# generated using pymatgen data_Zr6Nb4Ga6C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.99028920 _cell_length_b 7.99028790 _cell_length_c 5.49340024 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999326 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Nb4Ga6C _chemical_formula_sum 'Zr6 Nb4 Ga6 C1' _cell_volume 303.73639194 _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 Zr Zr0 1 0.00000000 0.75933762 0.25824521 1.0 Zr Zr1 1 0.24066238 0.24066238 0.25824521 1.0 Zr Zr2 1 0.75933762 0.00000000 0.25824521 1.0 Zr Zr3 1 1.00000000 0.24066238 0.74175479 1.0 Zr Zr4 1 0.75933762 0.75933762 0.74175479 1.0 Zr Zr5 1 0.24066238 1.00000000 0.74175479 1.0 Nb Nb6 1 0.33333300 0.66666700 0.00000000 1.0 Nb Nb7 1 0.66666700 0.33333300 0.00000000 1.0 Nb Nb8 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb9 1 0.33333300 0.66666700 0.50000000 1.0 Ga Ga10 1 1.00000000 0.40205031 0.24521889 1.0 Ga Ga11 1 0.59794969 0.59794969 0.24521889 1.0 Ga Ga12 1 0.40205031 1.00000000 0.24521889 1.0 Ga Ga13 1 0.00000000 0.59794969 0.75478111 1.0 Ga Ga14 1 0.40205031 0.40205031 0.75478111 1.0 Ga Ga15 1 0.59794969 0.00000000 0.75478111 1.0 C C16 1 0.00000000 0.00000000 0.50000000 1.0