#------------------------------------------------------------------------------
#$Date: 2016-03-23 14:53:57 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179311 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/08/4320873.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_4320873
loop_
_publ_author_name
'Klaus P. Mörtl'
'Jean-Pascal Sutter'
'Stéphane Golhen'
'Lahcène Ouahab'
'Olivier Kahn'
_publ_section_title
;
 Structure and Magnetic Characteristics of an Oxalate-Bridged U(IV)-Mn(II)
 Three-Dimensional Network
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1626
_journal_page_last               1627
_journal_paper_doi               10.1021/ic9911825
_journal_volume                  39
_journal_year                    2000
_chemical_formula_sum            'C8 H18 K2 Mn O25 U'
_chemical_formula_weight         885.39
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 97.22(9)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.360(6)
_cell_length_b                   8.9614(17)
_cell_length_c                   11.405(9)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      11.795
_cell_measurement_theta_min      9.323
_cell_volume                     1151.8(11)
_computing_cell_refinement       Enraf-Nonius
_computing_data_collection       'Enraf-Nonius CAD4'
_computing_data_reduction        MolEN
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Enraf Nonius CAD4'
_diffrn_measurement_method       θ-2θ
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0293
_diffrn_reflns_av_sigmaI/netI    0.0141
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            3695
_diffrn_reflns_theta_full        29.93
_diffrn_reflns_theta_max         29.93
_diffrn_reflns_theta_min         1.80
_diffrn_standards_interval_count 250
_diffrn_standards_interval_time  60
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    8.046
_exptl_absorpt_correction_T_max  0.998630
_exptl_absorpt_correction_T_min  0.769727
_exptl_absorpt_correction_type   '\y scan'
_exptl_crystal_density_diffrn    2.553
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             842
_refine_diff_density_max         1.399
_refine_diff_density_min         -1.888
_refine_diff_density_rms         0.201
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.016(6)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.684
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     334
_refine_ls_number_reflns         3537
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      0.684
_refine_ls_R_factor_all          0.0219
_refine_ls_R_factor_gt           0.0199
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0607P)²+4.9116P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0532
_refine_ls_wR_factor_ref         0.0548
_reflns_number_gt                3410
_reflns_number_total             3537
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic9911825.cif
_cod_data_source_block           calcul1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to the built-in table from CIF Core dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0607P)^2^+4.9116P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0607P)^2^+4.9116P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_database_code               4320873
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
U1 U -0.785686(10) -0.30058(7) -0.782082(10) 0.01127(5) Uani 1 d . . .
Mn1 Mn -1.27449(10) -0.04719(11) -0.72769(11) 0.0144(2) Uani 1 d . . .
K1 K -0.76555(10) 0.2051(5) -0.77026(10) 0.0289(2) Uani 1 d . . .
K2 K -1.2768(2) -0.5462(3) -0.7197(2) 0.0324(4) Uani 1 d . . .
O1 O -0.6577(3) -0.0787(5) -0.7635(4) 0.0181(7) Uani 1 d . . .
O2 O -0.5787(3) -0.3548(5) -0.7524(4) 0.0210(8) Uani 1 d . . .
O3 O -0.4720(3) 0.0091(5) -0.7468(4) 0.0231(8) Uani 1 d . . .
O4 O -0.3913(3) -0.2695(5) -0.7423(4) 0.0268(11) Uani 1 d . . .
O5 O -0.9017(3) -0.0770(5) -0.7707(4) 0.0224(8) Uani 1 d . . .
O6 O -0.9689(4) -0.3440(5) -0.7051(4) 0.0237(9) Uani 1 d . . .
O7 O -1.0776(3) 0.0184(5) -0.7383(4) 0.0244(8) Uani 1 d . . .
O8 O -1.1535(3) -0.2592(5) -0.6980(4) 0.0228(9) Uani 1 d . . .
O9 O -0.7686(4) -0.5174(4) -0.6552(3) 0.0183(7) Uani 1 d . . .
O10 O -0.7402(4) -0.2411(5) -0.5778(3) 0.0211(7) Uani 1 d . . .
O11 O -0.7379(4) -0.6038(5) -0.4691(3) 0.0249(8) Uani 1 d . . .
O12 O -0.7220(4) -0.3235(4) -0.3901(4) 0.0252(11) Uani 1 d . . .
O13 O -1.2869(4) 0.1723(4) -0.8460(3) 0.0236(11) Uani 1 d . . .
O14 O -1.2597(4) -0.1094(5) -0.9211(3) 0.0255(8) Uani 1 d . . .
O15 O -1.2655(4) 0.2567(5) -1.0274(3) 0.0206(7) Uani 1 d . . .
O16 O -1.2384(4) -0.0195(5) -1.1013(3) 0.0205(7) Uani 1 d . . .
O17 O -0.9639(4) -0.3209(6) -0.9401(4) 0.0289(14) Uani 1 d . . .
O18 O -1.4218(6) -0.3277(6) -1.0595(6) 0.0492(17) Uani 1 d . . .
O19 O -0.5523(5) 0.2502(7) -0.6173(6) 0.0548(16) Uani 1 d . . .
O20 O -1.0079(5) 0.2852(7) -0.8347(5) 0.0413(12) Uani 1 d . . .
O21 O -0.8826(6) 0.1670(7) -0.5674(5) 0.0517(18) Uani 1 d . . .
O22 O -1.4769(5) -0.5510(7) -0.9055(6) 0.0484(14) Uani 1 d . . .
O23 O -1.0518(5) -0.5857(8) -0.5771(6) 0.0512(15) Uani 1 d . . .
O24 O -1.4022(6) -0.5061(7) -0.5241(5) 0.0490(14) Uani 1 d . . .
O25 O -1.1885(5) -0.4429(7) -0.9415(6) 0.0488(15) Uani 1 d . . .
C1 C -0.5468(4) -0.0923(6) -0.7519(4) 0.0165(9) Uani 1 d . . .
C2 C -0.4990(4) -0.2530(6) -0.7481(4) 0.0175(9) Uani 1 d . . .
C3 C -1.0486(5) -0.2426(7) -0.7125(4) 0.0180(9) Uani 1 d . . .
C4 C -1.0063(4) -0.0854(6) -0.7434(5) 0.0173(9) Uani 1 d . . .
C5 C -0.7477(4) -0.5024(6) -0.5436(4) 0.0157(8) Uani 1 d . . .
C6 C -0.7365(5) -0.3416(6) -0.4975(5) 0.0172(9) Uani 1 d . . .
C7 C -1.2711(5) 0.1536(7) -0.9508(5) 0.0180(10) Uani 1 d . . .
C8 C -1.2548(4) -0.0073(6) -0.9929(4) 0.0178(9) Uani 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 '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'
Mn Mn 0.3368 0.7283 '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'
K K 0.2009 0.2494 '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
_geom_angle_publ_flag
O15 U1 O10 142.97(14) 2_343 . ?
O15 U1 O2 79.83(16) 2_343 . ?
O10 U1 O2 79.50(16) . . ?
O15 U1 O6 134.10(16) 2_343 . ?
O10 U1 O6 76.65(17) . . ?
O2 U1 O6 143.49(15) . . ?
O15 U1 O16 67.20(14) 2_343 2_343 ?
O10 U1 O16 134.23(14) . 2_343 ?
O2 U1 O16 74.54(15) . 2_343 ?
O6 U1 O16 103.60(15) . 2_343 ?
O15 U1 O5 93.91(15) 2_343 . ?
O10 U1 O5 79.29(16) . . ?
O2 U1 O5 134.28(14) . . ?
O6 U1 O5 66.94(14) . . ?
O16 U1 O5 143.98(14) 2_343 . ?
O15 U1 O9 135.34(14) 2_343 . ?
O10 U1 O9 66.61(14) . . ?
O2 U1 O9 75.36(15) . . ?
O6 U1 O9 69.95(14) . . ?
O16 U1 O9 70.67(14) 2_343 . ?
O5 U1 O9 129.75(15) . . ?
O15 U1 O1 72.16(14) 2_343 . ?
O10 U1 O1 71.41(14) . . ?
O2 U1 O1 65.80(13) . . ?
O6 U1 O1 129.30(14) . . ?
O16 U1 O1 126.92(14) 2_343 . ?
O5 U1 O1 69.17(14) . . ?
O9 U1 O1 126.66(14) . . ?
O15 U1 O17 68.40(15) 2_343 . ?
O10 U1 O17 139.88(15) . . ?
O2 U1 O17 140.34(16) . . ?
O6 U1 O17 66.17(16) . . ?
O16 U1 O17 71.66(16) 2_343 . ?
O5 U1 O17 72.88(16) . . ?
O9 U1 O17 111.34(16) . . ?
O1 U1 O17 121.95(16) . . ?
O15 U1 K1 103.06(10) 2_343 1_545 ?
O10 U1 K1 100.94(10) . 1_545 ?
O2 U1 K1 75.29(10) . 1_545 ?
O6 U1 K1 82.53(10) . 1_545 ?
O16 U1 K1 36.23(10) 2_343 1_545 ?
O5 U1 K1 148.71(10) . 1_545 ?
O9 U1 K1 34.80(9) . 1_545 ?
O1 U1 K1 141.06(9) . 1_545 ?
O17 U1 K1 89.04(13) . 1_545 ?
O15 U1 K1 78.12(10) 2_343 . ?
O10 U1 K1 75.14(10) . . ?
O2 U1 K1 98.87(10) . . ?
O6 U1 K1 101.23(10) . . ?
O16 U1 K1 145.30(10) 2_343 . ?
O5 U1 K1 36.34(10) . . ?
O9 U1 K1 141.75(9) . . ?
O1 U1 K1 33.09(9) . . ?
O17 U1 K1 97.20(13) . . ?
K1 U1 K1 173.60(3) 1_545 . ?
O3 Mn1 O11 94.66(18) 1_455 2_354 ?
O3 Mn1 O14 98.70(19) 1_455 . ?
O11 Mn1 O14 152.05(17) 2_354 . ?
O3 Mn1 O7 151.31(17) 1_455 . ?
O11 Mn1 O7 99.55(19) 2_354 . ?
O14 Mn1 O7 79.94(18) . . ?
O3 Mn1 O8 138.10(15) 1_455 . ?
O11 Mn1 O8 73.48(16) 2_354 . ?
O14 Mn1 O8 80.22(17) . . ?
O7 Mn1 O8 70.30(15) . . ?
O3 Mn1 O13 77.03(16) 1_455 . ?
O11 Mn1 O13 137.02(16) 2_354 . ?
O14 Mn1 O13 70.31(15) . . ?
O7 Mn1 O13 75.57(16) . . ?
O8 Mn1 O13 138.05(15) . . ?
O3 Mn1 O4 69.33(14) 1_455 1_455 ?
O11 Mn1 O4 81.30(17) 2_354 1_455 ?
O14 Mn1 O4 80.65(17) . 1_455 ?
O7 Mn1 O4 137.35(16) . 1_455 ?
O8 Mn1 O4 69.19(14) . 1_455 ?
O13 Mn1 O4 131.08(16) . 1_455 ?
O3 Mn1 O12 77.59(17) 1_455 2_354 ?
O11 Mn1 O12 69.03(15) 2_354 2_354 ?
O14 Mn1 O12 137.90(16) . 2_354 ?
O7 Mn1 O12 84.40(17) . 2_354 ?
O8 Mn1 O12 129.95(16) . 2_354 ?
O13 Mn1 O12 68.00(14) . 2_354 ?
O4 Mn1 O12 133.11(16) 1_455 2_354 ?
O9 K1 O1 144.60(12) 1_565 . ?
O9 K1 O21 71.99(15) 1_565 . ?
O1 K1 O21 96.66(19) . . ?
O9 K1 O19 69.28(17) 1_565 . ?
O1 K1 O19 77.11(16) . . ?
O21 K1 O19 88.1(2) . . ?
O9 K1 O20 80.18(18) 1_565 . ?
O1 K1 O20 129.52(19) . . ?
O21 K1 O20 72.74(19) . . ?
O19 K1 O20 147.9(2) . . ?
O9 K1 O16 58.70(15) 1_565 2_353 ?
O1 K1 O16 138.95(12) . 2_353 ?
O21 K1 O16 124.0(2) . 2_353 ?
O19 K1 O16 97.1(2) . 2_353 ?
O20 K1 O16 74.26(17) . 2_353 ?
O9 K1 O5 135.87(13) 1_565 . ?
O1 K1 O5 57.00(14) . . ?
O21 K1 O5 66.41(16) . . ?
O19 K1 O5 121.9(2) . . ?
O20 K1 O5 74.19(16) . . ?
O16 K1 O5 140.68(13) 2_353 . ?
O9 K1 O18 115.44(18) 1_565 2_353 ?
O1 K1 O18 66.29(14) . 2_353 ?
O21 K1 O18 160.0(2) . 2_353 ?
O19 K1 O18 78.23(18) . 2_353 ?
O20 K1 O18 125.78(17) . 2_353 ?
O16 K1 O18 72.72(14) 2_353 2_353 ?
O5 K1 O18 108.70(18) . 2_353 ?
O9 K1 U1 29.33(9) 1_565 1_565 ?
O1 K1 U1 157.21(9) . 1_565 ?
O21 K1 U1 96.74(16) . 1_565 ?
O19 K1 U1 85.01(17) . 1_565 ?
O20 K1 U1 72.31(15) . 1_565 ?
O16 K1 U1 29.65(9) 2_353 1_565 ?
O5 K1 U1 145.77(9) . 1_565 ?
O18 K1 U1 96.51(14) 2_353 1_565 ?
O9 K1 U1 153.22(10) 1_565 . ?
O1 K1 U1 28.39(8) . . ?
O21 K1 U1 82.93(16) . . ?
O19 K1 U1 101.36(17) . . ?
O20 K1 U1 101.57(16) . . ?
O16 K1 U1 147.83(10) 2_353 . ?
O5 K1 U1 28.81(9) . . ?
O18 K1 U1 85.53(14) 2_353 . ?
U1 K1 U1 173.60(3) 1_565 . ?
O12 K2 O4 143.55(16) 2_344 1_455 ?
O12 K2 O24 74.10(17) 2_344 . ?
O4 K2 O24 71.59(17) 1_455 . ?
O12 K2 O23 71.93(17) 2_344 . ?
O4 K2 O23 122.15(19) 1_455 . ?
O24 K2 O23 94.0(2) . . ?
O12 K2 O13 56.25(13) 2_344 1_545 ?
O4 K2 O13 137.41(15) 1_455 1_545 ?
O24 K2 O13 120.77(19) . 1_545 ?
O23 K2 O13 98.67(19) . 1_545 ?
O12 K2 O22 105.48(19) 2_344 . ?
O4 K2 O22 68.51(16) 1_455 . ?
O24 K2 O22 98.7(2) . . ?
O23 K2 O22 165.7(2) . . ?
O13 K2 O22 69.29(15) 1_545 . ?
O12 K2 O8 140.94(15) 2_344 . ?
O4 K2 O8 56.00(12) 1_455 . ?
O24 K2 O8 96.06(18) . . ?
O23 K2 O8 71.21(16) . . ?
O13 K2 O8 142.74(14) 1_545 . ?
O22 K2 O8 113.42(18) . . ?
O12 K2 O25 132.81(18) 2_344 . ?
O4 K2 O25 81.30(17) 1_455 . ?
O24 K2 O25 152.8(2) . . ?
O23 K2 O25 98.5(2) . . ?
O13 K2 O25 81.11(16) 1_545 . ?
O22 K2 O25 72.64(19) . . ?
O8 K2 O25 65.84(15) . . ?
C1 O1 U1 120.4(3) . . ?
C1 O1 K1 121.1(3) . . ?
U1 O1 K1 118.52(14) . . ?
C2 O2 U1 122.7(3) . . ?
C1 O3 Mn1 120.1(4) . 1_655 ?
C1 O3 Mn1 120.1(4) . 1_655 ?
Mn1 O3 Mn1 0.00(8) 1_655 1_655 ?
C1 O3 Mn1 120.1(4) . 1_655 ?
Mn1 O3 Mn1 0.00(8) 1_655 1_655 ?
Mn1 O3 Mn1 0.00(8) 1_655 1_655 ?
C2 O4 Mn1 116.4(4) . 1_655 ?
C2 O4 Mn1 116.4(4) . 1_655 ?
Mn1 O4 Mn1 0.00(8) 1_655 1_655 ?
C2 O4 Mn1 116.4(4) . 1_655 ?
Mn1 O4 Mn1 0.00(8) 1_655 1_655 ?
Mn1 O4 Mn1 0.00(8) 1_655 1_655 ?
C2 O4 K2 124.2(4) . 1_655 ?
Mn1 O4 K2 119.01(14) 1_655 1_655 ?
Mn1 O4 K2 119.01(14) 1_655 1_655 ?
Mn1 O4 K2 119.01(14) 1_655 1_655 ?
C4 O5 U1 120.0(4) . . ?
C4 O5 K1 123.7(4) . . ?
U1 O5 K1 114.85(15) . . ?
C3 O6 U1 120.2(3) . . ?
C4 O7 Mn1 116.8(4) . . ?
C3 O8 Mn1 116.2(4) . . ?
C3 O8 K2 123.8(4) . . ?
Mn1 O8 K2 115.75(14) . . ?
C5 O9 U1 120.4(3) . . ?
C5 O9 K1 123.2(3) . 1_545 ?
U1 O9 K1 115.87(15) . 1_545 ?
C6 O10 U1 121.7(3) . . ?
C5 O11 Mn1 119.9(4) . 2_344 ?
C6 O12 Mn1 115.9(3) . 2_344 ?
C6 O12 K2 124.0(4) . 2_354 ?
Mn1 O12 K2 119.31(16) 2_344 2_354 ?
C7 O13 Mn1 115.4(4) . . ?
C7 O13 K2 126.4(4) . 1_565 ?
Mn1 O13 K2 116.22(15) . 1_565 ?
C8 O14 Mn1 118.1(4) . . ?
C7 O15 U1 120.5(4) . 2_353 ?
C8 O16 U1 120.4(4) . 2_353 ?
C8 O16 K1 125.5(4) . 2_343 ?
U1 O16 K1 114.12(15) 2_353 2_343 ?
O3 C1 O1 127.3(5) . . ?
O3 C1 C2 116.6(4) . . ?
O1 C1 C2 116.0(4) . . ?
O4 C2 O2 127.7(5) . . ?
O4 C2 C1 117.5(5) . . ?
O2 C2 C1 114.9(4) . . ?
O8 C3 O6 126.5(6) . . ?
O8 C3 C4 118.3(5) . . ?
O6 C3 C4 115.2(4) . . ?
O7 C4 O5 127.2(5) . . ?
O7 C4 C3 116.8(4) . . ?
O5 C4 C3 116.0(5) . . ?
O11 C5 O9 126.7(5) . . ?
O11 C5 C6 117.3(4) . . ?
O9 C5 C6 116.0(4) . . ?
O12 C6 O10 127.5(5) . . ?
O12 C6 C5 117.5(5) . . ?
O10 C6 C5 115.0(5) . . ?
O13 C7 O15 125.9(5) . . ?
O13 C7 C8 117.6(5) . . ?
O15 C7 C8 116.5(5) . . ?
O14 C8 O16 127.1(5) . . ?
O14 C8 C7 118.1(5) . . ?
O16 C8 C7 114.8(5) . . ?
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
U1 O15 2.375(4) 2_343 ?
U1 O10 2.383(4) . ?
U1 O2 2.384(4) . ?
U1 O6 2.390(4) . ?
U1 O16 2.405(4) 2_343 ?
U1 O5 2.411(4) . ?
U1 O9 2.415(4) . ?
U1 O1 2.456(4) . ?
U1 O17 2.542(5) . ?
U1 K1 4.437(5) 1_545 ?
U1 K1 4.538(5) . ?
Mn1 O3 2.283(4) 1_455 ?
Mn1 O11 2.289(4) 2_354 ?
Mn1 O14 2.301(5) . ?
Mn1 O7 2.330(4) . ?
Mn1 O8 2.345(4) . ?
Mn1 O13 2.379(4) . ?
Mn1 O4 2.389(4) 1_455 ?
Mn1 O12 2.416(4) 2_354 ?
K1 O9 2.814(5) 1_565 ?
K1 O1 2.820(6) . ?
K1 O21 2.830(7) . ?
K1 O19 2.831(7) . ?
K1 O20 2.851(6) . ?
K1 O16 2.873(6) 2_353 ?
K1 O5 2.964(6) . ?
K1 O18 3.070(7) 2_353 ?
K1 U1 4.437(5) 1_565 ?
K2 O12 2.783(5) 2_344 ?
K2 O4 2.797(5) 1_455 ?
K2 O24 2.816(7) . ?
K2 O23 2.874(7) . ?
K2 O13 2.901(5) 1_545 ?
K2 O22 2.907(7) . ?
K2 O8 2.924(5) . ?
K2 O25 2.983(8) . ?
O1 C1 1.257(6) . ?
O2 C2 1.282(6) . ?
O3 C1 1.241(6) . ?
O3 Mn1 2.283(4) 1_655 ?
O3 Mn1 2.283(4) 1_655 ?
O3 Mn1 2.283(4) 1_655 ?
O4 C2 1.225(6) . ?
O4 Mn1 2.389(4) 1_655 ?
O4 Mn1 2.389(4) 1_655 ?
O4 Mn1 2.389(4) 1_655 ?
O4 K2 2.797(5) 1_655 ?
O5 C4 1.267(6) . ?
O6 C3 1.278(7) . ?
O7 C4 1.240(7) . ?
O8 C3 1.232(6) . ?
O9 C5 1.273(6) . ?
O9 K1 2.814(5) 1_545 ?
O10 C6 1.281(7) . ?
O11 C5 1.239(7) . ?
O11 Mn1 2.289(4) 2_344 ?
O12 C6 1.227(7) . ?
O12 Mn1 2.416(4) 2_344 ?
O12 K2 2.783(5) 2_354 ?
O13 C7 1.242(7) . ?
O13 K2 2.901(5) 1_565 ?
O14 C8 1.234(7) . ?
O15 C7 1.279(7) . ?
O15 U1 2.375(4) 2_353 ?
O16 C8 1.278(6) . ?
O16 U1 2.405(4) 2_353 ?
O16 K1 2.873(6) 2_343 ?
O18 K1 3.070(7) 2_343 ?
C1 C2 1.538(7) . ?
C3 C4 1.543(8) . ?
C5 C6 1.534(7) . ?
C7 C8 1.539(8) . ?
