# generated using pymatgen data_SmPa(Be11Cu2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.37857774 _cell_length_b 7.36176534 _cell_length_c 7.33624539 _cell_angle_alpha 60.26609469 _cell_angle_beta 60.03833742 _cell_angle_gamma 59.69556470 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmPa(Be11Cu2)2 _chemical_formula_sum 'Sm1 Pa1 Be22 Cu4' _cell_volume 281.76800044 _cell_formula_units_Z 1 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 Sm Sm0 1 0.75000000 0.75000000 0.75000000 1.0 Pa Pa1 1 0.25000000 0.25000000 0.25000000 1.0 Be Be2 1 0.00000000 0.00000000 0.00000000 1.0 Be Be3 1 0.50000000 0.50000000 0.50000000 1.0 Be Be4 1 0.93657975 0.29243287 0.06658470 1.0 Be Be5 1 0.21238561 0.43784938 0.78961885 1.0 Be Be6 1 0.06658470 0.70440269 0.93657975 1.0 Be Be7 1 0.78961885 0.56014617 0.21238561 1.0 Be Be8 1 0.70440269 0.06658470 0.29243287 1.0 Be Be9 1 0.43784938 0.21238561 0.56014617 1.0 Be Be10 1 0.29243287 0.93657975 0.70440269 1.0 Be Be11 1 0.56014617 0.78961885 0.43784938 1.0 Be Be12 1 0.06054706 0.94226097 0.29700998 1.0 Be Be13 1 0.56584872 0.21905268 0.78255411 1.0 Be Be14 1 0.94226097 0.06054706 0.70018199 1.0 Be Be15 1 0.43254348 0.78255411 0.21905268 1.0 Be Be16 1 0.70018199 0.29700998 0.94226097 1.0 Be Be17 1 0.21905268 0.56584872 0.43254348 1.0 Be Be18 1 0.29700998 0.70018199 0.06054706 1.0 Be Be19 1 0.78255411 0.43254348 0.56584872 1.0 Be Be20 1 0.78862430 0.21571906 0.43339518 1.0 Be Be21 1 0.21571906 0.78862430 0.56226145 1.0 Be Be22 1 0.56226145 0.43339518 0.21571906 1.0 Be Be23 1 0.43339518 0.56226145 0.78862430 1.0 Cu Cu24 1 0.30168961 0.05786994 0.94438273 1.0 Cu Cu25 1 0.69605672 0.94438273 0.05786994 1.0 Cu Cu26 1 0.05786994 0.30168961 0.69605672 1.0 Cu Cu27 1 0.94438273 0.69605672 0.30168961 1.0