# generated using pymatgen data_CdP3NO9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.89842363 _cell_length_b 6.89842363 _cell_length_c 10.62175500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999643 _symmetry_Int_Tables_number 1 _chemical_formula_structural CdP3NO9 _chemical_formula_sum 'Cd2 P6 N2 O18' _cell_volume 437.75049748 _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 Cd Cd0 1 0.00000000 0.00000000 0.00000000 1.0 Cd Cd1 1 0.00000000 0.00000000 0.50000000 1.0 P P2 1 0.71693100 0.11160700 0.25000000 1.0 P P3 1 0.88839300 0.60532400 0.25000000 1.0 P P4 1 0.71693100 0.60532400 0.75000000 1.0 P P5 1 0.39467600 0.28306900 0.25000000 1.0 P P6 1 0.88839300 0.28306900 0.75000000 1.0 P P7 1 0.39467600 0.11160700 0.75000000 1.0 N N8 1 0.33333300 0.66666700 0.00000000 1.0 N N9 1 0.33333300 0.66666700 0.50000000 1.0 O O10 1 0.27378100 0.26235000 0.12871500 1.0 O O11 1 0.73765000 0.01143100 0.12871500 1.0 O O12 1 0.27378100 0.26235000 0.37128500 1.0 O O13 1 0.27378100 0.01143100 0.62871500 1.0 O O14 1 0.98856900 0.72621900 0.12871500 1.0 O O15 1 0.73765000 0.01143100 0.37128500 1.0 O O16 1 0.73765000 0.72621900 0.62871500 1.0 O O17 1 0.27378100 0.01143100 0.87128500 1.0 O O18 1 0.98856900 0.72621900 0.37128500 1.0 O O19 1 0.73765000 0.72621900 0.87128500 1.0 O O20 1 0.98856900 0.26235000 0.62871500 1.0 O O21 1 0.98856900 0.26235000 0.87128500 1.0 O O22 1 0.48045400 0.10308000 0.25000000 1.0 O O23 1 0.89692000 0.37737400 0.25000000 1.0 O O24 1 0.48045400 0.37737400 0.75000000 1.0 O O25 1 0.62262600 0.51954600 0.25000000 1.0 O O26 1 0.89692000 0.51954600 0.75000000 1.0 O O27 1 0.62262600 0.10308000 0.75000000 1.0