# generated using pymatgen data_Nb8Al6Mo2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.81011820 _cell_length_b 7.81011740 _cell_length_c 5.19190097 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000337 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb8Al6Mo2C _chemical_formula_sum 'Nb8 Al6 Mo2 C1' _cell_volume 274.26613476 _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 0.66666700 0.33333300 0.00000000 1.0 Nb Nb1 1 0.33333300 0.66666700 0.00000000 1.0 Nb Nb2 1 1.00000000 0.76753429 0.24552895 1.0 Nb Nb3 1 0.23246571 0.23246571 0.24552895 1.0 Nb Nb4 1 0.76753429 0.00000000 0.24552895 1.0 Nb Nb5 1 0.00000000 0.23246571 0.75447105 1.0 Nb Nb6 1 0.76753429 0.76753429 0.75447105 1.0 Nb Nb7 1 0.23246571 0.00000000 0.75447105 1.0 Al Al8 1 0.00000000 0.40734943 0.26059284 1.0 Al Al9 1 0.59265057 0.59265057 0.26059284 1.0 Al Al10 1 0.40734943 0.00000000 0.26059284 1.0 Al Al11 1 1.00000000 0.59265057 0.73940716 1.0 Al Al12 1 0.40734943 0.40734943 0.73940716 1.0 Al Al13 1 0.59265057 0.00000000 0.73940716 1.0 Mo Mo14 1 0.33333300 0.66666700 0.50000000 1.0 Mo Mo15 1 0.66666700 0.33333300 0.50000000 1.0 C C16 1 0.00000000 0.00000000 0.50000000 1.0