# generated using pymatgen data_Nb12Al9Zn13Ni2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.75556070 _cell_length_b 8.75555925 _cell_length_c 8.07808622 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99998700 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb12Al9Zn13Ni2 _chemical_formula_sum 'Nb12 Al9 Zn13 Ni2' _cell_volume 536.29904983 _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 0.33097037 0.99993036 0.06699929 1.0 Nb Nb1 1 0.66895998 0.99993036 0.93300071 1.0 Nb Nb2 1 0.00006964 0.33104002 0.06699929 1.0 Nb Nb3 1 0.67008581 0.00069871 0.56737702 1.0 Nb Nb4 1 0.99930129 0.32991419 0.43262298 1.0 Nb Nb5 1 0.00006964 0.66902963 0.93300071 1.0 Nb Nb6 1 0.33061291 0.00069871 0.43262298 1.0 Nb Nb7 1 0.99930129 0.66938709 0.56737702 1.0 Nb Nb8 1 0.66895998 0.66902963 0.06699929 1.0 Nb Nb9 1 0.33097037 0.33104002 0.93300071 1.0 Nb Nb10 1 0.33061291 0.32991419 0.56737702 1.0 Nb Nb11 1 0.67008581 0.66938709 0.43262298 1.0 Al Al12 1 0.66666700 0.33333300 0.50000000 1.0 Al Al13 1 0.66666700 0.33333300 0.00000000 1.0 Al Al14 1 0.33333300 0.66666700 0.00000000 1.0 Al Al15 1 0.16974508 0.99958675 0.75025217 1.0 Al Al16 1 0.82984267 0.99958675 0.24974783 1.0 Al Al17 1 0.00041325 0.17015733 0.75025217 1.0 Al Al18 1 0.00041325 0.83025492 0.24974783 1.0 Al Al19 1 0.82984267 0.83025492 0.75025217 1.0 Al Al20 1 0.16974508 0.17015733 0.24974783 1.0 Zn Zn21 1 0.16148743 0.49582155 0.74699906 1.0 Zn Zn22 1 0.84025113 0.50532049 0.24993722 1.0 Zn Zn23 1 0.50417845 0.66566589 0.74699906 1.0 Zn Zn24 1 0.49467951 0.15974887 0.75006278 1.0 Zn Zn25 1 0.49467951 0.33493065 0.24993722 1.0 Zn Zn26 1 0.50417845 0.83851257 0.25300094 1.0 Zn Zn27 1 0.33433411 0.83851257 0.74699906 1.0 Zn Zn28 1 0.66506935 0.50532049 0.75006278 1.0 Zn Zn29 1 0.66506935 0.15974887 0.24993722 1.0 Zn Zn30 1 0.33433411 0.49582155 0.25300094 1.0 Zn Zn31 1 0.84025113 0.33493065 0.75006278 1.0 Zn Zn32 1 0.16148743 0.66566589 0.25300094 1.0 Zn Zn33 1 0.33333300 0.66666700 0.50000000 1.0 Ni Ni34 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni35 1 0.00000000 0.00000000 0.00000000 1.0