# generated using pymatgen data_Ti3Be2Nb7Ge6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.77521982 _cell_length_b 7.77522012 _cell_length_c 5.29105419 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999874 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Be2Nb7Ge6 _chemical_formula_sum 'Ti3 Be2 Nb7 Ge6' _cell_volume 277.01176604 _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 Ti Ti0 1 0.66666700 0.33333300 0.50000000 1.0 Ti Ti1 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti2 1 0.33333300 0.66666700 0.00000000 1.0 Be Be3 1 0.00000000 0.00000000 0.50000000 1.0 Be Be4 1 0.00000000 0.00000000 0.00000000 1.0 Nb Nb5 1 0.66666700 0.33333300 0.00000000 1.0 Nb Nb6 1 0.74224757 0.74192916 0.24915254 1.0 Nb Nb7 1 0.25807084 0.00031840 0.24915254 1.0 Nb Nb8 1 0.99968160 0.25775243 0.24915254 1.0 Nb Nb9 1 0.25807084 0.25775243 0.75084746 1.0 Nb Nb10 1 0.74224757 0.00031840 0.75084746 1.0 Nb Nb11 1 0.99968160 0.74192916 0.75084746 1.0 Ge Ge12 1 0.39256107 0.39546780 0.25283192 1.0 Ge Ge13 1 0.60453220 0.99709427 0.25283192 1.0 Ge Ge14 1 0.00290573 0.60743893 0.25283192 1.0 Ge Ge15 1 0.60453220 0.60743893 0.74716808 1.0 Ge Ge16 1 0.39256107 0.99709427 0.74716808 1.0 Ge Ge17 1 0.00290573 0.39546780 0.74716808 1.0