data_global _amcsd_formula_title 'F3 K N O3 Sb' loop_ _publ_author_name 'Bourgault M' 'Ducourant M' 'Mascherpa Corral D' 'Fourcade R' _journal_name_full 'Journal of Fluorine Chemistry' _journal_volume 17 _journal_year 1981 _journal_page_first 215 _journal_page_last 224 _publ_section_title ; Structure cristalline et moleculaire de K Sb F3 N O3 _cod_database_code 1008059 ; _database_code_amcsd 0016001 _chemical_formula_sum 'Sb K F3 O3 N' _cell_length_a 7.911 _cell_length_b 7.861 _cell_length_c 18.092 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1125.112 _exptl_crystal_density_diffrn 3.304 _symmetry_space_group_name_H-M 'P b c a' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,1/2-y,1/2+z' '-x,1/2+y,1/2-z' '1/2-x,1/2+y,z' '1/2+x,1/2-y,-z' '1/2+x,y,1/2-z' '1/2-x,-y,1/2+z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Sb1 0.55298 0.07074 0.39221 K1 0.42610 0.57070 0.31600 F1 0.46400 -0.08830 0.31750 F2 0.41240 0.23110 0.34000 F3 0.72830 0.11500 0.32020 O1 0.73300 0.47300 0.53900 O2 0.53100 0.28900 0.53210 O3 0.67800 0.34800 0.43590 N1 0.64900 0.36900 0.50330 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Sb1 0.02710 0.02130 0.02420 0.00030 0.00100 -0.00380 K1 0.04000 0.02500 0.03100 0.00050 0.00720 0.00580 F1 0.07500 0.03000 0.03600 -0.02600 0.00400 0.00600 F2 0.04100 0.03000 0.06000 -0.00300 0.03800 -0.02400 F3 0.04200 0.04500 0.04100 -0.00800 -0.02300 -0.00900 O1 0.03800 0.04100 0.04300 -0.01200 0.00900 0.01700 O2 0.05300 0.03400 0.04500 -0.01900 -0.03500 -0.00300 O3 0.04700 0.04400 0.02800 -0.03200 -0.01600 0.01300 N1 0.02500 0.02300 0.03300 -0.00600 0.00040 -0.00300