# generated using pymatgen data_Cu3As2H2PbO10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.95821005 _cell_length_b 5.95821005 _cell_length_c 14.19515949 _cell_angle_alpha 76.09777546 _cell_angle_beta 76.09777546 _cell_angle_gamma 60.64786337 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu3As2H2PbO10 _chemical_formula_sum 'Cu6 As4 H4 Pb2 O20' _cell_volume 421.88038589 _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 Cu Cu0 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu1 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu2 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu3 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu4 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu5 1 0.00000000 0.00000000 0.50000000 1.0 As As6 1 0.49051500 0.90870600 0.14148000 1.0 As As7 1 0.90870600 0.49051500 0.64148000 1.0 As As8 1 0.09129400 0.50948500 0.35852000 1.0 As As9 1 0.50948500 0.09129400 0.85852000 1.0 H H10 1 0.40953400 0.85285700 0.35936200 1.0 H H11 1 0.85285700 0.40953400 0.85936200 1.0 H H12 1 0.14714300 0.59046600 0.14063800 1.0 H H13 1 0.59046600 0.14714300 0.64063800 1.0 Pb Pb14 1 0.73915100 0.26084900 0.25000000 1.0 Pb Pb15 1 0.26084900 0.73915100 0.75000000 1.0 O O16 1 0.36030000 0.85186000 0.43483000 1.0 O O17 1 0.54148900 0.76679900 0.25978600 1.0 O O18 1 0.82112800 0.90788900 0.87689700 1.0 O O19 1 0.64781500 0.62401200 0.08282600 1.0 O O20 1 0.08867200 0.66775400 0.59634600 1.0 O O21 1 0.37598800 0.35218500 0.41717400 1.0 O O22 1 0.90788900 0.82112800 0.37689700 1.0 O O23 1 0.33224600 0.91132800 0.90365400 1.0 O O24 1 0.85186000 0.36030000 0.93483000 1.0 O O25 1 0.76679900 0.54148900 0.75978600 1.0 O O26 1 0.23320100 0.45851100 0.24021400 1.0 O O27 1 0.14814000 0.63970000 0.06517000 1.0 O O28 1 0.66775400 0.08867200 0.09634600 1.0 O O29 1 0.09211100 0.17887200 0.62310300 1.0 O O30 1 0.62401200 0.64781500 0.58282600 1.0 O O31 1 0.91132800 0.33224600 0.40365400 1.0 O O32 1 0.35218500 0.37598800 0.91717400 1.0 O O33 1 0.17887200 0.09211100 0.12310300 1.0 O O34 1 0.45851100 0.23320100 0.74021400 1.0 O O35 1 0.63970000 0.14814000 0.56517000 1.0