# generated using pymatgen data_PaBe11Cu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.34283424 _cell_length_b 7.31331912 _cell_length_c 7.34527136 _cell_angle_alpha 60.12178383 _cell_angle_beta 59.72331664 _cell_angle_gamma 60.15491350 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaBe11Cu2 _chemical_formula_sum 'Pa2 Be22 Cu4' _cell_volume 278.90475480 _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 Pa Pa0 1 0.25000000 0.25000000 0.25000000 1.0 Pa Pa1 1 0.75000000 0.75000000 0.75000000 1.0 Be Be2 1 0.70384896 0.93689902 0.06310098 1.0 Be Be3 1 0.69765622 0.05572989 0.30234378 1.0 Be Be4 1 0.06310098 0.29615104 0.70384896 1.0 Be Be5 1 0.94427011 0.30234378 0.05572989 1.0 Be Be6 1 0.93689902 0.70384896 0.29615104 1.0 Be Be7 1 0.30234378 0.94427011 0.69765622 1.0 Be Be8 1 0.29615104 0.06310098 0.93689902 1.0 Be Be9 1 0.05572989 0.69765622 0.94427011 1.0 Be Be10 1 0.78808875 0.43967724 0.56032276 1.0 Be Be11 1 0.56032276 0.21191125 0.78808875 1.0 Be Be12 1 0.21191125 0.56032276 0.43967724 1.0 Be Be13 1 0.43967724 0.78808875 0.21191125 1.0 Be Be14 1 0.78135873 0.21864127 0.43444424 1.0 Be Be15 1 0.78693377 0.56278663 0.21306623 1.0 Be Be16 1 0.43444424 0.56555576 0.78135873 1.0 Be Be17 1 0.56278663 0.78693377 0.43721337 1.0 Be Be18 1 0.56555576 0.43444424 0.21864127 1.0 Be Be19 1 0.21306623 0.43721337 0.78693377 1.0 Be Be20 1 0.21864127 0.78135873 0.56555576 1.0 Be Be21 1 0.43721337 0.21306623 0.56278663 1.0 Be Be22 1 0.00000000 0.00000000 0.00000000 1.0 Be Be23 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu24 1 0.69612110 0.30387890 0.94521732 1.0 Cu Cu25 1 0.94521732 0.05478268 0.69612110 1.0 Cu Cu26 1 0.30387890 0.69612110 0.05478268 1.0 Cu Cu27 1 0.05478268 0.94521732 0.30387890 1.0