# generated using pymatgen data_YbSc2(CO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.00094518 _cell_length_b 9.74817382 _cell_length_c 7.79228359 _cell_angle_alpha 89.93504578 _cell_angle_beta 105.98303306 _cell_angle_gamma 89.34067001 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbSc2(CO3)4 _chemical_formula_sum 'Yb2 Sc4 C8 O24' _cell_volume 438.18051647 _cell_formula_units_Z 2 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 Yb Yb0 1 0.50001082 0.25000393 0.50000298 1.0 Yb Yb1 1 0.50001937 0.74999292 0.50000937 1.0 Sc Sc2 1 0.50000009 0.75000300 0.00000723 1.0 Sc Sc3 1 0.50000148 0.24999514 0.99999543 1.0 Sc Sc4 1 0.00000374 0.00000400 0.49999328 1.0 Sc Sc5 1 0.99999690 0.50000122 0.50000232 1.0 C C6 1 0.01063518 0.24952975 0.73492704 1.0 C C7 1 0.01062588 0.74953532 0.73492509 1.0 C C8 1 0.98936870 0.25047416 0.26507172 1.0 C C9 1 0.98936649 0.75047351 0.26507665 1.0 C C10 1 0.51094000 0.00040689 0.24393595 1.0 C C11 1 0.51093278 0.50040332 0.24393231 1.0 C C12 1 0.48905937 0.49959067 0.75606857 1.0 C C13 1 0.48906513 0.99958705 0.75606007 1.0 O O14 1 0.35770524 0.44682374 0.60890703 1.0 O O15 1 0.35770946 0.94681856 0.60889859 1.0 O O16 1 0.64229513 0.05318033 0.39109403 1.0 O O17 1 0.64228393 0.55317032 0.39109680 1.0 O O18 1 0.60046453 0.42175839 0.88042779 1.0 O O19 1 0.60046840 0.92175653 0.88042304 1.0 O O20 1 0.39953550 0.07823252 0.11956774 1.0 O O21 1 0.39953252 0.57823481 0.11957037 1.0 O O22 1 0.01571935 0.37995436 0.28666358 1.0 O O23 1 0.01571248 0.87995550 0.28665866 1.0 O O24 1 0.98428226 0.12004971 0.71333498 1.0 O O25 1 0.98425898 0.62005559 0.71332758 1.0 O O26 1 0.49731029 0.36785377 0.23417288 1.0 O O27 1 0.49731777 0.86785635 0.23418478 1.0 O O28 1 0.50269093 0.13213701 0.76581928 1.0 O O29 1 0.50268274 0.63213928 0.76583080 1.0 O O30 1 0.87421671 0.33031014 0.61433783 1.0 O O31 1 0.87421255 0.83031995 0.61433958 1.0 O O32 1 0.12578622 0.16969521 0.38566163 1.0 O O33 1 0.12578839 0.66969863 0.38567054 1.0 O O34 1 0.16105220 0.30122765 0.86471123 1.0 O O35 1 0.16104907 0.80122481 0.86471180 1.0 O O36 1 0.83895250 0.19877650 0.13528625 1.0 O O37 1 0.83894693 0.69877244 0.13529618 1.0