# generated using pymatgen data_NbAgO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43486351 _cell_length_b 5.43486351 _cell_length_c 12.00427800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 92.24933355 _symmetry_Int_Tables_number 1 _chemical_formula_structural NbAgO2 _chemical_formula_sum 'Nb6 Ag6 O12' _cell_volume 354.30605286 _cell_formula_units_Z 6 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 0.50000000 0.00000000 1.0 Nb Nb1 1 0.00000000 0.50000000 0.66706800 1.0 Nb Nb2 1 0.50000000 0.00000000 0.66706800 1.0 Nb Nb3 1 0.00000000 0.50000000 0.33293200 1.0 Nb Nb4 1 0.50000000 0.00000000 0.33293200 1.0 Nb Nb5 1 0.50000000 0.00000000 0.00000000 1.0 Ag Ag6 1 0.50000000 0.50000000 0.88518900 1.0 Ag Ag7 1 0.00000000 0.00000000 0.77919200 1.0 Ag Ag8 1 0.50000000 0.50000000 0.50000000 1.0 Ag Ag9 1 0.00000000 0.00000000 0.50000000 1.0 Ag Ag10 1 0.50000000 0.50000000 0.11481100 1.0 Ag Ag11 1 0.00000000 0.00000000 0.22080800 1.0 O O12 1 0.00000000 0.50000000 0.83500400 1.0 O O13 1 0.50000000 0.00000000 0.83500400 1.0 O O14 1 0.69269500 0.69269500 0.67074300 1.0 O O15 1 0.30730500 0.30730500 0.67074300 1.0 O O16 1 0.00000000 0.50000000 0.50000000 1.0 O O17 1 0.50000000 0.00000000 0.50000000 1.0 O O18 1 0.69269500 0.69269500 0.32925700 1.0 O O19 1 0.30730500 0.30730500 0.32925700 1.0 O O20 1 0.00000000 0.50000000 0.16499600 1.0 O O21 1 0.50000000 0.00000000 0.16499600 1.0 O O22 1 0.82978600 0.17021400 0.00000000 1.0 O O23 1 0.17021400 0.82978600 0.00000000 1.0