# generated using pymatgen data_Nb9Ga6ReB2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.77391088 _cell_length_b 7.77391122 _cell_length_c 5.29593704 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000280 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb9Ga6ReB2 _chemical_formula_sum 'Nb9 Ga6 Re1 B2' _cell_volume 277.17404963 _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 Nb Nb0 1 0.24396827 0.00165679 0.25269838 1.0 Nb Nb1 1 0.75768852 0.00165679 0.74730162 1.0 Nb Nb2 1 0.99834321 0.24231148 0.25269838 1.0 Nb Nb3 1 0.99834321 0.75603173 0.74730162 1.0 Nb Nb4 1 0.75768852 0.75603173 0.25269838 1.0 Nb Nb5 1 0.24396827 0.24231148 0.74730162 1.0 Nb Nb6 1 0.66666700 0.33333300 0.00000000 1.0 Nb Nb7 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb8 1 0.33333300 0.66666700 0.50000000 1.0 Ga Ga9 1 0.59599558 0.99615328 0.24233854 1.0 Ga Ga10 1 0.40015770 0.99615328 0.75766146 1.0 Ga Ga11 1 0.00384672 0.59984230 0.24233854 1.0 Ga Ga12 1 0.00384672 0.40400442 0.75766146 1.0 Ga Ga13 1 0.40015770 0.40400442 0.24233854 1.0 Ga Ga14 1 0.59599558 0.59984230 0.75766146 1.0 Re Re15 1 0.33333300 0.66666700 0.00000000 1.0 B B16 1 0.00000000 0.00000000 0.00000000 1.0 B B17 1 0.00000000 0.00000000 0.50000000 1.0