#------------------------------------------------------------------------------
#$Date: 2021-04-08 11:44:37 +0300 (Thu, 08 Apr 2021) $
#$Revision: 263979 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/15/1561570.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1561570
loop_
_publ_author_name
'Yeon, Jeongho'
'Smith, Mark D.'
'Tapp, Joshua'
'Möller, Angela'
'zur Loye, Hans-Conrad'
_publ_section_title
;
 Mild hydrothermal crystal growth of new uranium(IV) fluorides,
 Na3.13Mg1.43U6F30 and Na2.50Mn1.75U6F30: Structures, optical and magnetic
 properties
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              83
_journal_page_last               88
_journal_paper_doi               10.1016/j.jssc.2015.04.036
_journal_volume                  236
_journal_year                    2016
_chemical_formula_sum            'F30 Mg1.43 Na3.13 U6'
_chemical_formula_weight         2105.05
_space_group_crystal_system      trigonal
_space_group_IT_number           165
_space_group_name_Hall           '-P 3 2"c'
_space_group_name_H-M_alt        'P -3 c 1'
_atom_sites_solution_hydrogens   .
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   9.8594(3)
_cell_length_b                   9.8594(3)
_cell_length_c                   13.0211(8)
_cell_measurement_reflns_used    9954
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      36.212
_cell_measurement_theta_min      2.386
_cell_volume                     1096.17(8)
_computing_cell_refinement       'SAINT-Plus Version 6.45 (Bruker, 2001)'
_computing_data_collection       'SMART Version 5.625 (Bruker, 2001)'
_computing_data_reduction        'SAINT-Plus Version 6.45 (Bruker, 2001)'
_computing_molecular_graphics    various
_computing_publication_material  various
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker SMART APEX CCD diffractometer'
_diffrn_measurement_method       'omega and phi scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0493
_diffrn_reflns_av_unetI/netI     0.0204
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            30480
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         36.343
_diffrn_reflns_theta_min         2.385
_diffrn_source                   'sealed tube'
_exptl_absorpt_coefficient_mu    44.508
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.2796
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS Version 2.05 (Bruker, 2001)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    6.378
_exptl_crystal_description       'trigonal antiprism'
_exptl_crystal_F_000             1747
_exptl_crystal_size_max          0.080
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.040
_refine_diff_density_max         2.484
_refine_diff_density_min         -1.666
_refine_diff_density_rms         0.350
_refine_ls_extinction_coef       0.00074(6)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.190
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     67
_refine_ls_number_reflns         1785
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.190
_refine_ls_R_factor_all          0.0281
_refine_ls_R_factor_gt           0.0256
_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/[σ²(Fo²)+(0.0194P)²+10.9117P] 
 where P=(Fo²+2Fc²)/3 
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0535
_refine_ls_wR_factor_ref         0.0542
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1701
_reflns_number_total             1785
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            JSSC-2016-236-83.cif
_cod_data_source_block           Na3.13Mg1.43U6F30
_cod_original_cell_volume        1096.17(9)
_cod_database_code               1561570
_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. 
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z+1/2'
'x-y, -y, -z+1/2'
'-x, -x+y, -z+1/2'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z-1/2'
'-x+y, y, z-1/2'
'x, x-y, z-1/2'
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
U1 U 0.39740(2) 0.32101(2) 0.39786(2) 0.00731(6) Uani 1 1 d . . . . .
Mg1 Mg 0.0000 0.0000 0.2500 0.0074(6) Uani 1 6 d S T P . .
Na1 Na 0.3333 0.6667 0.3377(2) 0.0051(5) Uani 0.7829 3 d S T P . .
Mg2 Mg 0.3333 0.6667 0.3377(2) 0.0051(5) Uani 0.2171 3 d S T P . .
Na2 Na 0.0000 0.0000 0.5000 0.0161(9) Uani 1 6 d S T P . .
Na3 Na 0.038(3) 0.339(4) 0.284(2) 0.025 Uiso 0.094(8) 1 d . U . . .
F1 F 0.3054(3) 0.4379(3) 0.2841(2) 0.0112(5) Uani 1 1 d . . . . .
F2 F 0.1909(3) 0.3104(3) 0.4818(2) 0.0109(5) Uani 1 1 d . . . . .
F3 F 0.5339(3) 0.4138(3) 0.5514(2) 0.0117(5) Uani 1 1 d . . . . .
F4 F 0.1845(3) 0.1068(3) 0.3397(2) 0.0121(5) Uani 1 1 d . . . . .
F5 F 0.5124(4) 0.1699(3) 0.3609(2) 0.0133(5) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
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'
Mg Mg 0.0486 0.0363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
U U -9.6767 9.6646 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
F4 U1 F2 73.89(10) . .
F4 U1 F5 141.98(11) . 3_665
F2 U1 F5 142.05(11) . 3_665
F4 U1 F1 80.66(10) . .
F2 U1 F1 76.43(10) . .
F5 U1 F1 94.87(11) 3_665 .
F4 U1 F3 138.35(10) . .
F2 U1 F3 86.20(10) . .
F5 U1 F3 71.31(10) 3_665 .
F1 U1 F3 130.21(10) . .
F4 U1 F5 81.58(11) . .
F2 U1 F5 141.58(11) . .
F5 U1 F5 71.82(15) 3_665 .
F1 U1 F5 128.45(10) . .
F3 U1 F5 93.32(10) . .
F4 U1 F2 69.61(10) . 8_556
F2 U1 F2 72.39(11) . 8_556
F5 U1 F2 123.55(10) 3_665 8_556
F1 U1 F2 141.57(10) . 8_556
F3 U1 F2 69.60(10) . 8_556
F5 U1 F2 71.53(10) . 8_556
F4 U1 F1 73.47(10) . 4
F2 U1 F1 129.93(10) . 4
F5 U1 F1 71.35(10) 3_665 4
F1 U1 F1 61.63(12) . 4
F3 U1 F1 141.68(10) . 4
F5 U1 F1 66.97(10) . 4
F2 U1 F1 127.32(10) 8_556 4
F4 U1 F3 136.83(10) . 7_666
F2 U1 F3 71.36(10) . 7_666
F5 U1 F3 71.27(10) 3_665 7_666
F1 U1 F3 66.99(10) . 7_666
F3 U1 F3 63.26(11) . 7_666
F5 U1 F3 141.06(10) . 7_666
F2 U1 F3 121.14(9) 8_556 7_666
F1 U1 F3 111.52(10) 4 7_666
F4 U1 Na3 46.5(5) . 4
F2 U1 Na3 120.4(5) . 4
F5 U1 Na3 96.3(5) 3_665 4
F1 U1 Na3 90.9(5) . 4
F3 U1 Na3 136.9(5) . 4
F5 U1 Na3 44.4(5) . 4
F2 U1 Na3 86.0(5) 8_556 4
F1 U1 Na3 41.4(5) 4 4
F3 U1 Na3 152.8(5) 7_666 4
F4 U1 Na3 41.4(5) . 3
F2 U1 Na3 112.0(5) . 3
F5 U1 Na3 106.0(5) 3_665 3
F1 U1 Na3 104.7(5) . 3
F3 U1 Na3 125.0(5) . 3
F5 U1 Na3 40.5(5) . 3
F2 U1 Na3 68.1(5) 8_556 3
F1 U1 Na3 59.4(5) 4 3
F3 U1 Na3 170.6(5) 7_666 3
Na3 U1 Na3 18.0(9) 4 3
F4 U1 Na3 133.1(5) . 2_665
F2 U1 Na3 114.2(4) . 2_665
F5 U1 Na3 37.9(5) 3_665 2_665
F1 U1 Na3 59.0(5) . 2_665
F3 U1 Na3 88.4(5) . 2_665
F5 U1 Na3 104.2(4) . 2_665
F2 U1 Na3 156.9(5) 8_556 2_665
F1 U1 Na3 66.9(4) 4 2_665
F3 U1 Na3 48.6(4) 7_666 2_665
Na3 U1 Na3 107.0(3) 4 2_665
Na3 U1 Na3 123.8(9) 3 2_665
F4 Mg1 F4 88.32(12) 6 5
F4 Mg1 F4 86.18(17) 6 2
F4 Mg1 F4 171.63(18) 5 2
F4 Mg1 F4 88.32(12) 6 4
F4 Mg1 F4 88.32(12) 5 4
F4 Mg1 F4 97.81(18) 2 4
F4 Mg1 F4 97.81(18) 6 3
F4 Mg1 F4 86.18(17) 5 3
F4 Mg1 F4 88.32(12) 2 3
F4 Mg1 F4 171.63(18) 4 3
F4 Mg1 F4 171.63(18) 6 .
F4 Mg1 F4 97.81(17) 5 .
F4 Mg1 F4 88.32(12) 2 .
F4 Mg1 F4 86.18(17) 4 .
F4 Mg1 F4 88.32(12) 3 .
F4 Mg1 Na3 95.2(5) 6 .
F4 Mg1 Na3 140.0(5) 5 .
F4 Mg1 Na3 47.0(5) 2 .
F4 Mg1 Na3 52.1(5) 4 .
F4 Mg1 Na3 132.3(5) 3 .
F4 Mg1 Na3 76.4(5) . .
F4 Mg1 Na3 47.0(5) 6 5
F4 Mg1 Na3 76.4(5) 5 5
F4 Mg1 Na3 95.2(5) 2 5
F4 Mg1 Na3 132.3(5) 4 5
F4 Mg1 Na3 52.1(5) 3 5
F4 Mg1 Na3 140.0(5) . 5
Na3 Mg1 Na3 132.3(10) . 5
F4 Mg1 Na3 52.1(5) 6 2
F4 Mg1 Na3 95.2(5) 5 2
F4 Mg1 Na3 76.4(5) 2 2
F4 Mg1 Na3 140.0(5) 4 2
F4 Mg1 Na3 47.0(5) 3 2
F4 Mg1 Na3 132.3(5) . 2
Na3 Mg1 Na3 118.2(2) . 2
Na3 Mg1 Na3 19.6(10) 5 2
F4 Mg1 Na3 132.3(5) 6 4
F4 Mg1 Na3 47.0(5) 5 4
F4 Mg1 Na3 140.0(5) 2 4
F4 Mg1 Na3 76.4(5) 4 4
F4 Mg1 Na3 95.2(5) 3 4
F4 Mg1 Na3 52.1(5) . 4
Na3 Mg1 Na3 109.0(10) . 4
Na3 Mg1 Na3 118.2(2) 5 4
Na3 Mg1 Na3 132.3(10) 2 4
F4 Mg1 Na3 140.0(5) 6 3
F4 Mg1 Na3 52.1(5) 5 3
F4 Mg1 Na3 132.3(5) 2 3
F4 Mg1 Na3 95.2(5) 4 3
F4 Mg1 Na3 76.4(5) 3 3
F4 Mg1 Na3 47.0(5) . 3
Na3 Mg1 Na3 118.2(2) . 3
Na3 Mg1 Na3 109.0(10) 5 3
Na3 Mg1 Na3 118.2(2) 2 3
Na3 Mg1 Na3 19.6(10) 4 3
F4 Mg1 Na3 76.4(5) 6 6
F4 Mg1 Na3 132.3(5) 5 6
F4 Mg1 Na3 52.1(5) 2 6
F4 Mg1 Na3 47.0(5) 4 6
F4 Mg1 Na3 140.0(5) 3 6
F4 Mg1 Na3 95.2(5) . 6
Na3 Mg1 Na3 19.6(10) . 6
Na3 Mg1 Na3 118.2(2) 5 6
Na3 Mg1 Na3 109.0(10) 2 6
Na3 Mg1 Na3 118.2(2) 4 6
Na3 Mg1 Na3 132.3(10) 3 6
F1 Na1 F1 110.80(9) 2_665 .
F1 Na1 F1 110.80(9) 2_665 3_565
F1 Na1 F1 110.80(9) . 3_565
F1 Na1 F3 70.05(10) 2_665 8_566
F1 Na1 F3 155.79(15) . 8_566
F1 Na1 F3 90.31(11) 3_565 8_566
F1 Na1 F3 155.79(15) 2_665 9_556
F1 Na1 F3 90.31(11) . 9_556
F1 Na1 F3 70.05(10) 3_565 9_556
F3 Na1 F3 85.83(13) 8_566 9_556
F1 Na1 F3 90.31(11) 2_665 7_666
F1 Na1 F3 70.05(10) . 7_666
F1 Na1 F3 155.79(15) 3_565 7_666
F3 Na1 F3 85.83(13) 8_566 7_666
F3 Na1 F3 85.83(13) 9_556 7_666
F1 Na1 Na3 147.0(5) 2_665 .
F1 Na1 Na3 46.8(5) . .
F1 Na1 Na3 68.8(5) 3_565 .
F3 Na1 Na3 141.4(5) 8_566 .
F3 Na1 Na3 57.0(5) 9_556 .
F3 Na1 Na3 100.1(5) 7_666 .
F1 Na1 Na3 68.8(5) 2_665 3_565
F1 Na1 Na3 147.0(5) . 3_565
F1 Na1 Na3 46.8(5) 3_565 3_565
F3 Na1 Na3 57.0(5) 8_566 3_565
F3 Na1 Na3 100.1(5) 9_556 3_565
F3 Na1 Na3 141.4(5) 7_666 3_565
Na3 Na1 Na3 115.2(4) . 3_565
F1 Na1 Na3 46.8(5) 2_665 2_665
F1 Na1 Na3 68.8(5) . 2_665
F1 Na1 Na3 147.0(5) 3_565 2_665
F3 Na1 Na3 100.1(5) 8_566 2_665
F3 Na1 Na3 141.4(5) 9_556 2_665
F3 Na1 Na3 57.0(5) 7_666 2_665
Na3 Na1 Na3 115.2(4) . 2_665
Na3 Na1 Na3 115.2(4) 3_565 2_665
F1 Na1 U1 107.92(8) 2_665 .
F1 Na1 U1 33.24(7) . .
F1 Na1 U1 135.95(8) 3_565 .
F3 Na1 U1 122.58(11) 8_566 .
F3 Na1 U1 83.00(8) 9_556 .
F3 Na1 U1 37.38(7) 7_666 .
Na3 Na1 U1 67.3(5) . .
Na3 Na1 U1 176.7(5) 3_565 .
Na3 Na1 U1 61.5(5) 2_665 .
F1 Na1 U1 33.24(7) 2_665 2_665
F1 Na1 U1 135.95(8) . 2_665
F1 Na1 U1 107.92(8) 3_565 2_665
F3 Na1 U1 37.38(7) 8_566 2_665
F3 Na1 U1 122.58(11) 9_556 2_665
F3 Na1 U1 83.00(8) 7_666 2_665
Na3 Na1 U1 176.7(5) . 2_665
Na3 Na1 U1 61.5(5) 3_565 2_665
Na3 Na1 U1 67.3(5) 2_665 2_665
U1 Na1 U1 115.95(3) . 2_665
F1 Na1 U1 135.95(8) 2_665 3_565
F1 Na1 U1 107.92(8) . 3_565
F1 Na1 U1 33.24(7) 3_565 3_565
F3 Na1 U1 83.00(8) 8_566 3_565
F3 Na1 U1 37.38(7) 9_556 3_565
F3 Na1 U1 122.58(11) 7_666 3_565
Na3 Na1 U1 61.5(5) . 3_565
Na3 Na1 U1 67.3(5) 3_565 3_565
Na3 Na1 U1 176.7(5) 2_665 3_565
U1 Na1 U1 115.95(3) . 3_565
U1 Na1 U1 115.95(3) 2_665 3_565
F4 Na2 F4 180.0 9_556 3
F4 Na2 F4 63.07(10) 9_556 8_556
F4 Na2 F4 116.93(10) 3 8_556
F4 Na2 F4 116.93(10) 9_556 2
F4 Na2 F4 63.07(10) 3 2
F4 Na2 F4 180.00(7) 8_556 2
F4 Na2 F4 63.07(10) 9_556 7_556
F4 Na2 F4 116.93(10) 3 7_556
F4 Na2 F4 63.07(10) 8_556 7_556
F4 Na2 F4 116.93(10) 2 7_556
F4 Na2 F4 116.93(10) 9_556 .
F4 Na2 F4 63.07(10) 3 .
F4 Na2 F4 116.93(10) 8_556 .
F4 Na2 F4 63.07(10) 2 .
F4 Na2 F4 180.00(15) 7_556 .
F4 Na2 F2 58.92(8) 9_556 .
F4 Na2 F2 121.08(8) 3 .
F4 Na2 F2 104.41(9) 8_556 .
F4 Na2 F2 75.59(9) 2 .
F4 Na2 F2 118.61(9) 7_556 .
F4 Na2 F2 61.39(9) . .
F4 Na2 F2 75.59(9) 9_556 8_556
F4 Na2 F2 104.41(9) 3 8_556
F4 Na2 F2 61.39(9) 8_556 8_556
F4 Na2 F2 118.61(9) 2 8_556
F4 Na2 F2 121.08(8) 7_556 8_556
F4 Na2 F2 58.92(8) . 8_556
F2 Na2 F2 60.773(18) . 8_556
F4 Na2 F2 104.41(9) 9_556 2
F4 Na2 F2 75.59(9) 3 2
F4 Na2 F2 118.61(9) 8_556 2
F4 Na2 F2 61.39(9) 2 2
F4 Na2 F2 58.92(8) 7_556 2
F4 Na2 F2 121.08(8) . 2
F2 Na2 F2 119.227(17) . 2
F2 Na2 F2 180.0 8_556 2
F4 Na2 F2 121.08(8) 9_556 7_556
F4 Na2 F2 58.92(8) 3 7_556
F4 Na2 F2 75.59(9) 8_556 7_556
F4 Na2 F2 104.41(9) 2 7_556
F4 Na2 F2 61.39(9) 7_556 7_556
F4 Na2 F2 118.61(9) . 7_556
F2 Na2 F2 180.0 . 7_556
F2 Na2 F2 119.227(18) 8_556 7_556
F2 Na2 F2 60.773(18) 2 7_556
F4 Na2 F2 61.39(9) 9_556 9_556
F4 Na2 F2 118.61(9) 3 9_556
F4 Na2 F2 121.08(8) 8_556 9_556
F4 Na2 F2 58.92(8) 2 9_556
F4 Na2 F2 75.59(9) 7_556 9_556
F4 Na2 F2 104.41(9) . 9_556
F2 Na2 F2 60.773(18) . 9_556
F2 Na2 F2 119.227(18) 8_556 9_556
F2 Na2 F2 60.773(18) 2 9_556
F2 Na2 F2 119.227(18) 7_556 9_556
F4 Na2 F2 118.61(9) 9_556 3
F4 Na2 F2 61.39(9) 3 3
F4 Na2 F2 58.92(8) 8_556 3
F4 Na2 F2 121.08(8) 2 3
F4 Na2 F2 104.41(9) 7_556 3
F4 Na2 F2 75.59(9) . 3
F2 Na2 F2 119.227(18) . 3
F2 Na2 F2 60.773(18) 8_556 3
F2 Na2 F2 119.227(18) 2 3
F2 Na2 F2 60.773(18) 7_556 3
F2 Na2 F2 180.0 9_556 3
Na3 Na3 F5 84(3) 6 2
Na3 Na3 F1 126(3) 6 .
F5 Na3 F1 146.1(14) 2 .
Na3 Na3 F4 86.2(19) 6 2
F5 Na3 F4 79.8(9) 2 2
F1 Na3 F4 113.7(12) . 2
Na3 Na3 F5 70(3) 6 4
F5 Na3 F5 119.6(12) 2 4
F1 Na3 F5 67.1(8) . 4
F4 Na3 F5 145.9(13) 2 4
Na3 Na3 F4 68.2(18) 6 4
F5 Na3 F4 142.8(13) 2 4
F1 Na3 F4 70.4(8) . 4
F4 Na3 F4 74.7(9) 2 4
F5 Na3 F4 73.9(8) 4 4
Na3 Na3 F3 141.8(16) 6 9_556
F5 Na3 F3 66.2(7) 2 9_556
F1 Na3 F3 80.0(8) . 9_556
F4 Na3 F3 109.4(10) 2 9_556
F5 Na3 F3 104.4(11) 4 9_556
F4 Na3 F3 148.5(11) 4 9_556
Na3 Na3 Na1 131(2) 6 .
F5 Na3 Na1 105.0(10) 2 .
F1 Na3 Na1 45.1(5) . .
F4 Na3 Na1 142.6(11) 2 .
F5 Na3 Na1 63.8(7) 4 .
F4 Na3 Na1 111.7(9) 4 .
F3 Na3 Na1 46.1(5) 9_556 .
Na3 Na3 Mg1 80.2(5) 6 .
F5 Na3 Mg1 115.8(11) 2 .
F1 Na3 Mg1 87.4(8) . .
F4 Na3 Mg1 37.7(4) 2 .
F5 Na3 Mg1 111.8(10) 4 .
F4 Na3 Mg1 37.9(4) 4 .
F3 Na3 Mg1 133.1(10) 9_556 .
Na1 Na3 Mg1 131.7(9) . .
Na3 Na3 U1 83(3) 6 4
F5 Na3 U1 160.4(11) 2 4
F1 Na3 U1 44.0(5) . 4
F4 Na3 U1 113.0(10) 2 4
F5 Na3 U1 42.0(4) 4 4
F4 Na3 U1 40.0(4) 4 4
F3 Na3 U1 119.3(9) 9_556 4
Na1 Na3 U1 74.3(6) . 4
Mg1 Na3 U1 75.3(6) . 4
Na3 Na3 U1 79(3) 6 2
F5 Na3 U1 41.1(5) 2 2
F1 Na3 U1 146.0(11) . 2
F4 Na3 U1 39.0(4) 2 2
F5 Na3 U1 146.5(10) 4 2
F4 Na3 U1 107.5(9) 4 2
F3 Na3 U1 91.1(8) 9_556 2
Na1 Na3 U1 137.2(9) . 2
Mg1 Na3 U1 74.9(6) . 2
U1 Na3 U1 147.3(9) 4 2
Na1 F1 Na3 88.1(7) . .
Na1 F1 U1 114.79(13) . .
Na3 F1 U1 116.0(7) . .
Na1 F1 U1 118.96(14) . 4
Na3 F1 U1 94.6(7) . 4
U1 F1 U1 118.02(12) . 4
U1 F2 U1 153.66(14) . 9_556
U1 F2 Na2 101.33(10) . .
U1 F2 Na2 99.65(10) 9_556 .
U1 F3 Mg2 135.18(14) . 7_666
U1 F3 Na1 135.18(14) . 7_666
U1 F3 U1 116.74(11) . 7_666
Mg2 F3 U1 107.06(11) 7_666 7_666
Na1 F3 U1 107.06(11) 7_666 7_666
U1 F3 Na3 111.5(6) . 8_556
Mg2 F3 Na3 76.9(6) 7_666 8_556
Na1 F3 Na3 76.9(6) 7_666 8_556
U1 F3 Na3 89.2(6) 7_666 8_556
Mg1 F4 U1 152.44(16) . .
Mg1 F4 Na3 95.3(7) . 3
U1 F4 Na3 99.6(7) . 3
Mg1 F4 Na3 90.0(7) . 4
U1 F4 Na3 93.5(7) . 4
Mg1 F4 Na2 89.29(10) . .
U1 F4 Na2 104.17(11) . .
Na3 F4 Na2 117.1(7) 3 .
Na3 F4 Na2 142.1(6) 4 .
U1 F5 Na3 104.2(8) 2_655 3
U1 F5 U1 152.44(15) 2_655 .
Na3 F5 U1 98.4(8) 3 .
U1 F5 Na3 113.6(7) 2_655 4
U1 F5 Na3 93.7(7) . 4
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
U1 F4 2.238(3) .
U1 F2 2.267(3) .
U1 F5 2.301(3) 3_665
U1 F1 2.321(3) .
U1 F3 2.327(3) .
U1 F5 2.329(3) .
U1 F2 2.331(3) 8_556
U1 F1 2.421(3) 4
U1 F3 2.441(3) 7_666
U1 Na3 3.48(3) 4
U1 Na3 3.51(3) 3
U1 Na3 3.63(3) 2_665
Mg1 F4 1.966(3) 6
Mg1 F4 1.966(3) 5
Mg1 F4 1.966(3) 2
Mg1 F4 1.966(3) 4
Mg1 F4 1.966(3) 3
Mg1 F4 1.966(3) .
Mg1 Na3 3.20(3) .
Mg1 Na3 3.20(3) 5
Mg1 Na3 3.20(3) 2
Mg1 Na3 3.20(3) 4
Mg1 Na3 3.20(3) 3
Mg1 Na3 3.20(3) 6
Na1 F1 2.242(3) 2_665
Na1 F1 2.242(3) .
Na1 F1 2.242(3) 3_565
Na1 F3 2.339(3) 8_566
Na1 F3 2.339(3) 9_556
Na1 F3 2.339(3) 7_666
Na1 Na3 3.16(3) .
Na1 Na3 3.16(3) 3_565
Na1 Na3 3.16(3) 2_665
Na1 U1 3.8446(6) 2_665
Na1 U1 3.8446(6) 3_565
Na2 F4 2.619(3) 9_556
Na2 F4 2.619(3) 3
Na2 F4 2.619(3) 8_556
Na2 F4 2.619(3) 2
Na2 F4 2.619(3) 7_556
Na2 F4 2.619(3) .
Na2 F2 2.684(3) .
Na2 F2 2.684(3) 8_556
Na2 F2 2.684(3) 2
Na2 F2 2.684(3) 7_556
Na2 F2 2.684(3) 9_556
Na2 F2 2.684(3) 3
Na3 Na3 1.09(5) 6
Na3 F5 2.30(3) 2
Na3 F1 2.31(3) .
Na3 F4 2.35(3) 2
Na3 F5 2.44(3) 4
Na3 F4 2.53(3) 4
Na3 F3 2.72(3) 9_556
Na3 U1 3.48(3) 4
Na3 U1 3.51(3) 2
F1 U1 2.421(3) 4
F2 U1 2.331(3) 9_556
F3 Mg2 2.339(3) 7_666
F3 Na1 2.339(3) 7_666
F3 U1 2.441(3) 7_666
F3 Na3 2.72(3) 8_556
F4 Na3 2.35(3) 3
F4 Na3 2.53(3) 4
F5 U1 2.301(3) 2_655
F5 Na3 2.30(3) 3
F5 Na3 2.44(3) 4
