# generated using pymatgen data_NbGa3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.79543088 _cell_length_b 3.79542980 _cell_length_c 5.12436289 _cell_angle_alpha 111.73607739 _cell_angle_beta 111.73607725 _cell_angle_gamma 90.00002122 _symmetry_Int_Tables_number 1 _chemical_formula_structural NbGa3 _chemical_formula_sum 'Nb1 Ga3' _cell_volume 62.88442534 _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 0.00000000 0.00000000 -0.00000000 1.0 Ga Ga1 1 0.50000000 0.50000000 -0.00000000 1.0 Ga Ga2 1 0.25000000 0.75000000 0.50000000 1.0 Ga Ga3 1 0.75000000 0.25000000 0.50000000 1.0