# generated using pymatgen data_V2Cu3Pb(ClO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62840009 _cell_length_b 8.62840009 _cell_length_c 8.62840009 _cell_angle_alpha 116.26499246 _cell_angle_beta 113.95290696 _cell_angle_gamma 98.71334240 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2Cu3Pb(ClO4)2 _chemical_formula_sum 'V4 Cu6 Pb2 Cl4 O16' _cell_volume 481.55495805 _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 0.04713900 0.79713900 0.25000000 1.0 V V1 1 0.45286100 0.20286100 0.25000000 1.0 V V2 1 0.95286100 0.20286100 0.75000000 1.0 V V3 1 0.54713900 0.79713900 0.75000000 1.0 Cu Cu4 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu5 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu6 1 0.67232500 0.92164400 0.24931900 1.0 Cu Cu7 1 0.32767500 0.07835600 0.75068100 1.0 Cu Cu8 1 0.82767500 0.57699400 0.74931900 1.0 Cu Cu9 1 0.17232500 0.42300600 0.25068100 1.0 Pb Pb10 1 0.75000000 0.50000000 0.25000000 1.0 Pb Pb11 1 0.25000000 0.50000000 0.75000000 1.0 Cl Cl12 1 0.41281200 0.59516800 0.18235600 1.0 Cl Cl13 1 0.58718800 0.40483200 0.81764400 1.0 Cl Cl14 1 0.08718800 0.76954300 0.68235600 1.0 Cl Cl15 1 0.91281200 0.23045700 0.31764400 1.0 O O16 1 0.52475300 0.99146700 0.73295000 1.0 O O17 1 0.74148300 0.00853300 0.53328600 1.0 O O18 1 0.97524700 0.20819700 0.96671400 1.0 O O19 1 0.75851700 0.79180300 0.76705000 1.0 O O20 1 0.47524700 0.00853300 0.26705000 1.0 O O21 1 0.25851700 0.99146700 0.46671400 1.0 O O22 1 0.02475300 0.79180300 0.03328600 1.0 O O23 1 0.24148300 0.20819700 0.23295000 1.0 O O24 1 0.45261900 0.18198000 0.04143100 1.0 O O25 1 0.85945100 0.81802000 0.27064000 1.0 O O26 1 0.04738100 0.58881200 0.22936000 1.0 O O27 1 0.64054900 0.41118800 0.45856900 1.0 O O28 1 0.54738100 0.81802000 0.95856900 1.0 O O29 1 0.14054900 0.18198000 0.72936000 1.0 O O30 1 0.95261900 0.41118800 0.77064000 1.0 O O31 1 0.35945100 0.58881200 0.54143100 1.0