# generated using pymatgen data_Cr6Cd(CuO6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.38425005 _cell_length_b 13.38425005 _cell_length_c 13.38425005 _cell_angle_alpha 153.60536559 _cell_angle_beta 153.60536559 _cell_angle_gamma 37.67345282 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr6Cd(CuO6)2 _chemical_formula_sum 'Cr12 Cd2 Cu4 O24' _cell_volume 473.11669297 _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 Cr Cr0 1 0.70785900 0.95737600 0.24951700 1.0 Cr Cr1 1 0.03955300 0.29283600 0.25328300 1.0 Cr Cr2 1 0.37729900 0.62416000 0.24686100 1.0 Cr Cr3 1 0.37729900 0.13043700 0.75313900 1.0 Cr Cr4 1 0.70785900 0.45834200 0.75048300 1.0 Cr Cr5 1 0.03955300 0.78627000 0.74671700 1.0 Cr Cr6 1 0.54165800 0.29214100 0.24951700 1.0 Cr Cr7 1 0.86956300 0.62270100 0.24686100 1.0 Cr Cr8 1 0.21373000 0.96044700 0.25328300 1.0 Cr Cr9 1 0.70716400 0.96044700 0.74671700 1.0 Cr Cr10 1 0.04262400 0.29214100 0.75048300 1.0 Cr Cr11 1 0.37584000 0.62270100 0.75313900 1.0 Cd Cd12 1 0.83524500 0.83524500 0.00000000 1.0 Cd Cd13 1 0.16475500 0.16475500 0.00000000 1.0 Cu Cu14 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu15 1 0.91814600 0.41814600 0.50000000 1.0 Cu Cu16 1 0.25000000 0.75000000 0.50000000 1.0 Cu Cu17 1 0.58185400 0.08185400 0.50000000 1.0 O O18 1 0.59177400 0.88260800 0.70916600 1.0 O O19 1 0.92638200 0.21343700 0.71294400 1.0 O O20 1 0.26489700 0.54233100 0.72256600 1.0 O O21 1 0.59457700 0.37307400 0.22150300 1.0 O O22 1 0.92698900 0.70370500 0.22328400 1.0 O O23 1 0.25797400 0.03967400 0.21829900 1.0 O O24 1 0.50049300 0.21343700 0.28705600 1.0 O O25 1 0.81976500 0.54233100 0.27743400 1.0 O O26 1 0.17344200 0.88260800 0.29083400 1.0 O O27 1 0.15157100 0.37307400 0.77849700 1.0 O O28 1 0.48042000 0.70370500 0.77671600 1.0 O O29 1 0.82137500 0.03967400 0.78170100 1.0 O O30 1 0.78656300 0.07361800 0.28705600 1.0 O O31 1 0.11739200 0.40822600 0.29083400 1.0 O O32 1 0.45766900 0.73510300 0.27743400 1.0 O O33 1 0.29629500 0.51958000 0.22328400 1.0 O O34 1 0.62692600 0.84842900 0.22150300 1.0 O O35 1 0.96032600 0.17862500 0.21829900 1.0 O O36 1 0.45766900 0.18023500 0.72256600 1.0 O O37 1 0.78656300 0.49950700 0.71294400 1.0 O O38 1 0.11739200 0.82655800 0.70916600 1.0 O O39 1 0.29629500 0.07301100 0.77671600 1.0 O O40 1 0.62692600 0.40542300 0.77849700 1.0 O O41 1 0.96032600 0.74202600 0.78170100 1.0