# generated using pymatgen data_Be3Tc4B5Mo8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.09346288 _cell_length_b 7.57352201 _cell_length_c 9.76381440 _cell_angle_alpha 90.18444472 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Be3Tc4B5Mo8 _chemical_formula_sum 'Be3 Tc4 B5 Mo8' _cell_volume 228.74945435 _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 Be Be0 1 0.50000000 0.12319118 0.46005815 1.0 Be Be1 1 0.50000000 0.87747189 0.53885434 1.0 Be Be2 1 0.00000000 0.38053459 0.96222513 1.0 Tc Tc3 1 0.50000000 0.62340336 0.39668437 1.0 Tc Tc4 1 0.50000000 0.37879965 0.60351093 1.0 Tc Tc5 1 0.00000000 0.87467386 0.89892020 1.0 Tc Tc6 1 0.00000000 0.12198642 0.10223532 1.0 B B7 1 0.00000000 0.61798155 0.04217749 1.0 B B8 1 0.50000000 0.12574137 0.25979137 1.0 B B9 1 0.50000000 0.87637650 0.73901393 1.0 B B10 1 0.00000000 0.37834606 0.76221135 1.0 B B11 1 0.00000000 0.62324190 0.23520296 1.0 Mo Mo12 1 0.50000000 0.81230664 0.13186977 1.0 Mo Mo13 1 0.50000000 0.18031975 0.86343633 1.0 Mo Mo14 1 0.00000000 0.67960510 0.63593934 1.0 Mo Mo15 1 0.00000000 0.32105485 0.36409173 1.0 Mo Mo16 1 0.50000000 0.58186047 0.86220270 1.0 Mo Mo17 1 0.50000000 0.42223901 0.14286010 1.0 Mo Mo18 1 0.00000000 0.91936293 0.35241945 1.0 Mo Mo19 1 0.00000000 0.08150191 0.64629503 1.0