# generated using pymatgen data_Al11NO17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.65487936 _cell_length_b 5.65487936 _cell_length_c 23.02154200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999255 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al11NO17 _chemical_formula_sum 'Al22 N2 O34' _cell_volume 637.54634872 _cell_formula_units_Z 2 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 Al Al0 1 0.16733600 0.33467100 0.60619600 1.0 Al Al1 1 0.83266400 0.66532900 0.39380400 1.0 Al Al2 1 0.66532900 0.83266400 0.60619600 1.0 Al Al3 1 0.83266400 0.66532900 0.10619600 1.0 Al Al4 1 0.33467100 0.16733600 0.39380400 1.0 Al Al5 1 0.16733600 0.33467100 0.89380400 1.0 Al Al6 1 0.16733600 0.83266400 0.60619600 1.0 Al Al7 1 0.33467100 0.16733600 0.10619600 1.0 Al Al8 1 0.83266400 0.16733600 0.39380400 1.0 Al Al9 1 0.66532900 0.83266400 0.89380400 1.0 Al Al10 1 0.83266400 0.16733600 0.10619600 1.0 Al Al11 1 0.16733600 0.83266400 0.89380400 1.0 Al Al12 1 0.33333300 0.66666700 0.17471400 1.0 Al Al13 1 0.66666700 0.33333300 0.82528600 1.0 Al Al14 1 0.66666700 0.33333300 0.67471400 1.0 Al Al15 1 0.33333300 0.66666700 0.32528600 1.0 Al Al16 1 0.33333300 0.66666700 0.02458700 1.0 Al Al17 1 0.66666700 0.33333300 0.97541300 1.0 Al Al18 1 0.66666700 0.33333300 0.52458700 1.0 Al Al19 1 0.33333300 0.66666700 0.47541300 1.0 Al Al20 1 0.00000000 0.00000000 0.00000000 1.0 Al Al21 1 0.00000000 0.00000000 0.50000000 1.0 N N22 1 0.33333300 0.66666700 0.75000000 1.0 N N23 1 0.66666700 0.33333300 0.25000000 1.0 O O24 1 0.50013700 0.00027500 0.14353800 1.0 O O25 1 0.49986300 0.99972500 0.85646200 1.0 O O26 1 0.99972500 0.49986300 0.14353800 1.0 O O27 1 0.49986300 0.99972500 0.64353800 1.0 O O28 1 0.00027500 0.50013700 0.85646200 1.0 O O29 1 0.50013700 0.00027500 0.35646200 1.0 O O30 1 0.50013700 0.49986300 0.14353800 1.0 O O31 1 0.00027500 0.50013700 0.64353800 1.0 O O32 1 0.49986300 0.50013700 0.85646200 1.0 O O33 1 0.99972500 0.49986300 0.35646200 1.0 O O34 1 0.49986300 0.50013700 0.64353800 1.0 O O35 1 0.50013700 0.49986300 0.35646200 1.0 O O36 1 0.15715100 0.31430300 0.04913000 1.0 O O37 1 0.84284900 0.68569700 0.95087000 1.0 O O38 1 0.68569700 0.84284900 0.04913000 1.0 O O39 1 0.84284900 0.68569700 0.54913000 1.0 O O40 1 0.31430300 0.15715100 0.95087000 1.0 O O41 1 0.15715100 0.31430300 0.45087000 1.0 O O42 1 0.15715100 0.84284900 0.04913000 1.0 O O43 1 0.31430300 0.15715100 0.54913000 1.0 O O44 1 0.84284900 0.15715100 0.95087000 1.0 O O45 1 0.68569700 0.84284900 0.45087000 1.0 O O46 1 0.84284900 0.15715100 0.54913000 1.0 O O47 1 0.15715100 0.84284900 0.45087000 1.0 O O48 1 0.33333300 0.66666700 0.55530100 1.0 O O49 1 0.66666700 0.33333300 0.44469900 1.0 O O50 1 0.66666700 0.33333300 0.05530100 1.0 O O51 1 0.33333300 0.66666700 0.94469900 1.0 O O52 1 0.33333300 0.66666700 0.25000000 1.0 O O53 1 0.66666700 0.33333300 0.75000000 1.0 O O54 1 0.00000000 0.00000000 0.13995100 1.0 O O55 1 0.00000000 0.00000000 0.86004900 1.0 O O56 1 0.00000000 0.00000000 0.63995100 1.0 O O57 1 0.00000000 0.00000000 0.36004900 1.0