# generated using pymatgen data_Nd(BeB14)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.22725750 _cell_length_b 7.22725747 _cell_length_c 5.72471446 _cell_angle_alpha 66.80391322 _cell_angle_beta 66.80391499 _cell_angle_gamma 92.26905635 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd(BeB14)2 _chemical_formula_sum 'Nd1 Be2 B28' _cell_volume 245.82794891 _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 Nd Nd0 1 0.88663254 0.88663254 0.36942881 1.0 Be Be1 1 0.52305940 0.52305940 0.45887188 1.0 Be Be2 1 0.25941838 0.25941838 0.28774887 1.0 B B3 1 0.41746123 0.73267590 0.18270377 1.0 B B4 1 0.57578693 0.25318035 0.83938941 1.0 B B5 1 0.25318035 0.57578693 0.83938941 1.0 B B6 1 0.73267590 0.41746123 0.18270377 1.0 B B7 1 0.69354666 0.86036905 0.97970306 1.0 B B8 1 0.30233378 0.12754612 0.04027169 1.0 B B9 1 0.12754612 0.30233378 0.04027169 1.0 B B10 1 0.86036905 0.69354666 0.97970306 1.0 B B11 1 0.52732814 0.86859555 0.30990827 1.0 B B12 1 0.46643832 0.11702183 0.22101658 1.0 B B13 1 0.11702183 0.46643832 0.22101658 1.0 B B14 1 0.86859555 0.52732814 0.30990827 1.0 B B15 1 0.45961502 0.11582179 0.71738055 1.0 B B16 1 0.52792703 0.86614181 0.80623265 1.0 B B17 1 0.86614181 0.52792703 0.80623265 1.0 B B18 1 0.11582179 0.45961502 0.71738055 1.0 B B19 1 0.71738967 0.09966070 0.00718410 1.0 B B20 1 0.27732379 0.88811265 0.33681570 1.0 B B21 1 0.88811265 0.27732379 0.33681570 1.0 B B22 1 0.09966070 0.71738967 0.00718410 1.0 B B23 1 0.27662664 0.88861198 0.01298080 1.0 B B24 1 0.71487645 0.09806846 0.69090526 1.0 B B25 1 0.09806846 0.71487645 0.69090526 1.0 B B26 1 0.88861198 0.27662664 0.01298080 1.0 B B27 1 0.28315440 0.46684529 0.39004212 1.0 B B28 1 0.69514744 0.51328471 0.65743775 1.0 B B29 1 0.51328471 0.69514744 0.65743775 1.0 B B30 1 0.46684529 0.28315440 0.39004212 1.0