#------------------------------------------------------------------------------ #$Date: 2021-04-27 08:02:32 +0300 (Tue, 27 Apr 2021) $ #$Revision: 264572 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/02/23/2022367.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2022367 loop_ _publ_author_name 'Bi, Wen-Yan' 'Wang, Wei' 'Zhang, Rui-Juan' _publ_section_title ; New red phosphor Na~3~EuB~8~O~15~ with an open-window tubular structure ; _journal_coeditor_code KY3203 _journal_issue 5 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first ; ; _journal_paper_doi 10.1107/S2053229621004071 _journal_volume 77 _journal_year 2021 _chemical_formula_iupac 'Na3 Eu B8 O15' _chemical_formula_moiety 'B8 Eu Na3 O15' _chemical_formula_sum 'B8 Eu Na3 O15' _chemical_formula_weight 547.41 _chemical_name_systematic ; Trisodium europium octaborate ; _space_group_crystal_system triclinic _space_group_IT_number 2 _space_group_name_Hall '-P 1' _space_group_name_H-M_alt 'P -1' _audit_creation_method SHELXL-2013 _cell_angle_alpha 90.5470(10) _cell_angle_beta 100.6670(10) _cell_angle_gamma 113.4890(10) _cell_formula_units_Z 2 _cell_length_a 6.2861(5) _cell_length_b 7.5366(6) _cell_length_c 13.4963(11) _cell_measurement_reflns_used 724 _cell_measurement_temperature 296(2) _cell_measurement_theta_max 24.01 _cell_measurement_theta_min 2.85 _cell_volume 573.81(8) _computing_cell_refinement ; SAINT (Bruker, 2013) ; _computing_data_collection ; APEX2 (Bruker, 2013) ; _computing_data_reduction ; SAINT (Bruker, 2013) ; _computing_molecular_graphics ; SHELXTL (Sheldrick, 2008) ; _computing_publication_material ; SHELXL2013 (Sheldrick, 2015b) and PLATON (Spek, 2020) ; _computing_structure_refinement ; SHELXL2013 (Sheldrick, 2015b) ; _computing_structure_solution ; SHELXS2013 (Sheldrick, 2015a) ; _diffrn_ambient_temperature 296(2) _diffrn_detector_area_resol_mean 83.33 _diffrn_measured_fraction_theta_full 0.999 _diffrn_measured_fraction_theta_max 0.988 _diffrn_measurement_device_type 'Bruker SMART APEXII CCD area detector' _diffrn_measurement_method '\w scans' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength 0.71073 _diffrn_reflns_av_R_equivalents 0.0316 _diffrn_reflns_av_unetI/netI 0.0404 _diffrn_reflns_limit_h_max 8 _diffrn_reflns_limit_h_min -8 _diffrn_reflns_limit_k_max 10 _diffrn_reflns_limit_k_min -10 _diffrn_reflns_limit_l_max 17 _diffrn_reflns_limit_l_min -17 _diffrn_reflns_number 7261 _diffrn_reflns_theta_full 25.242 _diffrn_reflns_theta_max 28.283 _diffrn_reflns_theta_min 2.960 _diffrn_source 'fine-focus sealed tube' _exptl_absorpt_coefficient_mu 5.677 _exptl_absorpt_correction_T_max 0.748 _exptl_absorpt_correction_T_min 0.307 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; (SADABS; Sheldrick, 2003) ; _exptl_crystal_colour colorless _exptl_crystal_density_diffrn 3.168 _exptl_crystal_description prism _exptl_crystal_F_000 512 _exptl_crystal_size_max 0.200 _exptl_crystal_size_mid 0.100 _exptl_crystal_size_min 0.100 _refine_diff_density_max 1.170 _refine_diff_density_min -0.918 _refine_ls_extinction_coef 0.0079(6) _refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^ _refine_ls_extinction_method ; SHELXL2013 (Sheldrick, 2015b) ; _refine_ls_goodness_of_fit_ref 1.065 _refine_ls_hydrogen_treatment undef _refine_ls_matrix_type full _refine_ls_number_parameters 245 _refine_ls_number_reflns 2807 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.065 _refine_ls_R_factor_all 0.0263 _refine_ls_R_factor_gt 0.0234 _refine_ls_shift/su_max 0.001 _refine_ls_shift/su_mean 0.000 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'w=1/[\s^2^(Fo^2^)+(0.0189P)^2^+1.0032P] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_gt 0.0534 _refine_ls_wR_factor_ref 0.0547 _reflns_number_gt 2599 _reflns_number_total 2807 _reflns_threshold_expression 'I > 2\s(I)' _cod_data_source_file ky3203sup1.cif _cod_data_source_block I _cod_database_code 2022367 _shelx_space_group_comment ; The symmetry employed for this shelxl refinement is uniquely defined by the following loop, which should always be used as a source of symmetry information in preference to the above space-group names. They are only intended as comments. ; _shelx_estimated_absorpt_t_min 0.396 _shelx_estimated_absorpt_t_max 0.601 _shelx_hkl_file ; -1 0 0 259.54 8.63 -1 0 0 263.18 8.77 1 0 0 262.50 8.39 1 0 0 253.09 8.44 -2 0 0 0.57 0.36 -2 0 0 0.73 0.33 2 0 0 -0.04 0.26 2 0 0 0.70 0.29 -3 0 0 53.79 2.83 -3 0 0 54.48 2.52 3 0 0 54.70 2.44 3 0 0 51.83 2.63 -4 0 0 82.98 4.32 -4 0 0 92.75 3.92 4 0 0 89.85 4.21 4 0 0 89.98 3.86 -5 0 0 92.70 4.82 5 0 0 88.81 4.55 -6 0 0 123.49 6.36 6 0 0 120.08 6.01 -7 0 0 58.65 4.32 7 0 0 61.41 4.32 7 -1 0 27.21 3.03 -7 1 0 30.42 3.45 6 -1 0 0.43 0.72 -6 1 0 -0.16 0.67 5 -1 0 67.04 3.59 -5 1 0 64.14 3.25 -5 1 0 63.53 3.67 4 -1 0 56.51 2.85 4 -1 0 58.18 2.98 -4 1 0 57.48 2.80 -4 1 0 59.20 3.15 3 -1 0 415.88 14.09 3 -1 0 418.79 14.09 -3 1 0 413.73 14.58 -3 1 0 432.44 14.33 2 -1 0 101.86 3.79 2 -1 0 106.84 3.89 -2 1 0 102.49 3.97 -2 1 0 103.27 3.86 1 -1 0 24.30 1.01 1 -1 0 22.48 1.15 -1 1 0 25.43 1.13 0 1 0 9.74 0.53 0 1 0 10.02 0.59 0 1 0 10.24 0.57 0 1 0 9.13 0.50 -1 -1 0 5.67 0.59 1 1 0 4.64 0.57 1 1 0 6.21 0.68 1 1 0 5.51 0.41 -2 -1 0 63.64 3.11 -2 -1 0 67.85 2.98 2 1 0 64.61 2.89 2 1 0 69.27 2.64 -3 -1 0 159.85 6.38 -3 -1 0 150.20 5.89 3 1 0 141.31 5.49 3 1 0 149.21 5.93 -4 -1 0 119.25 5.10 -4 -1 0 120.83 5.66 4 1 0 120.47 5.35 -5 -1 0 19.15 2.36 5 1 0 17.89 2.15 -6 -1 0 17.22 2.50 6 1 0 15.44 2.32 -7 -1 0 7.49 1.96 7 1 0 10.26 2.08 8 -2 0 3.71 1.57 -8 2 0 4.15 1.59 7 -2 0 35.66 2.95 -7 2 0 41.59 4.01 6 -2 0 323.49 12.27 -6 2 0 325.79 12.81 5 -2 0 182.17 7.24 5 -2 0 181.79 7.27 -5 2 0 178.75 7.60 -5 2 0 178.79 7.14 4 -2 0 48.18 2.62 4 -2 0 46.72 2.50 -4 2 0 50.45 2.77 -4 2 0 47.22 2.50 3 -2 0 34.24 1.95 3 -2 0 32.56 1.72 -3 2 0 32.76 1.89 -3 2 0 32.34 1.79 2 -2 0 497.28 16.41 2 -2 0 498.69 15.88 -2 2 0 486.64 16.52 1 -2 0 127.86 4.54 1 -2 0 135.97 4.93 -1 2 0 134.79 4.87 -1 2 0 136.65 4.90 0 2 0 486.74 16.06 0 2 0 486.45 15.50 0 2 0 471.80 16.09 0 2 0 488.10 15.63 -1 -2 0 117.40 4.51 1 2 0 116.41 4.33 1 2 0 114.54 4.07 1 2 0 114.19 4.54 -2 -2 0 17.95 1.30 2 2 0 16.48 1.38 2 2 0 15.22 1.24 2 2 0 17.77 0.98 -3 -2 0 7.86 1.24 -3 -2 0 6.92 1.30 3 2 0 3.06 0.80 -4 -2 0 0.52 0.64 4 2 0 0.89 0.70 -5 -2 0 104.71 5.75 5 2 0 104.83 5.42 -6 -2 0 106.27 6.29 6 2 0 112.41 6.06 7 -3 0 9.65 1.69 -7 3 0 6.80 1.57 6 -3 0 -0.93 0.62 6 -3 0 0.73 0.72 -6 3 0 -0.12 0.54 -6 3 0 1.66 0.73 5 -3 0 128.76 5.67 5 -3 0 129.39 5.35 -5 3 0 119.93 5.67 -5 3 0 125.52 5.45 4 -3 0 127.10 5.05 4 -3 0 134.12 5.57 -4 3 0 130.48 5.54 -4 3 0 127.93 5.34 3 -3 0 64.25 3.30 3 -3 0 70.53 2.84 -3 3 0 69.47 3.18 -3 3 0 72.56 3.31 2 -3 0 166.56 6.41 2 -3 0 167.92 5.68 -2 3 0 165.29 6.36 -2 3 0 169.86 6.27 1 -3 0 31.64 1.44 1 -3 0 31.51 1.81 -1 3 0 30.91 1.64 -1 3 0 31.41 1.72 0 3 0 6.87 0.87 0 3 0 7.81 0.81 0 3 0 6.96 0.74 0 3 0 7.48 0.87 -1 -3 0 4.24 0.76 1 3 0 3.49 0.69 1 3 0 5.10 0.65 1 3 0 5.01 0.76 -2 -3 0 253.70 9.60 2 3 0 255.75 9.37 2 3 0 263.54 8.83 2 3 0 259.85 9.84 -3 -3 0 74.00 4.18 -3 -3 0 65.59 3.64 3 3 0 70.81 3.67 -4 -3 0 131.12 6.65 4 3 0 133.16 6.14 -5 -3 0 20.52 2.69 5 3 0 22.25 2.63 -6 -3 0 2.53 1.32 6 3 0 1.03 1.24 6 -4 0 206.41 8.79 -6 4 0 218.78 9.13 -6 4 0 205.07 8.56 5 -4 0 41.64 2.41 5 -4 0 42.99 2.89 -5 4 0 48.82 3.04 -5 4 0 40.47 2.63 4 -4 0 1.83 0.77 4 -4 0 2.46 0.59 -4 4 0 2.00 0.63 -4 4 0 4.33 1.06 3 -4 0 9.71 1.38 3 -4 0 10.41 0.83 -3 4 0 10.48 1.37 -3 4 0 9.40 1.22 2 -4 0 13.58 1.52 2 -4 0 16.68 0.97 -2 4 0 12.40 1.34 -2 4 0 13.64 1.36 1 -4 0 329.41 10.91 1 -4 0 329.81 11.57 -1 4 0 333.42 11.61 -1 4 0 318.75 10.72 -1 4 0 317.99 11.44 0 -4 0 256.63 9.28 0 4 0 253.26 9.41 0 4 0 263.65 9.04 0 4 0 252.98 9.38 0 4 0 256.05 8.87 -1 -4 0 251.58 9.74 1 4 0 256.88 8.93 1 4 0 272.48 9.74 1 4 0 245.82 9.14 -2 -4 0 3.76 0.89 2 4 0 4.55 0.98 2 4 0 4.77 1.05 -3 -4 0 0.48 0.68 -3 -4 0 2.44 0.90 3 4 0 0.70 0.65 3 4 0 0.68 0.67 -4 -4 0 5.16 1.51 4 4 0 7.64 1.57 -5 -4 0 101.27 6.21 5 4 0 99.19 5.65 7 -5 0 15.40 2.35 6 -5 0 5.24 1.38 -6 5 0 9.24 1.62 5 -5 0 0.01 0.56 -5 5 0 1.10 0.73 -5 5 0 2.30 0.80 4 -5 0 375.30 13.00 -4 5 0 365.71 12.73 -4 5 0 285.00 12.52 3 -5 0 57.14 3.35 -3 5 0 55.93 3.13 -3 5 0 58.19 3.07 2 -5 0 175.11 7.28 2 -5 0 177.77 6.45 -2 5 0 171.95 7.11 -2 5 0 183.83 6.95 1 -5 0 92.94 4.36 -1 5 0 89.46 4.10 -1 5 0 93.94 4.24 -1 5 0 92.56 3.63 0 -5 0 11.45 1.41 0 5 0 12.65 1.30 0 5 0 9.10 1.30 0 5 0 10.30 1.38 -1 -5 0 0.07 0.47 1 5 0 0.36 0.51 1 5 0 0.17 0.42 -2 -5 0 168.82 7.26 2 5 0 164.68 6.88 2 5 0 161.50 7.32 -3 -5 0 153.92 7.65 3 5 0 146.19 6.80 3 5 0 154.52 7.24 -4 -5 0 60.81 4.54 4 5 0 58.14 3.94 8 -6 0 5.31 1.80 7 -6 0 83.11 5.27 -7 6 0 85.83 4.94 6 -6 0 69.77 4.41 -6 6 0 65.37 4.06 5 -6 0 112.08 5.78 -5 6 0 111.71 5.56 4 -6 0 1.16 0.75 -4 6 0 1.80 0.76 -4 6 0 2.49 0.85 3 -6 0 -0.09 0.59 -3 6 0 -0.14 0.40 -3 6 0 -0.19 0.46 2 -6 0 13.65 1.85 -2 6 0 13.59 1.67 -2 6 0 13.28 1.53 1 -6 0 173.64 7.27 -1 6 0 176.86 7.25 -1 6 0 169.66 7.03 0 -6 0 183.31 7.46 0 6 0 180.77 7.54 0 6 0 178.51 7.49 -1 -6 0 54.50 3.57 1 6 0 52.70 3.07 1 6 0 55.16 3.42 -2 -6 0 7.72 1.62 2 6 0 7.16 1.42 2 6 0 6.22 1.42 -3 -6 0 4.79 1.65 3 6 0 8.09 1.63 -4 -6 0 11.27 2.47 4 6 0 13.51 2.31 7 -7 0 11.98 2.40 -7 7 0 8.61 1.79 6 -7 0 2.83 1.35 -6 7 0 1.71 1.01 5 -7 0 16.16 2.32 -5 7 0 12.58 1.95 4 -7 0 151.62 7.36 -4 7 0 159.07 7.18 3 -7 0 136.00 6.65 -3 7 0 140.77 6.49 -3 7 0 141.78 6.59 2 -7 0 43.90 3.23 -2 7 0 52.09 3.26 -2 7 0 53.07 3.08 1 -7 0 82.23 4.46 -1 7 0 82.61 4.43 -1 7 0 78.95 4.25 0 -7 0 0.22 0.74 0 7 0 -0.14 0.53 0 7 0 0.45 0.67 -1 -7 0 22.31 2.85 1 7 0 23.18 2.63 2 7 0 80.29 4.92 -3 -7 0 76.24 5.57 7 -8 0 67.93 5.08 -7 8 0 63.23 4.69 6 -8 0 104.96 6.30 -6 8 0 112.38 6.14 5 -8 0 60.72 4.30 -5 8 0 59.04 4.06 4 -8 0 17.07 2.58 -4 8 0 22.09 2.62 3 -8 0 -0.37 0.57 -3 8 0 -0.44 0.49 2 -8 0 55.44 3.87 -2 8 0 64.34 3.93 1 -8 0 90.71 5.10 -1 8 0 92.22 5.00 -1 8 0 85.58 4.74 0 -8 0 139.93 7.37 0 8 0 137.38 6.67 1 8 0 20.96 2.68 6 -9 0 0.07 0.98 -6 9 0 0.02 1.06 5 -9 0 19.74 2.94 -5 9 0 24.21 3.01 4 -9 0 46.65 4.57 -4 9 0 54.16 3.86 3 -9 0 100.39 5.81 -3 9 0 97.27 5.55 2 -9 0 8.21 1.92 -2 9 0 6.51 1.61 -1 9 0 38.88 3.82 0 -9 0 4.93 1.66 4 -10 0 3.81 1.60 -4 10 0 0.45 0.87 3 -10 0 0.97 1.14 -3 10 0 0.50 0.75 -3 10 -1 39.37 4.07 3 -10 1 42.57 4.52 0 -9 1 9.78 2.12 -1 9 -1 97.54 5.49 -2 9 -1 44.87 3.45 2 -9 1 38.58 3.92 -3 9 -1 60.67 4.20 3 -9 1 62.04 4.48 -4 9 -1 1.30 1.12 4 -9 1 3.58 1.36 -5 9 -1 3.15 1.42 5 -9 1 6.36 1.89 -6 9 -1 39.38 4.14 6 -9 1 39.93 4.35 1 8 -1 32.01 3.30 0 8 -1 43.62 3.21 0 8 -1 43.36 3.20 0 -8 1 43.64 3.60 -1 8 -1 9.97 1.79 1 -8 1 5.90 1.49 -2 8 -1 19.72 2.43 2 -8 1 23.25 2.83 -3 8 -1 63.53 4.01 3 -8 1 64.46 4.35 -4 8 -1 152.16 7.20 4 -8 1 141.22 7.39 -5 8 -1 42.17 3.37 5 -8 1 43.21 4.22 -6 8 -1 -0.17 0.84 6 -8 1 0.96 1.07 -7 8 -1 1.77 1.18 7 -8 1 0.74 1.24 -3 -7 1 35.33 4.27 2 7 -1 0.10 0.65 1 7 -1 23.83 2.58 -1 -7 1 20.54 2.72 0 7 -1 10.76 1.65 0 7 -1 10.61 1.64 0 -7 1 9.99 1.75 -1 7 -1 224.29 8.97 -1 7 -1 224.87 9.28 1 -7 1 233.26 9.57 -2 7 -1 278.97 11.11 2 -7 1 287.19 11.40 -3 7 -1 110.09 5.49 3 -7 1 112.17 5.84 -4 7 -1 -0.34 0.52 4 -7 1 -0.16 0.61 -5 7 -1 83.57 4.86 5 -7 1 88.67 5.20 -6 7 -1 76.81 4.82 6 -7 1 83.94 5.14 -7 7 -1 98.03 5.72 7 -7 1 93.28 5.79 4 6 -1 11.31 2.11 -4 -6 1 6.04 1.89 3 6 -1 68.72 4.22 -3 -6 1 67.36 4.77 2 6 -1 179.74 7.62 2 6 -1 176.78 7.96 1 6 -1 111.42 5.45 1 6 -1 110.69 5.13 -1 -6 1 117.49 5.74 0 6 -1 23.83 1.94 0 6 -1 22.83 1.72 0 6 -1 23.79 1.99 0 -6 1 24.64 2.47 -1 6 -1 8.71 1.25 -1 6 -1 8.22 1.31 1 -6 1 7.35 1.42 -2 6 -1 42.66 2.47 -2 6 -1 45.61 2.83 2 -6 1 41.21 2.90 -3 6 -1 54.44 3.25 -3 6 -1 50.90 2.82 3 -6 1 58.91 3.61 -4 6 -1 57.67 3.55 4 -6 1 61.63 3.85 -5 6 -1 81.17 4.50 5 -6 1 77.25 4.63 -6 6 -1 13.14 1.99 6 -6 1 15.75 2.29 -7 6 -1 2.33 1.17 7 -6 1 1.16 1.26 4 5 -1 51.99 3.66 -4 -5 1 48.44 3.96 3 5 -1 24.41 2.63 -3 -5 1 20.91 2.79 2 5 -1 20.02 2.10 2 5 -1 23.11 2.38 -2 -5 1 19.54 2.14 1 5 -1 183.47 6.84 1 5 -1 169.09 7.27 1 5 -1 181.08 7.02 -1 -5 1 179.52 7.53 0 5 -1 253.22 9.28 0 5 -1 256.25 9.56 0 5 -1 251.34 9.08 0 5 -1 256.71 9.57 -1 5 -1 100.27 4.46 -1 5 -1 95.07 4.18 1 -5 1 100.12 4.12 1 -5 1 95.61 4.60 -2 5 -1 172.31 6.47 -2 5 -1 162.70 6.79 2 -5 1 164.15 7.00 2 -5 1 169.00 6.36 -3 5 -1 4.49 0.85 -3 5 -1 5.41 1.04 3 -5 1 4.89 0.80 3 -5 1 2.18 0.79 -4 5 -1 8.19 1.30 -4 5 -1 9.80 1.45 4 -5 1 4.34 1.13 -5 5 -1 16.80 2.05 5 -5 1 19.42 2.30 -6 5 -1 47.02 3.28 6 -5 1 53.87 3.57 -7 5 -1 56.02 3.78 7 -5 1 55.85 4.00 5 4 -1 0.92 0.92 -5 -4 1 2.40 1.20 4 4 -1 21.62 2.55 -4 -4 1 17.66 2.56 3 4 -1 179.66 7.53 -3 -4 1 183.04 8.23 2 4 -1 140.01 6.03 2 4 -1 134.35 5.71 -2 -4 1 133.68 5.80 1 4 -1 78.78 3.46 1 4 -1 81.33 3.64 1 4 -1 83.85 3.69 1 4 -1 82.56 3.86 0 4 -1 0.75 0.41 0 4 -1 0.05 0.26 0 4 -1 -0.02 0.28 0 4 -1 0.29 0.34 -1 4 -1 32.53 1.78 -1 4 -1 29.74 1.89 1 -4 1 31.81 2.12 1 -4 1 35.96 1.81 -2 4 -1 3.71 0.75 -2 4 -1 3.24 0.61 2 -4 1 2.84 0.56 2 -4 1 1.94 0.69 -3 4 -1 169.14 6.93 -3 4 -1 181.68 7.10 3 -4 1 178.40 7.25 3 -4 1 187.31 6.48 -4 4 -1 185.76 7.42 -4 4 -1 184.24 7.35 4 -4 1 179.82 6.73 4 -4 1 178.99 7.47 -5 4 -1 234.56 9.30 -5 4 -1 239.15 9.48 5 -4 1 231.83 9.36 5 -4 1 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149.08 6.73 4 -3 5 155.53 6.65 4 -3 5 159.61 6.58 -5 3 -5 148.20 6.92 5 -3 5 156.24 6.83 -6 3 -5 30.90 3.11 6 -3 5 35.69 2.86 -7 3 -5 18.85 2.61 7 -3 5 11.92 2.15 6 2 -5 11.93 2.08 -6 -2 5 12.20 2.16 5 2 -5 60.05 3.77 -5 -2 5 58.66 3.95 4 2 -5 180.10 7.34 4 2 -5 153.93 7.20 -4 -2 5 186.09 7.72 3 2 -5 113.32 5.00 3 2 -5 107.08 5.03 -3 -2 5 117.04 5.21 2 2 -5 67.41 2.50 2 2 -5 65.37 3.23 2 2 -5 68.26 3.34 -2 -2 5 67.17 3.25 1 2 -5 11.11 0.76 1 2 -5 9.95 1.22 1 2 -5 8.91 1.11 -1 -2 5 10.58 1.04 0 2 -5 44.56 2.11 0 2 -5 47.09 2.32 0 -2 5 43.81 1.81 0 -2 5 46.91 2.51 -1 2 -5 99.01 4.10 -1 2 -5 101.03 4.24 1 -2 5 105.40 4.55 -2 2 -5 609.87 19.75 -2 2 -5 617.89 19.56 -2 2 -5 620.25 20.59 2 -2 5 537.11 20.04 -3 2 -5 155.08 6.43 -3 2 -5 152.98 5.67 3 -2 5 145.64 5.98 3 -2 5 147.92 6.29 -4 2 -5 12.37 1.71 4 -2 5 13.97 1.75 -5 2 -5 3.01 1.10 5 -2 5 2.61 0.94 -6 2 -5 7.40 1.62 6 -2 5 7.39 1.65 7 -2 5 51.55 3.97 7 1 -5 49.32 3.85 -7 -1 5 55.33 4.46 6 1 -5 34.05 3.23 -6 -1 5 28.13 3.22 5 1 -5 45.89 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23.00 2.73 2 -3 -14 112.96 6.04 -2 3 14 102.82 5.66 1 -3 -14 109.24 6.41 -1 3 14 122.49 6.12 0 -3 -14 63.35 4.67 0 3 14 64.79 4.15 -1 -3 -14 9.86 2.18 6 -4 -14 26.20 3.34 -6 4 14 38.29 4.23 5 -4 -14 34.28 3.56 -5 4 14 47.14 4.58 4 -4 -14 82.10 4.93 -4 4 14 83.50 5.27 3 -4 -14 46.56 3.38 -3 4 14 39.97 3.41 2 -4 -14 -0.13 0.80 -2 4 14 0.61 0.86 1 -4 -14 -0.36 0.99 -1 4 14 1.93 1.12 0 -4 -14 36.06 4.12 0 4 14 29.85 3.30 -1 -4 -14 33.74 4.21 1 4 14 35.39 3.72 5 -5 -14 13.64 2.28 -5 5 14 11.77 2.44 4 -5 -14 1.02 0.88 -4 5 14 1.43 1.21 2 -5 -14 84.15 5.46 -2 5 14 80.70 5.23 1 -5 -14 123.49 7.12 -1 5 14 114.45 6.62 -4 6 14 52.46 4.22 3 -6 -14 64.97 4.64 -3 6 14 54.66 4.41 2 -6 -14 16.45 2.78 -2 6 14 13.89 2.62 1 5 -15 -0.10 1.07 -1 -5 15 2.69 1.55 0 5 -15 -0.31 0.93 0 -5 15 -0.11 1.22 -1 5 -15 30.07 3.48 -2 5 -15 27.08 3.28 2 -5 15 23.85 3.28 2 4 -15 27.72 3.48 -2 -4 15 44.46 4.74 1 4 -15 47.65 3.69 -1 -4 15 35.88 4.23 0 4 -15 76.89 4.87 0 -4 15 73.51 5.05 -1 4 -15 105.22 5.78 1 -4 15 100.19 6.11 -2 4 -15 18.48 3.02 2 -4 15 18.30 2.84 3 3 -15 66.25 4.55 -3 -3 15 68.89 5.13 2 3 -15 66.09 4.44 -2 -3 15 69.23 5.12 1 3 -15 2.43 1.14 -1 -3 15 2.20 1.50 0 3 -15 3.33 1.25 0 -3 15 5.36 1.54 -1 3 -15 18.07 2.83 -1 3 -15 17.09 2.37 1 -3 15 17.21 2.68 -2 3 -15 39.09 3.98 2 -3 15 37.52 3.97 -3 3 -15 87.33 5.60 3 -3 15 70.87 5.49 4 2 -15 29.47 3.55 -4 -2 15 32.35 3.96 3 2 -15 5.04 1.49 -3 -2 15 6.15 1.99 2 2 -15 18.38 2.55 -2 -2 15 20.62 3.05 1 2 -15 65.46 4.20 -1 -2 15 73.16 4.80 0 2 -15 116.41 5.90 0 -2 15 113.17 6.25 -1 2 -15 125.51 6.58 1 -2 15 127.11 6.80 -2 2 -15 30.97 3.42 2 -2 15 35.93 3.93 -3 2 -15 4.43 1.43 3 -2 15 7.67 2.13 5 1 -15 13.54 2.44 -5 -1 15 16.78 2.99 4 1 -15 54.82 4.07 -4 -1 15 52.15 4.92 3 1 -15 50.71 3.68 -3 -1 15 48.67 4.00 2 1 -15 83.37 4.92 -2 -1 15 93.73 5.67 1 1 -15 20.63 2.41 -1 -1 15 12.79 2.15 0 1 -15 1.05 0.86 0 -1 15 0.22 0.83 -1 1 -15 11.31 2.10 1 -1 15 8.92 2.09 -2 1 -15 50.04 3.98 2 -1 15 44.47 4.47 -3 1 -15 97.76 6.04 3 -1 15 87.73 6.03 5 0 -15 44.95 4.33 4 0 -15 15.98 2.41 -4 0 15 14.36 2.53 3 0 -15 19.17 2.58 -3 0 15 21.23 2.99 2 0 -15 53.38 3.63 -2 0 15 54.28 3.85 1 0 -15 50.99 3.42 -1 0 15 48.56 3.53 0 0 -15 169.55 7.72 0 0 15 153.66 7.68 -1 0 -15 77.29 4.91 1 0 15 81.27 5.20 -2 0 -15 25.16 3.19 2 0 15 20.26 3.04 5 -1 -15 6.92 1.81 -5 1 15 6.31 1.66 4 -1 -15 64.29 4.33 -4 1 15 69.13 4.65 3 -1 -15 118.99 6.14 2 -1 -15 56.61 3.76 -2 1 15 60.68 3.89 -1 1 15 26.46 2.95 0 -1 -15 1.39 0.90 0 1 15 0.94 0.99 -1 -1 -15 11.64 2.19 1 1 15 8.15 1.98 -2 -1 -15 33.44 3.73 2 1 15 31.42 3.88 5 -2 -15 74.31 5.04 -5 2 15 81.35 5.32 4 -2 -15 14.65 2.37 -4 2 15 19.15 2.69 3 -2 -15 6.83 1.52 -3 2 15 11.25 1.95 2 -2 -15 66.84 4.05 1 -2 -15 79.96 4.83 0 -2 -15 115.42 6.35 -1 -2 -15 53.71 4.25 1 2 15 53.95 4.25 5 -3 -15 6.14 1.69 -5 3 15 2.83 1.39 4 -3 -15 34.85 3.55 -4 3 15 40.81 3.93 3 -3 -15 71.56 4.42 -3 3 15 68.57 4.48 -2 3 15 66.81 4.36 1 -3 -15 15.78 2.60 -1 3 15 12.98 2.16 0 -3 -15 6.79 1.80 -1 -3 -15 6.39 1.97 5 -4 -15 50.47 4.02 -5 4 15 54.41 4.36 4 -4 -15 2.65 1.07 -4 4 15 0.98 1.03 -3 4 15 3.62 1.39 2 -4 -15 37.54 4.07 -2 4 15 35.80 3.71 1 -4 -15 72.70 5.27 -1 4 15 67.32 4.64 0 -4 -15 63.26 5.01 -4 5 15 103.89 6.25 -3 5 15 127.80 7.02 2 -5 -15 77.13 5.41 1 4 -16 88.75 5.51 0 4 -16 4.69 1.54 0 -4 16 6.40 1.80 -1 4 -16 1.63 1.22 1 -4 16 -1.24 0.95 3 3 -16 5.99 1.65 -3 -3 16 5.46 1.84 2 3 -16 1.30 1.07 -2 -3 16 -0.58 1.02 1 3 -16 57.61 4.11 -1 -3 16 58.24 4.59 0 3 -16 54.48 3.91 0 -3 16 53.93 4.22 1 -3 16 90.56 5.75 -2 3 -16 52.98 4.20 2 -3 16 45.76 4.61 3 2 -16 76.29 5.04 -3 -2 16 80.83 5.73 2 2 -16 77.50 4.90 -2 -2 16 92.24 5.89 1 2 -16 113.29 5.91 -1 -2 16 104.30 6.16 0 2 -16 31.78 3.18 0 -2 16 29.23 3.43 -1 2 -16 1.93 1.06 1 -2 16 3.04 1.44 -2 2 -16 49.91 3.96 2 -2 16 41.20 4.41 4 1 -16 67.57 4.61 -4 -1 16 65.37 5.03 3 1 -16 0.44 0.90 -3 -1 16 1.48 1.26 2 1 -16 0.58 0.81 -2 -1 16 1.23 1.05 1 1 -16 21.98 2.61 -1 -1 16 19.07 2.66 0 -1 16 32.11 3.54 -1 1 -16 81.11 4.92 1 -1 16 67.24 4.93 -2 1 -16 41.91 4.28 2 -1 16 45.48 4.70 4 0 -16 35.14 3.56 3 0 -16 59.13 4.15 -3 0 16 71.84 4.90 2 0 -16 101.27 5.37 -2 0 16 85.73 5.31 1 0 -16 46.84 3.48 -1 0 16 51.20 3.82 0 0 -16 20.18 2.69 0 0 16 18.54 2.59 -1 0 -16 7.53 1.76 1 0 16 5.77 1.71 -2 0 -16 6.94 1.70 2 0 16 1.62 1.47 4 -1 -16 20.13 2.79 3 -1 -16 20.27 2.65 2 -1 -16 0.13 0.83 -1 1 16 12.74 2.12 0 -1 -16 78.16 4.82 0 1 16 76.08 4.98 -1 -1 -16 120.16 6.62 1 1 16 117.59 6.79 5 -2 -16 4.03 1.56 -5 2 16 5.70 1.84 4 -2 -16 10.33 2.05 -4 2 16 10.00 2.16 3 -2 -16 55.12 3.90 0 -2 -16 41.90 4.19 4 -3 -16 102.59 5.84 -4 3 16 94.50 5.77 -3 3 16 11.46 2.15 1 -3 -16 22.20 3.07 0 -3 -16 96.76 6.10 4 -4 -16 31.83 3.40 -4 4 16 27.55 3.39 -3 4 16 63.45 4.56 -2 4 16 57.50 4.23 1 3 -17 83.30 5.26 -1 -3 17 83.23 5.58 0 3 -17 20.91 2.92 0 -3 17 24.69 3.31 2 2 -17 29.42 3.33 -2 -2 17 25.48 3.55 1 2 -17 4.11 1.40 -1 -2 17 1.81 1.35 0 -2 17 35.61 3.82 1 -2 17 31.82 3.79 3 1 -17 25.12 3.18 -3 -1 17 23.03 3.45 -2 -1 17 54.59 4.19 1 1 -17 38.24 3.64 -1 -1 17 43.17 4.14 0 -1 17 33.91 3.73 -1 1 -17 31.25 3.54 1 -1 17 31.60 3.78 3 0 -17 32.13 3.37 -3 0 17 43.64 4.31 2 0 -17 14.55 2.28 -2 0 17 14.08 2.30 -1 0 17 4.10 1.42 0 0 17 69.14 4.82 4 -1 -17 3.15 1.37 3 -1 -17 21.33 2.76 0 -1 -17 40.29 4.08 0 1 17 43.56 4.39 4 -2 -17 86.85 5.43 3 -2 -17 58.73 4.15 0 0 0 0.00 0.00 ; _shelx_hkl_checksum 20070 _shelx_res_file ; TITL a P-1 CELL 0.71073 6.2861 7.5366 13.4963 90.547 100.667 113.489 ZERR 2.0000 0.0005 0.0006 0.0011 0.001 0.001 0.001 LATT 1 SFAC B EU NA O UNIT 16 2 6 30 MERG 2 FMAP 2 GRID PLAN 20 TEMP 23 SIZE 0.2 0.1 0.1 BOND $H L.S. 10 ACTA WGHT 0.018900 1.003200 EXTI 0.007934 FVAR 0.17306 EU1 2 0.918474 0.249421 0.332663 11.00000 0.00544 0.00627 = 0.00421 0.00042 0.00098 0.00227 NA1 3 0.365859 0.613430 0.270698 11.00000 0.02215 0.01503 = 0.04056 0.01089 0.01728 0.00768 NA2 3 0.907914 0.689493 0.391343 11.00000 0.02840 0.01909 = 0.01375 -0.00406 0.00131 0.00757 NA3 3 0.749157 0.262429 0.023097 11.00000 0.01593 0.02529 = 0.02165 -0.00738 -0.00515 0.01280 B1 1 0.618568 0.363866 0.500416 11.00000 0.01008 0.00827 = 0.00938 0.00149 0.00339 0.00594 B2 1 0.272706 0.058019 0.486000 11.00000 0.00689 0.00996 = 0.00760 0.00035 0.00214 0.00614 B3 1 0.387570 0.201986 0.326782 11.00000 0.00450 0.00543 = 0.00809 -0.00279 -0.00087 0.00232 B4 1 0.371765 -0.017461 0.185365 11.00000 0.00814 0.00600 = 0.01049 0.00291 0.00429 0.00300 B5 1 0.105650 0.152987 0.158940 11.00000 0.00834 0.00908 = 0.00493 -0.00033 0.00176 0.00591 B6 1 0.315815 0.129802 -0.142783 11.00000 0.00558 0.00466 = 0.00691 -0.00142 -0.00034 0.00303 B7 1 0.205338 0.281607 -0.010524 11.00000 0.00592 0.00674 = 0.00690 -0.00052 0.00151 0.00132 B8 1 0.164517 0.389328 -0.180285 11.00000 0.00507 0.00618 = 0.00756 0.00251 0.00081 0.00061 O1 4 0.802968 0.506181 0.559204 11.00000 0.01090 0.01321 = 0.01121 -0.00363 -0.00109 0.00123 O2 4 0.590736 0.354983 0.395062 11.00000 0.00598 0.00714 = 0.00454 -0.00042 0.00047 0.00110 O3 4 0.451348 0.222882 0.544999 11.00000 0.01108 0.01052 = 0.00488 0.00021 0.00123 -0.00137 O4 4 0.159412 -0.101536 0.527639 11.00000 0.01099 0.01047 = 0.00962 0.00414 0.00346 0.00254 O5 4 0.217656 0.070007 0.383042 11.00000 0.00875 0.01042 = 0.00583 0.00127 0.00073 0.00166 O6 4 0.254982 0.278794 0.252740 11.00000 0.00632 0.00697 = 0.00407 -0.00080 0.00073 0.00348 O7 4 0.497825 0.094824 0.274700 11.00000 0.00565 0.01230 = 0.00772 -0.00351 -0.00081 0.00614 O8 4 0.168639 -0.007725 0.137847 11.00000 0.00552 0.01035 = 0.00747 -0.00098 -0.00003 0.00641 O9 4 0.125963 0.279039 0.076192 11.00000 0.01155 0.01045 = 0.00400 0.00165 0.00206 0.00708 O10 4 0.145184 -0.074391 -0.173550 11.00000 0.00453 0.00599 = 0.00922 -0.00046 0.00256 0.00100 O11 4 0.557543 0.147783 -0.146986 11.00000 0.00393 0.00795 = 0.01182 -0.00257 0.00183 0.00267 O12 4 0.325751 0.179481 -0.035580 11.00000 0.00658 0.00967 = 0.00503 0.00008 -0.00029 0.00596 O13 4 0.162846 0.413211 -0.076936 11.00000 0.01574 0.01047 = 0.00616 0.00204 0.00298 0.00977 O14 4 0.074889 0.485352 -0.245573 11.00000 0.01536 0.01399 = 0.01036 0.00630 0.00574 0.01113 O15 4 0.262118 0.266627 -0.210071 11.00000 0.00968 0.00988 = 0.00644 0.00325 0.00388 0.00676 HKLF 4 REM a P-1 REM R1 = 0.0234 for 2599 Fo > 4sig(Fo) and 0.0263 for all 2807 data REM 245 parameters refined using 0 restraints END WGHT 0.0189 1.0032 REM Highest difference peak 1.170, deepest hole -0.918, 1-sigma level 0.163 Q1 1 0.2963 0.5597 0.2087 11.00000 0.05 1.17 Q2 1 1.0296 0.3623 0.3866 11.00000 0.05 0.94 Q3 1 0.9412 0.3401 0.2653 11.00000 0.05 0.94 Q4 1 0.8008 0.1253 0.2813 11.00000 0.05 0.83 Q5 1 0.0914 -0.1604 0.5974 11.00000 0.05 0.83 Q6 1 0.9123 0.1011 0.3294 11.00000 0.05 0.75 Q7 1 0.8757 0.3168 0.4086 11.00000 0.05 0.75 Q8 1 0.7501 0.1915 0.3468 11.00000 0.05 0.73 Q9 1 1.0279 0.5419 0.6094 11.00000 0.05 0.69 Q10 1 0.1625 0.3372 -0.0535 11.00000 0.05 0.62 Q11 1 1.0942 0.3184 0.3181 11.00000 0.05 0.61 Q12 1 0.1435 0.0789 0.1567 11.00000 0.05 0.58 Q13 1 0.9962 0.2066 0.2618 11.00000 0.05 0.56 Q14 1 0.6275 0.1086 0.2592 11.00000 0.05 0.56 Q15 1 0.2210 0.0194 -0.1569 11.00000 0.05 0.54 Q16 1 0.5883 0.4288 -0.0981 11.00000 0.05 0.54 Q17 1 0.1854 0.0512 -0.2385 11.00000 0.05 0.53 Q18 1 0.1162 -0.2306 0.5229 11.00000 0.05 0.53 Q19 1 0.2710 0.2256 0.2937 11.00000 0.05 0.53 Q20 1 0.7636 0.1858 0.0082 11.00000 0.05 0.53 ; _shelx_res_checksum 8343 _shelxl_version_number .2013 loop_ _space_group_symop_operation_xyz 'x, y, z' '-x, -y, -z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Eu Eu1 0.91847(3) 0.24942(3) 0.33266(2) 0.00535(8) Uani d 1 . . Na Na1 0.3659(3) 0.6134(2) 0.27070(15) 0.0243(4) Uani d 1 . . Na Na2 0.9079(3) 0.6895(2) 0.39134(13) 0.0216(4) Uani d 1 . . Na Na3 0.7492(3) 0.2624(3) 0.02310(13) 0.0209(4) Uani d 1 . . B B1 0.6186(7) 0.3639(6) 0.5004(3) 0.0083(8) Uani d 1 . . B B2 0.2727(7) 0.0580(6) 0.4860(3) 0.0072(8) Uani d 1 . . B B3 0.3876(7) 0.2020(6) 0.3268(3) 0.0062(8) Uani d 1 . . B B4 0.3718(7) -0.0175(6) 0.1854(3) 0.0078(8) Uani d 1 . . B B5 0.1056(7) 0.1530(6) 0.1589(3) 0.0066(8) Uani d 1 . . B B6 0.3158(7) 0.1298(6) -0.1428(3) 0.0057(7) Uani d 1 . . B B7 0.2053(7) 0.2816(6) -0.0105(3) 0.0069(8) Uani d 1 . . B B8 0.1645(7) 0.3893(6) -0.1803(3) 0.0069(8) Uani d 1 . . O O1 0.8030(5) 0.5062(4) 0.5592(2) 0.0135(6) Uani d 1 . . O O2 0.5907(4) 0.3550(3) 0.39506(18) 0.0065(5) Uani d 1 . . O O3 0.4513(5) 0.2229(4) 0.54500(19) 0.0108(5) Uani d 1 . . O O4 0.1594(5) -0.1015(4) 0.5276(2) 0.0107(5) Uani d 1 . . O O5 0.2177(4) 0.0700(4) 0.38304(19) 0.0092(5) Uani d 1 . . O O6 0.2550(4) 0.2788(3) 0.25274(18) 0.0056(5) Uani d 1 . . O O7 0.4978(4) 0.0948(4) 0.27470(19) 0.0081(5) Uani d 1 . . O O8 0.1686(4) -0.0077(4) 0.13785(19) 0.0070(5) Uani d 1 . . O O9 0.1260(4) 0.2790(4) 0.07619(19) 0.0078(5) Uani d 1 . . O O10 0.1452(4) -0.0744(3) -0.17355(19) 0.0068(5) Uani d 1 . . O O11 0.5575(4) 0.1478(4) -0.14699(19) 0.0078(5) Uani d 1 . . O O12 0.3258(4) 0.1795(4) -0.03558(18) 0.0065(5) Uani d 1 . . O O13 0.1628(5) 0.4132(4) -0.07694(19) 0.0092(5) Uani d 1 . . O O14 0.0749(5) 0.4854(4) -0.2456(2) 0.0111(5) Uani d 1 . . O O15 0.2621(4) 0.2666(4) -0.21007(19) 0.0074(5) Uani d 1 . . 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 Eu1 0.00544(10) 0.00627(11) 0.00421(10) 0.00227(7) 0.00098(6) 0.00042(6) Na1 0.0221(9) 0.0150(9) 0.0406(11) 0.0077(7) 0.0173(8) 0.0109(8) Na2 0.0284(10) 0.0191(9) 0.0138(8) 0.0076(8) 0.0013(7) -0.0041(7) Na3 0.0159(8) 0.0253(9) 0.0217(9) 0.0128(7) -0.0052(7) -0.0074(7) B1 0.0101(19) 0.0083(19) 0.009(2) 0.0059(16) 0.0034(15) 0.0015(15) B2 0.0069(18) 0.0100(19) 0.0076(19) 0.0061(15) 0.0021(15) 0.0004(15) B3 0.0045(18) 0.0054(18) 0.0081(19) 0.0023(15) -0.0009(15) -0.0028(15) B4 0.0081(19) 0.0060(18) 0.010(2) 0.0030(15) 0.0043(15) 0.0029(15) B5 0.0083(19) 0.0091(19) 0.0049(18) 0.0059(15) 0.0018(15) -0.0003(15) B6 0.0056(18) 0.0047(18) 0.0069(19) 0.0030(15) -0.0003(14) -0.0014(14) B7 0.0059(18) 0.0067(19) 0.0069(19) 0.0013(15) 0.0015(15) -0.0005(15) B8 0.0051(18) 0.0062(18) 0.0076(19) 0.0006(15) 0.0008(14) 0.0025(15) O1 0.0109(13) 0.0132(14) 0.0112(14) 0.0012(11) -0.0011(11) -0.0036(11) O2 0.0060(12) 0.0071(12) 0.0045(12) 0.0011(10) 0.0005(9) -0.0004(9) O3 0.0111(13) 0.0105(13) 0.0049(12) -0.0014(11) 0.0012(10) 0.0002(10) O4 0.0110(13) 0.0105(13) 0.0096(13) 0.0025(11) 0.0035(10) 0.0041(10) O5 0.0087(12) 0.0104(13) 0.0058(12) 0.0017(10) 0.0007(10) 0.0013(10) O6 0.0063(12) 0.0070(12) 0.0041(12) 0.0035(10) 0.0007(9) -0.0008(9) O7 0.0056(12) 0.0123(13) 0.0077(13) 0.0061(10) -0.0008(10) -0.0035(10) O8 0.0055(12) 0.0104(13) 0.0075(12) 0.0064(10) 0.0000(9) -0.0010(10) O9 0.0116(13) 0.0105(13) 0.0040(12) 0.0071(10) 0.0021(10) 0.0017(10) O10 0.0045(11) 0.0060(12) 0.0092(12) 0.0010(10) 0.0026(9) -0.0005(10) O11 0.0039(12) 0.0080(12) 0.0118(13) 0.0027(10) 0.0018(10) -0.0026(10) O12 0.0066(12) 0.0097(12) 0.0050(12) 0.0060(10) -0.0003(9) 0.0001(10) O13 0.0157(13) 0.0105(13) 0.0062(12) 0.0098(11) 0.0030(10) 0.0020(10) O14 0.0154(13) 0.0140(13) 0.0104(13) 0.0111(11) 0.0057(11) 0.0063(11) O15 0.0097(12) 0.0099(13) 0.0064(12) 0.0068(10) 0.0039(10) 0.0032(10) loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag O4 Eu1 O1 2_656 2_766 84.47(10) ? O4 Eu1 O14 2_656 2_665 144.72(10) ? O1 Eu1 O14 2_766 2_665 79.17(10) ? O4 Eu1 O10 2_656 2_655 122.54(9) ? O1 Eu1 O10 2_766 2_655 141.44(9) ? O14 Eu1 O10 2_665 2_655 88.27(9) ? O4 Eu1 O7 2_656 . 83.76(9) ? O1 Eu1 O7 2_766 . 141.00(9) ? O14 Eu1 O7 2_665 . 89.60(9) ? O10 Eu1 O7 2_655 . 74.22(8) ? O4 Eu1 O6 2_656 1_655 125.07(9) ? O1 Eu1 O6 2_766 1_655 83.56(9) ? O14 Eu1 O6 2_665 1_655 84.00(9) ? O10 Eu1 O6 2_655 1_655 58.78(8) ? O7 Eu1 O6 . 1_655 132.65(8) ? O4 Eu1 O5 2_656 1_655 72.00(9) ? O1 Eu1 O5 2_766 1_655 84.01(9) ? O14 Eu1 O5 2_665 1_655 135.83(8) ? O10 Eu1 O5 2_655 1_655 80.06(8) ? O7 Eu1 O5 . 1_655 126.59(8) ? O6 Eu1 O5 1_655 1_655 53.53(8) ? O4 Eu1 O2 2_656 . 73.49(8) ? O1 Eu1 O2 2_766 . 87.18(9) ? O14 Eu1 O2 2_665 . 74.67(8) ? O10 Eu1 O2 2_655 . 124.55(8) ? O7 Eu1 O2 . . 53.82(8) ? O6 Eu1 O2 1_655 . 158.02(8) ? O5 Eu1 O2 1_655 . 145.02(7) ? O4 Eu1 B5 2_656 1_655 131.31(10) ? O1 Eu1 B5 2_766 1_655 112.31(11) ? O14 Eu1 B5 2_665 1_655 83.94(10) ? O10 Eu1 B5 2_655 1_655 29.45(9) ? O7 Eu1 B5 . 1_655 103.30(10) ? O6 Eu1 B5 1_655 1_655 29.41(9) ? O5 Eu1 B5 1_655 1_655 65.32(9) ? O2 Eu1 B5 . 1_655 147.89(9) ? O4 Eu1 B3 2_656 1_655 98.12(10) ? O1 Eu1 B3 2_766 1_655 75.86(10) ? O14 Eu1 B3 2_665 1_655 107.70(10) ? O10 Eu1 B3 2_655 1_655 73.56(9) ? O7 Eu1 B3 . 1_655 142.67(10) ? O6 Eu1 B3 1_655 1_655 27.12(9) ? O5 Eu1 B3 1_655 1_655 28.16(9) ? O2 Eu1 B3 . 1_655 161.87(9) ? B5 Eu1 B3 1_655 1_655 48.59(11) ? O4 Eu1 B3 2_656 . 77.92(10) ? O1 Eu1 B3 2_766 . 114.62(10) ? O14 Eu1 B3 2_665 . 80.87(10) ? O10 Eu1 B3 2_655 . 98.84(9) ? O7 Eu1 B3 . . 26.39(9) ? O6 Eu1 B3 1_655 . 153.38(9) ? O5 Eu1 B3 1_655 . 142.82(9) ? O2 Eu1 B3 . . 27.44(8) ? B5 Eu1 B3 1_655 . 126.42(10) ? B3 Eu1 B3 1_655 . 168.01(14) ? O4 Eu1 Na1 2_656 1_655 136.46(8) ? O1 Eu1 Na1 2_766 1_655 54.78(8) ? O14 Eu1 Na1 2_665 1_655 49.58(7) ? O10 Eu1 Na1 2_655 1_655 89.50(7) ? O7 Eu1 Na1 . 1_655 136.96(7) ? O6 Eu1 Na1 1_655 1_655 44.79(6) ? O5 Eu1 Na1 1_655 1_655 87.58(6) ? O2 Eu1 Na1 . 1_655 114.31(6) ? B5 Eu1 Na1 1_655 1_655 64.63(9) ? B3 Eu1 Na1 1_655 1_655 60.67(8) ? B3 Eu1 Na1 . 1_655 129.59(8) ? O6 Na1 O11 . 2_665 130.94(12) ? O6 Na1 O15 . 2_665 101.40(11) ? O11 Na1 O15 2_665 2_665 58.73(9) ? O6 Na1 O14 . 2_565 82.95(10) ? O11 Na1 O14 2_665 2_565 97.59(10) ? O15 Na1 O14 2_665 2_565 152.24(12) ? O6 Na1 O3 . 2_666 115.18(11) ? O11 Na1 O3 2_665 2_666 111.57(10) ? O15 Na1 O3 2_665 2_666 96.41(10) ? O14 Na1 O3 2_565 2_666 106.58(11) ? O6 Na1 O1 . 2_666 76.85(10) ? O11 Na1 O1 2_665 2_666 148.14(11) ? O15 Na1 O1 2_665 2_666 140.49(11) ? O14 Na1 O1 2_565 2_666 67.27(9) ? O3 Na1 O1 2_666 2_666 52.51(9) ? O6 Na1 B6 . 2_665 119.86(12) ? O11 Na1 B6 2_665 2_665 29.41(9) ? O15 Na1 B6 2_665 2_665 29.34(9) ? O14 Na1 B6 2_565 2_665 125.95(12) ? O3 Na1 B6 2_666 2_665 105.28(11) ? O1 Na1 B6 2_666 2_665 157.74(12) ? O6 Na1 B4 . 1_565 150.77(13) ? O11 Na1 B4 2_665 1_565 26.34(10) ? O15 Na1 B4 2_665 1_565 78.47(11) ? O14 Na1 B4 2_565 1_565 84.61(11) ? O3 Na1 B4 2_666 1_565 93.71(11) ? O1 Na1 B4 2_666 1_565 121.82(12) ? B6 Na1 B4 2_665 1_565 50.79(11) ? O6 Na1 B1 . 2_666 95.01(11) ? O11 Na1 B1 2_665 2_666 134.06(12) ? O15 Na1 B1 2_665 2_666 119.34(12) ? O14 Na1 B1 2_565 2_666 87.15(11) ? O3 Na1 B1 2_666 2_666 26.90(10) ? O1 Na1 B1 2_666 2_666 25.67(9) ? B6 Na1 B1 2_665 2_666 132.17(13) ? B4 Na1 B1 1_565 2_666 110.70(12) ? O6 Na1 Eu1 . 1_455 48.64(7) ? O11 Na1 Eu1 2_665 1_455 139.90(9) ? O15 Na1 Eu1 2_665 1_455 149.83(9) ? O14 Na1 Eu1 2_565 1_455 44.47(6) ? O3 Na1 Eu1 2_666 1_455 94.83(8) ? O1 Na1 Eu1 2_666 1_455 42.34(6) ? B6 Na1 Eu1 2_665 1_455 159.88(11) ? B4 Na1 Eu1 1_565 1_455 128.59(10) ? B1 Na1 Eu1 2_666 1_455 67.95(9) ? O6 Na1 Na2 . . 91.69(9) ? O11 Na1 Na2 2_665 . 102.26(8) ? O15 Na1 Na2 2_665 . 50.15(7) ? O14 Na1 Na2 2_565 . 157.61(10) ? O3 Na1 Na2 2_666 . 56.28(8) ? O1 Na1 Na2 2_666 . 90.35(8) ? B6 Na1 Na2 2_665 . 75.43(9) ? B4 Na1 Na2 1_565 . 109.11(10) ? B1 Na1 Na2 2_666 . 71.61(9) ? Eu1 Na1 Na2 1_455 . 117.62(6) ? O6 Na1 Na2 . 1_455 106.12(9) ? O11 Na1 Na2 2_665 1_455 103.65(8) ? O15 Na1 Na2 2_665 1_455 152.27(9) ? O14 Na1 Na2 2_565 1_455 38.63(7) ? O3 Na1 Na2 2_666 1_455 68.88(8) ? O1 Na1 Na2 2_666 1_455 46.85(7) ? B6 Na1 Na2 2_665 1_455 129.71(10) ? B4 Na1 Na2 1_565 1_455 79.19(9) ? B1 Na1 Na2 2_666 1_455 55.29(9) ? Eu1 Na1 Na2 1_455 1_455 57.48(4) ? Na2 Na1 Na2 . 1_455 124.70(8) ? O4 Na2 O14 1_665 2_665 139.32(13) ? O4 Na2 O2 1_665 . 127.05(11) ? O14 Na2 O2 2_665 . 77.65(10) ? O4 Na2 O15 1_665 2_665 134.25(11) ? O14 Na2 O15 2_665 2_665 57.32(9) ? O2 Na2 O15 . 2_665 95.22(10) ? O4 Na2 O1 1_665 . 73.31(10) ? O14 Na2 O1 2_665 . 120.22(11) ? O2 Na2 O1 . . 53.75(9) ? O15 Na2 O1 2_665 . 144.86(11) ? O4 Na2 O1 1_665 2_766 83.02(10) ? O14 Na2 O1 2_665 2_766 68.09(9) ? O2 Na2 O1 . 2_766 81.52(9) ? O15 Na2 O1 2_665 2_766 124.53(10) ? O1 Na2 O1 . 2_766 71.94(10) ? O4 Na2 O5 1_665 1_665 54.52(9) ? O14 Na2 O5 2_665 1_665 104.69(10) ? O2 Na2 O5 . 1_665 173.93(11) ? O15 Na2 O5 2_665 1_665 81.62(9) ? O1 Na2 O5 . 1_665 127.45(10) ? O1 Na2 O5 2_766 1_665 104.55(10) ? O4 Na2 B8 1_665 2_665 143.54(13) ? O14 Na2 B8 2_665 2_665 28.11(10) ? O2 Na2 B8 . 2_665 88.25(11) ? O15 Na2 B8 2_665 2_665 29.43(10) ? O1 Na2 B8 . 2_665 140.72(12) ? O1 Na2 B8 2_766 2_665 95.25(11) ? O5 Na2 B8 1_665 2_665 91.43(11) ? O4 Na2 O3 1_665 2_666 85.23(10) ? O14 Na2 O3 2_665 2_666 134.81(11) ? O2 Na2 O3 . 2_666 78.04(9) ? O15 Na2 O3 2_665 2_666 87.89(9) ? O1 Na2 O3 . 2_666 71.17(9) ? O1 Na2 O3 2_766 2_666 143.09(10) ? O5 Na2 O3 1_665 2_666 96.60(9) ? B8 Na2 O3 2_665 2_666 114.35(11) ? O4 Na2 B2 1_665 1_665 26.41(11) ? O14 Na2 B2 2_665 1_665 124.78(12) ? O2 Na2 B2 . 1_665 153.23(12) ? O15 Na2 B2 2_665 1_665 109.09(12) ? O1 Na2 B2 . 1_665 99.61(11) ? O1 Na2 B2 2_766 1_665 93.25(11) ? O5 Na2 B2 1_665 1_665 28.13(10) ? B8 Na2 B2 2_665 1_665 118.45(13) ? O3 Na2 B2 2_666 1_665 91.47(11) ? O4 Na2 B1 1_665 . 99.51(12) ? O14 Na2 B1 2_665 . 101.44(12) ? O2 Na2 B1 . . 27.63(10) ? O15 Na2 B1 2_665 . 120.22(12) ? O1 Na2 B1 . . 26.37(10) ? O1 Na2 B1 2_766 . 77.66(11) ? O5 Na2 B1 1_665 . 152.58(12) ? B8 Na2 B1 2_665 . 115.77(13) ? O3 Na2 B1 2_666 . 69.97(10) ? B2 Na2 B1 1_665 . 125.60(13) ? O4 Na2 B2 1_665 2_666 60.17(11) ? O14 Na2 B2 2_665 2_666 156.34(12) ? O2 Na2 B2 . 2_666 100.24(11) ? O15 Na2 B2 2_665 2_666 99.90(11) ? O1 Na2 B2 . 2_666 73.73(10) ? O1 Na2 B2 2_766 2_666 135.34(11) ? O5 Na2 B2 1_665 2_666 75.33(10) ? B8 Na2 B2 2_665 2_666 129.32(13) ? O3 Na2 B2 2_666 2_666 26.38(9) ? B2 Na2 B2 1_665 2_666 65.39(13) ? B1 Na2 B2 . 2_666 84.07(12) ? O9 Na3 O13 1_655 2_665 96.45(11) ? O9 Na3 O11 1_655 . 118.12(11) ? O13 Na3 O11 2_665 . 118.17(11) ? O9 Na3 O12 1_655 . 169.36(12) ? O13 Na3 O12 2_665 . 93.81(10) ? O11 Na3 O12 . . 58.49(9) ? O9 Na3 O10 1_655 2_655 58.08(9) ? O13 Na3 O10 2_665 2_655 111.76(10) ? O11 Na3 O10 . 2_655 129.84(11) ? O12 Na3 O10 . 2_655 115.17(11) ? O9 Na3 B7 1_655 1_655 26.57(10) ? O13 Na3 B7 2_665 1_655 102.93(12) ? O11 Na3 B7 . 1_655 93.01(11) ? O12 Na3 B7 . 1_655 151.40(12) ? O10 Na3 B7 2_655 1_655 80.05(11) ? O9 Na3 O13 1_655 1_655 50.20(8) ? O13 Na3 O13 2_665 1_655 87.85(10) ? O11 Na3 O13 . 1_655 79.80(9) ? O12 Na3 O13 . 1_655 133.31(10) ? O10 Na3 O13 2_655 1_655 107.21(9) ? B7 Na3 O13 1_655 1_655 27.67(9) ? O9 Na3 B6 1_655 . 146.77(12) ? O13 Na3 B6 2_665 . 106.88(11) ? O11 Na3 B6 . . 29.22(10) ? O12 Na3 B6 . . 29.32(10) ? O10 Na3 B6 2_655 . 128.85(11) ? B7 Na3 B6 1_655 . 122.23(13) ? O13 Na3 B6 1_655 . 106.43(11) ? O9 Na3 B5 1_655 1_655 28.18(10) ? O13 Na3 B5 2_665 1_655 106.16(11) ? O11 Na3 B5 . 1_655 128.92(12) ? O12 Na3 B5 . 1_655 144.37(12) ? O10 Na3 B5 2_655 1_655 29.91(9) ? B7 Na3 B5 1_655 1_655 51.45(12) ? O13 Na3 B5 1_655 1_655 77.73(10) ? B6 Na3 B5 . 1_655 146.81(12) ? O9 Na3 B4 1_655 2_655 97.29(11) ? O13 Na3 B4 2_665 2_655 136.36(12) ? O11 Na3 B4 . 2_655 23.57(10) ? O12 Na3 B4 . 2_655 77.01(10) ? O10 Na3 B4 2_655 2_655 110.68(11) ? B7 Na3 B4 1_655 2_655 74.86(11) ? O13 Na3 B4 1_655 2_655 70.31(10) ? B6 Na3 B4 . 2_655 49.56(11) ? B5 Na3 B4 1_655 2_655 105.35(12) ? O9 Na3 B8 1_655 2_665 93.10(11) ? O13 Na3 B8 2_665 2_665 24.34(9) ? O11 Na3 B8 . 2_665 138.14(12) ? O12 Na3 B8 . 2_665 95.10(11) ? O10 Na3 B8 2_655 2_665 89.49(10) ? B7 Na3 B8 1_655 2_665 109.71(12) ? O13 Na3 B8 1_655 2_665 104.21(10) ? B6 Na3 B8 . 2_665 117.77(12) ? B5 Na3 B8 1_655 2_665 91.92(11) ? B4 Na3 B8 2_655 2_665 159.83(12) ? O9 Na3 Na3 1_655 2_765 64.89(8) ? O13 Na3 Na3 2_665 2_765 50.31(7) ? O11 Na3 Na3 . 2_765 98.71(10) ? O12 Na3 Na3 . 2_765 124.66(10) ? O10 Na3 Na3 2_655 2_765 117.00(9) ? B7 Na3 Na3 1_655 2_765 56.94(9) ? O13 Na3 Na3 1_655 2_765 37.54(6) ? B6 Na3 Na3 . 2_765 113.26(11) ? B5 Na3 Na3 1_655 2_765 90.35(10) ? B4 Na3 Na3 2_655 2_765 100.47(10) ? B8 Na3 Na3 2_665 2_765 68.50(9) ? O1 B1 O3 . . 119.4(4) ? O1 B1 O2 . . 120.7(3) ? O3 B1 O2 . . 119.9(3) ? O1 B1 Na2 . . 64.7(2) ? O3 B1 Na2 . . 169.8(3) ? O2 B1 Na2 . . 56.84(18) ? O1 B1 Na1 . 2_666 62.1(2) ? O3 B1 Na1 . 2_666 57.49(19) ? O2 B1 Na1 . 2_666 174.5(3) ? Na2 B1 Na1 . 2_666 124.73(15) ? O4 B2 O5 . . 121.2(3) ? O4 B2 O3 . . 121.3(3) ? O5 B2 O3 . . 117.5(3) ? O4 B2 Na2 . 1_445 50.41(19) ? O5 B2 Na2 . 1_445 70.9(2) ? O3 B2 Na2 . 1_445 171.6(3) ? O4 B2 Na2 . 2_666 92.9(2) ? O5 B2 Na2 . 2_666 111.4(2) ? O3 B2 Na2 . 2_666 64.61(19) ? Na2 B2 Na2 1_445 2_666 114.61(13) ? O6 B3 O5 . . 106.9(3) ? O6 B3 O2 . . 113.2(3) ? O5 B3 O2 . . 111.9(3) ? O6 B3 O7 . . 110.3(3) ? O5 B3 O7 . . 110.6(3) ? O2 B3 O7 . . 104.1(3) ? O6 B3 Eu1 . 1_455 51.08(15) ? O5 B3 Eu1 . 1_455 60.53(17) ? O2 B3 Eu1 . 1_455 110.7(2) ? O7 B3 Eu1 . 1_455 144.9(2) ? O6 B3 Eu1 . . 125.1(2) ? O5 B3 Eu1 . . 127.0(2) ? O2 B3 Eu1 . . 58.88(16) ? O7 B3 Eu1 . . 45.24(14) ? Eu1 B3 Eu1 1_455 . 168.01(14) ? O8 B4 O11 . 2_655 119.2(3) ? O8 B4 O7 . . 120.2(3) ? O11 B4 O7 2_655 . 120.5(3) ? O8 B4 Na1 . 1_545 120.5(2) ? O11 B4 Na1 2_655 1_545 52.48(18) ? O7 B4 Na1 . 1_545 93.3(2) ? O8 B4 Na3 . 2_655 77.0(2) ? O11 B4 Na3 2_655 2_655 43.91(17) ? O7 B4 Na3 . 2_655 161.1(3) ? Na1 B4 Na3 1_545 2_655 83.07(11) ? O8 B5 O9 . . 111.8(3) ? O8 B5 O6 . . 113.4(3) ? O9 B5 O6 . . 106.9(3) ? O8 B5 O10 . 2 109.5(3) ? O9 B5 O10 . 2 108.5(3) ? O6 B5 O10 . 2 106.5(3) ? O8 B5 Na3 . 1_455 126.1(2) ? O9 B5 Na3 . 1_455 47.80(16) ? O6 B5 Na3 . 1_455 120.3(2) ? O10 B5 Na3 2 1_455 60.70(17) ? O8 B5 Eu1 . 1_455 131.4(2) ? O9 B5 Eu1 . 1_455 116.7(2) ? O6 B5 Eu1 . 1_455 55.09(16) ? O10 B5 Eu1 2 1_455 51.63(15) ? Na3 B5 Eu1 1_455 1_455 86.58(11) ? O12 B6 O15 . . 112.5(3) ? O12 B6 O10 . . 109.5(3) ? O15 B6 O10 . . 112.2(3) ? O12 B6 O11 . . 105.2(3) ? O15 B6 O11 . . 107.9(3) ? O10 B6 O11 . . 109.1(3) ? O12 B6 Na3 . . 54.32(16) ? O15 B6 Na3 . . 121.7(2) ? O10 B6 Na3 . . 125.9(2) ? O11 B6 Na3 . . 51.02(16) ? O12 B6 Na1 . 2_665 124.9(2) ? O15 B6 Na1 . 2_665 54.25(16) ? O10 B6 Na1 . 2_665 125.2(2) ? O11 B6 Na1 . 2_665 53.71(17) ? Na3 B6 Na1 . 2_665 85.92(12) ? O9 B7 O12 . . 126.6(3) ? O9 B7 O13 . . 114.0(3) ? O12 B7 O13 . . 119.3(3) ? O9 B7 Na3 . 1_455 49.44(18) ? O12 B7 Na3 . 1_455 145.9(3) ? O13 B7 Na3 . 1_455 77.8(2) ? O14 B8 O15 . . 122.5(3) ? O14 B8 O13 . . 119.2(3) ? O15 B8 O13 . . 118.3(3) ? O14 B8 Na2 . 2_665 58.18(19) ? O15 B8 Na2 . 2_665 65.00(19) ? O13 B8 Na2 . 2_665 171.2(3) ? O14 B8 Na3 . 2_665 83.5(2) ? O15 B8 Na3 . 2_665 144.1(2) ? O13 B8 Na3 . 2_665 43.63(16) ? Na2 B8 Na3 2_665 2_665 138.64(15) ? B1 O1 Eu1 . 2_766 173.2(3) ? B1 O1 Na2 . . 88.9(2) ? Eu1 O1 Na2 2_766 . 94.51(10) ? B1 O1 Na1 . 2_666 92.2(2) ? Eu1 O1 Na1 2_766 2_666 82.88(9) ? Na2 O1 Na1 . 2_666 164.30(13) ? B1 O1 Na2 . 2_766 98.6(2) ? Eu1 O1 Na2 2_766 2_766 85.96(9) ? Na2 O1 Na2 . 2_766 108.06(10) ? Na1 O1 Na2 2_666 2_766 87.26(10) ? B1 O2 B3 . . 122.7(3) ? B1 O2 Na2 . . 95.5(2) ? B3 O2 Na2 . . 140.1(2) ? B1 O2 Eu1 . . 111.3(2) ? B3 O2 Eu1 . . 93.68(19) ? Na2 O2 Eu1 . . 81.22(8) ? B1 O3 B2 . . 120.4(3) ? B1 O3 Na1 . 2_666 95.6(2) ? B2 O3 Na1 . 2_666 143.9(2) ? B1 O3 Na2 . 2_666 118.9(2) ? B2 O3 Na2 . 2_666 89.0(2) ? Na1 O3 Na2 2_666 2_666 74.45(9) ? B2 O4 Eu1 . 2_656 148.8(3) ? B2 O4 Na2 . 1_445 103.2(2) ? Eu1 O4 Na2 2_656 1_445 107.70(11) ? B2 O5 B3 . . 123.2(3) ? B2 O5 Eu1 . 1_455 112.9(2) ? B3 O5 Eu1 . 1_455 91.30(19) ? B2 O5 Na2 . 1_445 81.0(2) ? B3 O5 Na2 . 1_445 145.0(2) ? Eu1 O5 Na2 1_455 1_445 102.41(9) ? B3 O6 B5 . . 118.4(3) ? B3 O6 Na1 . . 116.3(2) ? B5 O6 Na1 . . 123.4(2) ? B3 O6 Eu1 . 1_455 101.8(2) ? B5 O6 Eu1 . 1_455 95.49(19) ? Na1 O6 Eu1 . 1_455 86.56(9) ? B4 O7 B3 . . 119.0(3) ? B4 O7 Eu1 . . 128.3(2) ? B3 O7 Eu1 . . 108.37(19) ? B4 O8 B5 . . 122.9(3) ? B7 O9 B5 . . 132.7(3) ? B7 O9 Na3 . 1_455 104.0(2) ? B5 O9 Na3 . 1_455 104.0(2) ? B6 O10 B5 . 2 123.3(3) ? B6 O10 Eu1 . 2_655 125.3(2) ? B5 O10 Eu1 2 2_655 98.92(19) ? B6 O10 Na3 . 2_655 103.5(2) ? B5 O10 Na3 2 2_655 89.40(19) ? Eu1 O10 Na3 2_655 2_655 110.76(10) ? B4 O11 B6 2_655 . 129.8(3) ? B4 O11 Na3 2_655 . 112.5(2) ? B6 O11 Na3 . . 99.8(2) ? B4 O11 Na1 2_655 2_665 101.2(2) ? B6 O11 Na1 . 2_665 96.9(2) ? Na3 O11 Na1 . 2_665 116.74(12) ? B7 O12 B6 . . 120.4(3) ? B7 O12 Na3 . . 126.2(2) ? B6 O12 Na3 . . 96.36(19) ? B8 O13 B7 . . 119.8(3) ? B8 O13 Na3 . 2_665 112.0(2) ? B7 O13 Na3 . 2_665 122.9(2) ? B8 O13 Na3 . 1_455 128.0(2) ? B7 O13 Na3 . 1_455 74.51(19) ? Na3 O13 Na3 2_665 1_455 92.15(10) ? B8 O14 Eu1 . 2_665 155.4(2) ? B8 O14 Na2 . 2_665 93.7(2) ? Eu1 O14 Na2 2_665 2_665 93.30(10) ? B8 O14 Na1 . 2_565 115.8(2) ? Eu1 O14 Na1 2_665 2_565 85.95(9) ? Na2 O14 Na1 2_665 2_565 100.43(12) ? B8 O15 B6 . . 122.3(3) ? B8 O15 Na1 . 2_665 122.6(2) ? B6 O15 Na1 . 2_665 96.41(19) ? B8 O15 Na2 . 2_665 85.6(2) ? B6 O15 Na2 . 2_665 145.0(2) ? Na1 O15 Na2 2_665 2_665 82.68(10) ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Eu1 O4 2_656 2.232(3) ? Eu1 O1 2_766 2.241(3) ? Eu1 O14 2_665 2.319(3) ? Eu1 O10 2_655 2.391(2) ? Eu1 O7 . 2.392(2) ? Eu1 O6 1_655 2.483(2) ? Eu1 O5 1_655 2.720(3) ? Eu1 O2 . 2.743(2) ? Eu1 B5 1_655 3.013(4) ? Eu1 B3 1_655 3.123(4) ? Eu1 B3 . 3.197(4) ? Eu1 Na1 1_655 3.3014(17) ? Na1 O6 . 2.330(3) ? Na1 O11 2_665 2.434(3) ? Na1 O15 2_665 2.448(3) ? Na1 O14 2_565 2.520(3) ? Na1 O3 2_666 2.604(3) ? Na1 O1 2_666 2.718(3) ? Na1 B6 2_665 2.998(4) ? Na1 B4 1_565 3.010(4) ? Na1 B1 2_666 3.073(5) ? Na1 Eu1 1_455 3.3013(17) ? Na1 Na2 . 3.311(3) ? Na1 Na2 1_455 3.781(3) ? Na2 O4 1_665 2.291(3) ? Na2 O14 2_665 2.400(3) ? Na2 O2 . 2.523(3) ? Na2 O15 2_665 2.563(3) ? Na2 O1 . 2.713(3) ? Na2 O1 2_766 2.762(3) ? Na2 O5 1_665 2.768(3) ? Na2 B8 2_665 2.819(4) ? Na2 O3 2_666 2.858(3) ? Na2 B2 1_665 2.894(5) ? Na2 B1 . 3.000(5) ? Na2 B2 2_666 3.164(4) ? Na3 O9 1_655 2.296(3) ? Na3 O13 2_665 2.356(3) ? Na3 O11 . 2.361(3) ? Na3 O12 . 2.447(3) ? Na3 O10 2_655 2.623(3) ? Na3 B7 1_655 2.933(4) ? Na3 O13 1_655 2.975(3) ? Na3 B6 . 2.993(4) ? Na3 B5 1_655 3.007(4) ? Na3 B4 2_655 3.145(5) ? Na3 B8 2_665 3.165(4) ? Na3 Na3 2_765 3.863(4) ? B1 O1 . 1.333(5) ? B1 O3 . 1.397(5) ? B1 O2 . 1.398(5) ? B1 Na1 2_666 3.073(5) ? B2 O4 . 1.322(5) ? B2 O5 . 1.381(5) ? B2 O3 . 1.406(5) ? B2 Na2 1_445 2.894(4) ? B2 Na2 2_666 3.164(4) ? B3 O6 . 1.455(5) ? B3 O5 . 1.475(5) ? B3 O2 . 1.476(4) ? B3 O7 . 1.497(4) ? B3 Eu1 1_455 3.123(4) ? B4 O8 . 1.349(5) ? B4 O11 2_655 1.362(5) ? B4 O7 . 1.375(5) ? B4 Na1 1_545 3.010(4) ? B4 Na3 2_655 3.145(5) ? B5 O8 . 1.457(5) ? B5 O9 . 1.464(5) ? B5 O6 . 1.487(5) ? B5 O10 2 1.500(5) ? B5 Na3 1_455 3.007(4) ? B5 Eu1 1_455 3.013(4) ? B6 O12 . 1.475(5) ? B6 O15 . 1.478(5) ? B6 O10 . 1.483(4) ? B6 O11 . 1.483(5) ? B6 Na1 2_665 2.998(4) ? B7 O9 . 1.352(5) ? B7 O12 . 1.354(5) ? B7 O13 . 1.414(5) ? B7 Na3 1_455 2.933(4) ? B8 O14 . 1.331(5) ? B8 O15 . 1.389(5) ? B8 O13 . 1.407(5) ? B8 Na2 2_665 2.819(4) ? B8 Na3 2_665 3.165(4) ? O1 Eu1 2_766 2.241(3) ? O1 Na1 2_666 2.718(3) ? O1 Na2 2_766 2.762(3) ? O3 Na1 2_666 2.604(3) ? O3 Na2 2_666 2.858(3) ? O4 Eu1 2_656 2.232(3) ? O4 Na2 1_445 2.291(3) ? O5 Eu1 1_455 2.720(3) ? O5 Na2 1_445 2.768(3) ? O6 Eu1 1_455 2.483(2) ? O9 Na3 1_455 2.296(3) ? O10 B5 2 1.500(5) ? O10 Eu1 2_655 2.391(2) ? O10 Na3 2_655 2.623(3) ? O11 B4 2_655 1.362(5) ? O11 Na1 2_665 2.434(3) ? O13 Na3 2_665 2.356(3) ? O13 Na3 1_455 2.975(3) ? O14 Eu1 2_665 2.318(3) ? O14 Na2 2_665 2.400(3) ? O14 Na1 2_565 2.520(3) ? O15 Na1 2_665 2.448(3) ? O15 Na2 2_665 2.563(3) ? _cod_database_fobs_code 2022367