# generated using pymatgen data_PaBe13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.22408681 _cell_length_b 7.22408681 _cell_length_c 7.22408681 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaBe13 _chemical_formula_sum 'Pa2 Be26' _cell_volume 266.58387120 _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 0.75000000 0.75000000 0.75000000 1.0 Pa Pa1 1 0.25000000 0.25000000 0.25000000 1.0 Be Be2 1 0.50000000 0.50000000 0.50000000 1.0 Be Be3 1 -0.00000000 0.00000000 0.00000000 1.0 Be Be4 1 0.79065652 0.43900520 0.20934348 1.0 Be Be5 1 0.20934348 0.56099480 0.79065652 1.0 Be Be6 1 0.56099480 0.20934348 0.43900520 1.0 Be Be7 1 0.43900520 0.79065652 0.56099480 1.0 Be Be8 1 0.29065652 0.06099480 0.70934348 1.0 Be Be9 1 0.70934348 0.93900520 0.29065652 1.0 Be Be10 1 0.93900520 0.70934348 0.06099480 1.0 Be Be11 1 0.06099480 0.29065652 0.93900520 1.0 Be Be12 1 0.43900520 0.20934348 0.79065652 1.0 Be Be13 1 0.56099480 0.79065652 0.20934348 1.0 Be Be14 1 0.20934348 0.43900520 0.56099480 1.0 Be Be15 1 0.79065652 0.56099480 0.43900520 1.0 Be Be16 1 0.06099480 0.70934348 0.29065652 1.0 Be Be17 1 0.93900520 0.29065652 0.70934348 1.0 Be Be18 1 0.70934348 0.06099480 0.93900520 1.0 Be Be19 1 0.29065652 0.93900520 0.06099480 1.0 Be Be20 1 0.20934348 0.79065652 0.43900520 1.0 Be Be21 1 0.79065652 0.20934348 0.56099480 1.0 Be Be22 1 0.43900520 0.56099480 0.20934348 1.0 Be Be23 1 0.56099480 0.43900520 0.79065652 1.0 Be Be24 1 0.70934348 0.29065652 0.06099480 1.0 Be Be25 1 0.29065652 0.70934348 0.93900520 1.0 Be Be26 1 0.06099480 0.93900520 0.70934348 1.0 Be Be27 1 0.93900520 0.06099480 0.29065652 1.0