# generated using pymatgen data_KMg2V3(CuO6)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.84162712 _cell_length_b 8.84162712 _cell_length_c 7.12368104 _cell_angle_alpha 74.55543641 _cell_angle_beta 74.55543641 _cell_angle_gamma 92.26893108 _symmetry_Int_Tables_number 1 _chemical_formula_structural KMg2V3(CuO6)2 _chemical_formula_sum 'K2 Mg4 V6 Cu4 O24' _cell_volume 513.72232364 _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 K K0 1 0.99319900 0.00680100 0.25000000 1.0 K K1 1 0.00680100 0.99319900 0.75000000 1.0 Mg Mg2 1 0.62698500 0.94737400 0.62194400 1.0 Mg Mg3 1 0.05262600 0.37301500 0.87805600 1.0 Mg Mg4 1 0.37301500 0.05262600 0.37805600 1.0 Mg Mg5 1 0.94737400 0.62698500 0.12194400 1.0 V V6 1 0.35604000 0.11412700 0.88130400 1.0 V V7 1 0.28363500 0.71636500 0.75000000 1.0 V V8 1 0.11412700 0.35604000 0.38130400 1.0 V V9 1 0.64396000 0.88587300 0.11869600 1.0 V V10 1 0.88587300 0.64396000 0.61869600 1.0 V V11 1 0.71636500 0.28363500 0.25000000 1.0 Cu Cu12 1 0.73416600 0.26583400 0.75000000 1.0 Cu Cu13 1 0.26583400 0.73416600 0.25000000 1.0 Cu Cu14 1 0.50681200 0.49318800 0.25000000 1.0 Cu Cu15 1 0.49318800 0.50681200 0.75000000 1.0 O O16 1 0.49987900 0.71872100 0.17647900 1.0 O O17 1 0.28127900 0.50012100 0.32352100 1.0 O O18 1 0.50012100 0.28127900 0.82352100 1.0 O O19 1 0.71872100 0.49987900 0.67647900 1.0 O O20 1 0.16885700 0.75388000 0.96665200 1.0 O O21 1 0.24612000 0.83114300 0.53334800 1.0 O O22 1 0.83114300 0.24612000 0.03334800 1.0 O O23 1 0.75388000 0.16885700 0.46665200 1.0 O O24 1 0.97002000 0.59483400 0.81942500 1.0 O O25 1 0.40516600 0.02998000 0.68057500 1.0 O O26 1 0.02998000 0.40516600 0.18057500 1.0 O O27 1 0.59483400 0.97002000 0.31942500 1.0 O O28 1 0.01983400 0.66886500 0.37450300 1.0 O O29 1 0.33113500 0.98016600 0.12549700 1.0 O O30 1 0.98016600 0.33113500 0.62549700 1.0 O O31 1 0.66886500 0.01983400 0.87450300 1.0 O O32 1 0.82269600 0.81809200 0.11099100 1.0 O O33 1 0.18190800 0.17730400 0.38900900 1.0 O O34 1 0.17730400 0.18190800 0.88900900 1.0 O O35 1 0.81809200 0.82269600 0.61099100 1.0 O O36 1 0.48957500 0.72921000 0.73219500 1.0 O O37 1 0.27079000 0.51042500 0.76780500 1.0 O O38 1 0.51042500 0.27079000 0.26780500 1.0 O O39 1 0.72921000 0.48957500 0.23219500 1.0