# generated using pymatgen data_Nb(Cl2O)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.52812300 _cell_length_b 6.46768164 _cell_length_c 7.69049590 _cell_angle_alpha 102.87918615 _cell_angle_beta 103.70218710 _cell_angle_gamma 107.39975267 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb(Cl2O)2 _chemical_formula_sum 'Nb1 Cl4 O2' _cell_volume 198.04739290 _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 0.10388900 0.28646700 0.82165300 1.0 Cl Cl1 1 0.34998200 0.30650200 0.57344800 1.0 Cl Cl2 1 0.72572400 0.36458600 0.00443900 1.0 Cl Cl3 1 0.45583500 0.80812800 0.11418400 1.0 Cl Cl4 1 0.52093900 0.70855500 0.34350100 1.0 O O5 1 0.83672900 0.31109700 0.60611300 1.0 O O6 1 0.96330200 0.99736400 0.79756100 1.0