# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_b
_database_code_depnum_ccdc_archive 'CCDC 1840310'
_audit_update_record             
;
2018-04-28 deposited with the CCDC.
2018-10-18 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'B14 F4 Na6 O22'
_chemical_formula_weight         717.28

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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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'

_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_H-M   Pnma

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z'
'x+1/2, -y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z'
'-x-1/2, y-1/2, z-1/2'

_cell_length_a                   9.2659(12)
_cell_length_b                   16.3431(16)
_cell_length_c                   6.6326(5)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     1004.40(18)
_cell_formula_units_Z            2
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    2071
_cell_measurement_theta_min      3.3320
_cell_measurement_theta_max      29.6860

_exptl_crystal_description       plate
_exptl_crystal_colour            ?
_exptl_crystal_size_max          ?
_exptl_crystal_size_mid          ?
_exptl_crystal_size_min          ?
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.372
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             696
_exptl_absorpt_coefficient_mu    0.340
_exptl_absorpt_correction_type   ?
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  Rigaku
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            8125
_diffrn_reflns_av_R_equivalents  0.0475
_diffrn_reflns_av_sigmaI/netI    0.0332
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -8
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_theta_min         3.31
_diffrn_reflns_theta_max         26.37
_reflns_number_total             1059
_reflns_number_gt                787
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0734P)²+0.1817P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   ?
_refine_ls_hydrogen_treatment    ?
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         1059
_refine_ls_number_parameters     112
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0514
_refine_ls_R_factor_gt           0.0386
_refine_ls_wR_factor_ref         0.1184
_refine_ls_wR_factor_gt          0.1081
_refine_ls_goodness_of_fit_ref   1.052
_refine_ls_restrained_S_all      1.052
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Na1 Na 1.05858(12) 0.7500 1.25115(14) 0.0221(3) Uani 1 2 d S . .
Na2 Na 1.05872(9) 0.62907(5) 0.75319(10) 0.0270(3) Uani 1 1 d . . .
B1 B 0.4360(2) 0.55475(13) 0.1891(3) 0.0159(4) Uani 1 1 d . . .
B2 B 0.6823(2) 0.55239(13) 0.3145(3) 0.0168(5) Uani 1 1 d . . .
B3 B 0.8093(3) 0.7500 0.8045(4) 0.0162(6) Uani 1 2 d S . .
B4 B 0.8079(2) 0.67208(12) 0.4763(3) 0.0153(5) Uani 1 1 d . . .
O1 O 0.80456(19) 0.7500 0.3792(2) 0.0178(5) Uani 1 2 d S . .
O2 O 0.67658(13) 0.62421(8) 0.41104(18) 0.0173(4) Uani 1 1 d . . .
O3 O 0.55836(13) 0.51363(8) 0.25025(18) 0.0194(4) Uani 1 1 d . . .
O4 O 0.44091(14) 0.62677(8) 0.09423(18) 0.0181(4) Uani 1 1 d . . .
O5 O 0.31010(13) 0.51300(9) 0.2273(2) 0.0226(4) Uani 1 1 d . . .
O6 O 0.81014(14) 0.67592(8) 0.69328(19) 0.0204(4) Uani 1 1 d . . .
F7 F 0.68188(18) 0.7500 0.9331(2) 0.0314(5) Uani 1 2 d S . .
F8 F 0.93387(19) 0.7500 0.9374(2) 0.0320(5) Uani 1 2 d S . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Na1 F8 2.3804(17) . ?
Na1 F7 2.3856(18) 6_658 ?
Na1 O1 2.438(2) 6_657 ?
Na1 O1 2.502(2) 1_556 ?
Na1 O4 2.5093(14) 6_657 ?
Na1 O4 2.5093(14) 4_566 ?
Na1 O2 2.5651(14) 6_657 ?
Na1 O2 2.5651(14) 4_566 ?
Na1 B4 3.039(2) 6_657 ?
Na1 B4 3.039(2) 4_566 ?
Na1 B4 3.041(2) 1_556 ?
Na1 B4 3.041(2) 7_576 ?
Na2 O6 2.4595(15) . ?
Na2 O6 2.4779(15) 6_657 ?
Na2 O2 2.4817(14) 6_657 ?
Na2 O4 2.5500(14) 6_656 ?
Na2 O3 2.5722(17) 2_665 ?
Na2 F8 2.5956(15) . ?
Na2 F7 2.5952(15) 6_657 ?
Na2 O5 2.6264(16) 2_665 ?
Na2 B4 3.007(2) 6_657 ?
Na2 B1 3.035(2) 2_665 ?
Na2 B4 3.044(2) . ?
Na2 B3 3.060(2) . ?
B1 O4 1.335(2) . ?
B1 O5 1.375(2) . ?
B1 O3 1.379(2) . ?
B1 Na2 3.035(2) 2_664 ?
B2 O2 1.338(2) . ?
B2 O5 1.376(2) 6_656 ?
B2 O3 1.379(2) . ?
B3 O6 1.418(2) . ?
B3 O6 1.418(2) 7_575 ?
B3 F8 1.452(3) . ?
B3 F7 1.456(3) . ?
B3 Na2 3.060(2) 7_575 ?
B3 Na2 3.073(2) 6_557 ?
B3 Na2 3.073(2) 4_466 ?
B4 O1 1.427(2) . ?
B4 O6 1.440(2) . ?
B4 O2 1.510(2) . ?
B4 O4 1.512(2) 6_656 ?
B4 Na2 3.007(2) 6_557 ?
B4 Na1 3.039(2) 6_557 ?
B4 Na1 3.041(2) 1_554 ?
O1 B4 1.427(2) 7_575 ?
O1 Na1 2.438(2) 6_557 ?
O1 Na1 2.502(2) 1_554 ?
O2 Na2 2.4817(14) 6_557 ?
O2 Na1 2.5651(14) 6_557 ?
O3 Na2 2.5722(17) 2_664 ?
O4 B4 1.512(2) 6_556 ?
O4 Na1 2.5093(14) 6_557 ?
O4 Na2 2.5500(14) 6_556 ?
O5 B2 1.376(2) 6_556 ?
O5 Na2 2.6264(16) 2_664 ?
O6 Na2 2.4779(15) 6_557 ?
F7 Na1 2.3856(18) 6_558 ?
F7 Na2 2.5952(14) 6_557 ?
F7 Na2 2.5952(14) 4_466 ?
F8 Na2 2.5956(15) 7_575 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
F8 Na1 F7 179.57(8) . 6_658 ?
F8 Na1 O1 98.27(7) . 6_657 ?
F7 Na1 O1 82.16(7) 6_658 6_657 ?
F8 Na1 O1 80.80(7) . 1_556 ?
F7 Na1 O1 98.77(6) 6_658 1_556 ?
O1 Na1 O1 179.07(5) 6_657 1_556 ?
F8 Na1 O4 98.42(5) . 6_657 ?
F7 Na1 O4 81.33(5) 6_658 6_657 ?
O1 Na1 O4 123.45(4) 6_657 6_657 ?
O1 Na1 O4 56.81(4) 1_556 6_657 ?
F8 Na1 O4 98.42(5) . 4_566 ?
F7 Na1 O4 81.33(5) 6_658 4_566 ?
O1 Na1 O4 123.45(4) 6_657 4_566 ?
O1 Na1 O4 56.81(4) 1_556 4_566 ?
O4 Na1 O4 106.76(7) 6_657 4_566 ?
F8 Na1 O2 80.81(4) . 6_657 ?
F7 Na1 O2 99.44(5) 6_658 6_657 ?
O1 Na1 O2 56.82(4) 6_657 6_657 ?
O1 Na1 O2 122.91(4) 1_556 6_657 ?
O4 Na1 O2 73.34(4) 6_657 6_657 ?
O4 Na1 O2 179.23(6) 4_566 6_657 ?
F8 Na1 O2 80.81(4) . 4_566 ?
F7 Na1 O2 99.44(5) 6_658 4_566 ?
O1 Na1 O2 56.82(4) 6_657 4_566 ?
O1 Na1 O2 122.91(4) 1_556 4_566 ?
O4 Na1 O2 179.23(6) 6_657 4_566 ?
O4 Na1 O2 73.34(4) 4_566 4_566 ?
O2 Na1 O2 106.55(7) 6_657 4_566 ?
F8 Na1 B4 86.27(6) . 6_657 ?
F7 Na1 B4 94.12(6) 6_658 6_657 ?
O1 Na1 B4 27.52(4) 6_657 6_657 ?
O1 Na1 B4 152.08(5) 1_556 6_657 ?
O4 Na1 B4 101.36(5) 6_657 6_657 ?
O4 Na1 B4 150.40(6) 4_566 6_657 ?
O2 Na1 B4 29.76(5) 6_657 6_657 ?
O2 Na1 B4 78.67(5) 4_566 6_657 ?
F8 Na1 B4 86.27(6) . 4_566 ?
F7 Na1 B4 94.12(6) 6_658 4_566 ?
O1 Na1 B4 27.52(4) 6_657 4_566 ?
O1 Na1 B4 152.08(4) 1_556 4_566 ?
O4 Na1 B4 150.40(6) 6_657 4_566 ?
O4 Na1 B4 101.36(5) 4_566 4_566 ?
O2 Na1 B4 78.67(5) 6_657 4_566 ?
O2 Na1 B4 29.76(5) 4_566 4_566 ?
B4 Na1 B4 49.55(8) 6_657 4_566 ?
F8 Na1 B4 93.36(6) . 1_556 ?
F7 Na1 B4 86.25(6) 6_658 1_556 ?
O1 Na1 B4 152.67(4) 6_657 1_556 ?
O1 Na1 B4 27.73(4) 1_556 1_556 ?
O4 Na1 B4 29.69(5) 6_657 1_556 ?
O4 Na1 B4 78.67(5) 4_566 1_556 ?
O2 Na1 B4 101.30(5) 6_657 1_556 ?
O2 Na1 B4 150.14(5) 4_566 1_556 ?
B4 Na1 B4 130.47(7) 6_657 1_556 ?
B4 Na1 B4 179.63(5) 4_566 1_556 ?
F8 Na1 B4 93.36(6) . 7_576 ?
F7 Na1 B4 86.25(6) 6_658 7_576 ?
O1 Na1 B4 152.67(4) 6_657 7_576 ?
O1 Na1 B4 27.73(4) 1_556 7_576 ?
O4 Na1 B4 78.67(5) 6_657 7_576 ?
O4 Na1 B4 29.69(5) 4_566 7_576 ?
O2 Na1 B4 150.14(5) 6_657 7_576 ?
O2 Na1 B4 101.30(5) 4_566 7_576 ?
B4 Na1 B4 179.63(5) 6_657 7_576 ?
B4 Na1 B4 130.47(7) 4_566 7_576 ?
B4 Na1 B4 49.51(8) 1_556 7_576 ?
O6 Na2 O6 143.84(7) . 6_657 ?
O6 Na2 O2 124.55(5) . 6_657 ?
O6 Na2 O2 57.83(4) 6_657 6_657 ?
O6 Na2 O4 57.16(4) . 6_656 ?
O6 Na2 O4 122.45(5) 6_657 6_656 ?
O2 Na2 O4 177.21(6) 6_657 6_656 ?
O6 Na2 O3 83.46(5) . 2_665 ?
O6 Na2 O3 132.67(6) 6_657 2_665 ?
O2 Na2 O3 99.40(5) 6_657 2_665 ?
O4 Na2 O3 78.42(4) 6_656 2_665 ?
O6 Na2 F8 54.66(5) . . ?
O6 Na2 F8 96.68(5) 6_657 . ?
O2 Na2 F8 78.36(5) 6_657 . ?
O4 Na2 F8 104.23(5) 6_656 . ?
O3 Na2 F8 120.40(6) 2_665 . ?
O6 Na2 F7 95.61(5) . 6_657 ?
O6 Na2 F7 54.51(5) 6_657 6_657 ?
O2 Na2 F7 104.96(5) 6_657 6_657 ?
O4 Na2 F7 76.66(5) 6_656 6_657 ?
O3 Na2 F7 150.73(5) 2_665 6_657 ?
F8 Na2 F7 80.81(5) . 6_657 ?
O6 Na2 O5 134.28(5) . 2_665 ?
O6 Na2 O5 81.22(5) 6_657 2_665 ?
O2 Na2 O5 80.01(5) 6_657 2_665 ?
O4 Na2 O5 97.24(5) 6_656 2_665 ?
O3 Na2 O5 52.64(4) 2_665 2_665 ?
F8 Na2 O5 155.53(5) . 2_665 ?
F7 Na2 O5 116.02(5) 6_657 2_665 ?
O6 Na2 B4 137.95(6) . 6_657 ?
O6 Na2 B4 28.41(5) 6_657 6_657 ?
O2 Na2 B4 30.03(5) 6_657 6_657 ?
O4 Na2 B4 150.59(6) 6_656 6_657 ?
O3 Na2 B4 122.70(6) 2_665 6_657 ?
F8 Na2 B4 83.30(6) . 6_657 ?
F7 Na2 B4 76.61(5) 6_657 6_657 ?
O5 Na2 B4 83.70(5) 2_665 6_657 ?
O6 Na2 B1 107.50(6) . 2_665 ?
O6 Na2 B1 108.11(6) 6_657 2_665 ?
O2 Na2 B1 94.99(5) 6_657 2_665 ?
O4 Na2 B1 82.28(5) 6_656 2_665 ?
O3 Na2 B1 26.89(5) 2_665 2_665 ?
F8 Na2 B1 145.79(6) . 2_665 ?
F7 Na2 B1 132.85(6) 6_657 2_665 ?
O5 Na2 B1 26.90(5) 2_665 2_665 ?
B4 Na2 B1 107.62(6) 6_657 2_665 ?
O6 Na2 B4 27.84(5) . . ?
O6 Na2 B4 137.13(6) 6_657 . ?
O2 Na2 B4 152.21(6) 6_657 . ?
O4 Na2 B4 29.72(5) 6_656 . ?
O3 Na2 B4 83.27(5) 2_665 . ?
F8 Na2 B4 76.57(6) . . ?
F7 Na2 B4 82.68(6) 6_657 . ?
O5 Na2 B4 121.21(5) 2_665 . ?
B4 Na2 B4 153.13(8) 6_657 . ?
B1 Na2 B4 99.00(6) 2_665 . ?
O6 Na2 B3 27.08(5) . . ?
O6 Na2 B3 119.64(6) 6_657 . ?
O2 Na2 B3 104.67(6) 6_657 . ?
O4 Na2 B3 77.69(6) 6_656 . ?
O3 Na2 B3 105.54(5) 2_665 . ?
F8 Na2 B3 28.26(6) . . ?
F7 Na2 B3 83.87(5) 6_657 . ?
O5 Na2 B3 158.10(5) 2_665 . ?
B4 Na2 B3 111.25(6) 6_657 . ?
B1 Na2 B3 131.85(6) 2_665 . ?
B4 Na2 B3 48.80(6) . . ?
O4 B1 O5 123.59(17) . . ?
O4 B1 O3 122.69(16) . . ?
O5 B1 O3 113.67(16) . . ?
O4 B1 Na2 159.72(13) . 2_664 ?
O5 B1 Na2 59.77(9) . 2_664 ?
O3 B1 Na2 57.52(9) . 2_664 ?
O2 B2 O5 122.75(16) . 6_656 ?
O2 B2 O3 121.18(17) . . ?
O5 B2 O3 116.07(16) 6_656 . ?
O6 B3 O6 117.3(2) . 7_575 ?
O6 B3 F8 108.15(14) . . ?
O6 B3 F8 108.15(14) 7_575 . ?
O6 B3 F7 108.01(14) . . ?
O6 B3 F7 108.01(14) 7_575 . ?
F8 B3 F7 106.8(2) . . ?
O6 B3 Na2 119.31(16) . 7_575 ?
O6 B3 Na2 52.15(9) 7_575 7_575 ?
F8 B3 Na2 57.81(8) . 7_575 ?
F7 B3 Na2 132.64(8) . 7_575 ?
O6 B3 Na2 52.15(9) . . ?
O6 B3 Na2 119.31(16) 7_575 . ?
F8 B3 Na2 57.81(8) . . ?
F7 B3 Na2 132.64(8) . . ?
Na2 B3 Na2 80.47(7) 7_575 . ?
O6 B3 Na2 52.42(10) . 6_557 ?
O6 B3 Na2 119.24(15) 7_575 6_557 ?
F8 B3 Na2 132.54(9) . 6_557 ?
F7 B3 Na2 57.35(8) . 6_557 ?
Na2 B3 Na2 166.46(10) 7_575 6_557 ?
Na2 B3 Na2 98.13(3) . 6_557 ?
O6 B3 Na2 119.24(15) . 4_466 ?
O6 B3 Na2 52.42(9) 7_575 4_466 ?
F8 B3 Na2 132.54(9) . 4_466 ?
F7 B3 Na2 57.35(8) . 4_466 ?
Na2 B3 Na2 98.13(3) 7_575 4_466 ?
Na2 B3 Na2 166.46(10) . 4_466 ?
Na2 B3 Na2 80.05(7) 6_557 4_466 ?
O1 B4 O6 114.35(15) . . ?
O1 B4 O2 108.39(15) . . ?
O6 B4 O2 108.71(14) . . ?
O1 B4 O4 108.35(15) . 6_656 ?
O6 B4 O4 108.58(14) . 6_656 ?
O2 B4 O4 108.31(14) . 6_656 ?
O1 B4 Na2 117.46(13) . 6_557 ?
O6 B4 Na2 54.93(8) . 6_557 ?
O2 B4 Na2 55.34(8) . 6_557 ?
O4 B4 Na2 134.10(12) 6_656 6_557 ?
O1 B4 Na1 52.09(10) . 6_557 ?
O6 B4 Na1 119.26(12) . 6_557 ?
O2 B4 Na1 57.47(8) . 6_557 ?
O4 B4 Na1 132.16(11) 6_656 6_557 ?
Na2 B4 Na1 79.08(5) 6_557 6_557 ?
O1 B4 Na1 54.64(10) . 1_554 ?
O6 B4 Na1 117.47(12) . 1_554 ?
O2 B4 Na1 133.76(11) . 1_554 ?
O4 B4 Na1 55.28(8) 6_656 1_554 ?
Na2 B4 Na1 167.78(8) 6_557 1_554 ?
Na1 B4 Na1 99.29(6) 6_557 1_554 ?
O1 B4 Na2 119.65(12) . . ?
O6 B4 Na2 52.88(9) . . ?
O2 B4 Na2 131.95(11) . . ?
O4 B4 Na2 56.72(8) 6_656 . ?
Na2 B4 Na2 99.92(6) 6_557 . ?
Na1 B4 Na2 167.58(8) 6_557 . ?
Na1 B4 Na2 79.04(5) 1_554 . ?
B4 O1 B4 126.27(19) 7_575 . ?
B4 O1 Na1 100.39(11) 7_575 6_557 ?
B4 O1 Na1 100.39(11) . 6_557 ?
B4 O1 Na1 97.63(11) 7_575 1_554 ?
B4 O1 Na1 97.63(11) . 1_554 ?
Na1 O1 Na1 139.39(7) 6_557 1_554 ?
B2 O2 B4 124.04(14) . . ?
B2 O2 Na2 118.36(11) . 6_557 ?
B4 O2 Na2 94.63(9) . 6_557 ?
B2 O2 Na1 121.28(11) . 6_557 ?
B4 O2 Na1 92.78(9) . 6_557 ?
Na2 O2 Na1 99.39(5) 6_557 6_557 ?
B1 O3 B2 123.49(15) . . ?
B1 O3 Na2 95.59(10) . 2_664 ?
B2 O3 Na2 139.94(12) . 2_664 ?
B1 O4 B4 123.34(14) . 6_556 ?
B1 O4 Na1 121.98(11) . 6_557 ?
B4 O4 Na1 95.02(10) 6_556 6_557 ?
B1 O4 Na2 116.96(11) . 6_556 ?
B4 O4 Na2 93.56(9) 6_556 6_556 ?
Na1 O4 Na2 99.88(5) 6_557 6_556 ?
B1 O5 B2 117.43(15) . 6_556 ?
B1 O5 Na2 93.33(11) . 2_664 ?
B2 O5 Na2 145.59(12) 6_556 2_664 ?
B3 O6 B4 123.84(15) . . ?
B3 O6 Na2 100.77(13) . . ?
B4 O6 Na2 99.29(11) . . ?
B3 O6 Na2 100.61(13) . 6_557 ?
B4 O6 Na2 96.66(10) . 6_557 ?
Na2 O6 Na2 139.56(7) . 6_557 ?
B3 F7 Na1 154.46(15) . 6_558 ?
B3 F7 Na2 94.45(9) . 6_557 ?
Na1 F7 Na2 101.97(5) 6_558 6_557 ?
B3 F7 Na2 94.45(9) . 4_466 ?
Na1 F7 Na2 101.97(5) 6_558 4_466 ?
Na2 F7 Na2 99.20(7) 6_557 4_466 ?
B3 F8 Na1 156.41(16) . . ?
B3 F8 Na2 93.93(9) . . ?
Na1 F8 Na2 101.25(5) . . ?
B3 F8 Na2 93.93(9) . 7_575 ?
Na1 F8 Na2 101.25(5) . 7_575 ?
Na2 F8 Na2 99.18(7) . 7_575 ?

_diffrn_measured_fraction_theta_max 0.994
_diffrn_reflns_theta_full        26.37
_diffrn_measured_fraction_theta_full 0.994
_refine_diff_density_max         0.421
_refine_diff_density_min         -0.332
_refine_diff_density_rms         0.076
