# generated using pymatgen data_ThBe11Cu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.45301845 _cell_length_b 7.44008739 _cell_length_c 7.41122545 _cell_angle_alpha 60.24355071 _cell_angle_beta 60.07014584 _cell_angle_gamma 59.68629948 _symmetry_Int_Tables_number 1 _chemical_formula_structural ThBe11Cu2 _chemical_formula_sum 'Th2 Be22 Cu4' _cell_volume 290.57869693 _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 Th Th0 1 0.25000000 0.25000000 0.25000000 1.0 Th Th1 1 0.75000000 0.75000000 0.75000000 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 0.93298190 0.29016025 0.06701810 1.0 Be Be5 1 0.21310021 0.43914715 0.78689979 1.0 Be Be6 1 0.06701810 0.70983975 0.93298190 1.0 Be Be7 1 0.78689979 0.56085285 0.21310021 1.0 Be Be8 1 0.70983975 0.06701810 0.29016025 1.0 Be Be9 1 0.43914715 0.21310021 0.56085285 1.0 Be Be10 1 0.29016025 0.93298190 0.70983975 1.0 Be Be11 1 0.56085285 0.78689979 0.43914715 1.0 Be Be12 1 0.05951208 0.94048792 0.29547264 1.0 Be Be13 1 0.56698900 0.21912045 0.78087955 1.0 Be Be14 1 0.94048792 0.05951208 0.70452736 1.0 Be Be15 1 0.43301100 0.78087955 0.21912045 1.0 Be Be16 1 0.70452736 0.29547264 0.94048792 1.0 Be Be17 1 0.21912045 0.56698900 0.43301100 1.0 Be Be18 1 0.29547264 0.70452736 0.05951208 1.0 Be Be19 1 0.78087955 0.43301100 0.56698900 1.0 Be Be20 1 0.78474703 0.21525297 0.43619159 1.0 Be Be21 1 0.21525297 0.78474703 0.56380841 1.0 Be Be22 1 0.56380841 0.43619159 0.21525297 1.0 Be Be23 1 0.43619159 0.56380841 0.78474703 1.0 Cu Cu24 1 0.30110356 0.05784005 0.94215995 1.0 Cu Cu25 1 0.69889644 0.94215995 0.05784005 1.0 Cu Cu26 1 0.05784005 0.30110356 0.69889644 1.0 Cu Cu27 1 0.94215995 0.69889644 0.30110356 1.0