# generated using pymatgen data_V2Cu2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.54139874 _cell_length_b 5.54139874 _cell_length_c 10.12823275 _cell_angle_alpha 76.42006354 _cell_angle_beta 76.42006354 _cell_angle_gamma 91.85150406 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2Cu2O7 _chemical_formula_sum 'V4 Cu4 O14' _cell_volume 292.60111298 _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 V V0 1 0.44375771 0.00199074 0.71350062 1.0 V V1 1 0.99800926 0.55624229 0.78649938 1.0 V V2 1 0.55624229 0.99800926 0.28649938 1.0 V V3 1 0.00199074 0.44375771 0.21350062 1.0 Cu Cu4 1 0.23954237 0.38593103 0.48494144 1.0 Cu Cu5 1 0.61406897 0.76045763 0.01505856 1.0 Cu Cu6 1 0.76045763 0.61406897 0.51505856 1.0 Cu Cu7 1 0.38593103 0.23954237 0.98494144 1.0 O O8 1 0.86920164 0.13079836 0.25000000 1.0 O O9 1 0.13079836 0.86920164 0.75000000 1.0 O O10 1 0.36708724 0.17899499 0.36430849 1.0 O O11 1 0.82100501 0.63291276 0.13569151 1.0 O O12 1 0.63291276 0.82100501 0.63569151 1.0 O O13 1 0.17899499 0.36708724 0.86430849 1.0 O O14 1 0.46756464 0.28915086 0.60174763 1.0 O O15 1 0.71084914 0.53243536 0.89825237 1.0 O O16 1 0.53243536 0.71084914 0.39825237 1.0 O O17 1 0.28915086 0.46756464 0.10174763 1.0 O O18 1 0.48320659 0.98821539 0.12807442 1.0 O O19 1 0.01178461 0.51679341 0.37192558 1.0 O O20 1 0.51679341 0.01178461 0.87192558 1.0 O O21 1 0.98821539 0.48320659 0.62807442 1.0