0 Tb Tb11 1 0.67738269 0.16695266 0.62204619 1.0 Tb Tb12 1 0.17747718 0.33271822 0.87781320 1.0 Tb Tb13 1 0.32266084 0.83284278 0.12265847 1.0 Tb Tb14 1 0.82259993 0.66735234 0.37746776 1.0 Tb Tb15 1 0.32266084 0.83284278 0.37734153 1.0 Tb Tb16 1 0.82259993 0.66735234 0.12253224 1.0 Tb Tb17 1 0.67738269 0.16695266 0.87795381 1.0 Tb Tb18 1 0.17747718 0.33271822 0.62218680 1.0 Yb Yb19 1 0.65934634 0.01118111 0.25000000 1.0 Sn Sn20 1 0.66520201 0.96311697 0.45855651 1.0 Sn Sn21 1 0.16554168 0.53776154 0.04057640 1.0 Sn Sn22 1 0.33454688 0.03753936 0.95973386 1.0 Sn Sn23 1 0.83449490 0.46242267 0.54029397 1.0 Sn Sn24 1 0.33454688 0.03753936 0.54026614 1.0 Sn Sn25 1 0.83449490 0.46242267 0.95970603 1.0 Sn Sn26 1 0.66520201 0.96311697 0.04144349 1.0 Sn Sn27 1 0.16554168 0.53776154 0.45942360 1.0 Sn Sn28 1 0.47462471 0.37333157 0.75000000 1.0 Sn Sn29 1 0.97440096 0.12648736 0.75000000 1.0 Sn Sn30 1 0.52630567 0.62726393 0.25000000 1.0 Sn Sn31 1 0.02359207 0.87579937 0.25000000 1.0 Sn Sn32 1 0.72516806 0.87565434 0.75000000 1.0 Sn Sn33 1 0.22534602 0.62420998 0.75000000 1.0 Sn Sn34 1 0.27718247 0.12336606 0.25000000 1.0 Sn Sn35 1 0.77353060 0.37377820 0.25000000 1.0