# generated using pymatgen data_V2Cu2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.65393660 _cell_length_b 6.65393660 _cell_length_c 6.77189002 _cell_angle_alpha 74.41236441 _cell_angle_beta 74.41236441 _cell_angle_gamma 101.05465099 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2Cu2O7 _chemical_formula_sum 'V4 Cu4 O14' _cell_volume 266.68062353 _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 0.35533500 0.25371900 0.11788100 1.0 V V1 1 0.25371900 0.35533500 0.61788100 1.0 V V2 1 0.74628100 0.64466500 0.38211900 1.0 V V3 1 0.64466500 0.74628100 0.88211900 1.0 Cu Cu4 1 0.19987700 0.89304400 0.97736800 1.0 Cu Cu5 1 0.89304400 0.19987700 0.47736800 1.0 Cu Cu6 1 0.10695600 0.80012300 0.52263200 1.0 Cu Cu7 1 0.80012300 0.10695600 0.02263200 1.0 O O8 1 0.21724800 0.30842100 0.36694400 1.0 O O9 1 0.69157900 0.78275200 0.13305600 1.0 O O10 1 0.37585300 0.62869300 0.95456100 1.0 O O11 1 0.62869300 0.37585300 0.45456100 1.0 O O12 1 0.98067000 0.33077000 0.73272200 1.0 O O13 1 0.37130700 0.62414700 0.54543900 1.0 O O14 1 0.62414700 0.37130700 0.04543900 1.0 O O15 1 0.30842100 0.21724800 0.86694400 1.0 O O16 1 0.78275200 0.69157900 0.63305600 1.0 O O17 1 0.91191000 0.08809000 0.25000000 1.0 O O18 1 0.33077000 0.98067000 0.23272200 1.0 O O19 1 0.66923000 0.01933000 0.76727800 1.0 O O20 1 0.08809000 0.91191000 0.75000000 1.0 O O21 1 0.01933000 0.66923000 0.26727800 1.0