#------------------------------------------------------------------------------
#$Date: 2019-11-22 21:58:11 +0200 (Fri, 22 Nov 2019) $
#$Revision: 231388 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/51/65/4516583.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_4516583
loop_
_publ_author_name
'Zhang, Huijie'
'Fan, Ruiqing'
'Chen, Wei'
'Fan, Jizhuang'
'Dong, Yuwei'
'Song, Yang'
'Du, Xi'
'Wang, Ping'
'Yang, Yulin'
_publ_section_title
;
 3D Lanthanide Metal--Organic Frameworks Based on Mono-, Tri-, and
 Heterometallic Tetranuclear Clusters as Highly Selective and Sensitive
 Luminescent Sensor for Fe3+ and Cu2+ Ions
;
_journal_issue                   9
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              5429
_journal_paper_doi               10.1021/acs.cgd.6b00903
_journal_volume                  16
_journal_year                    2016
_chemical_formula_sum            'C32 H12 K2 O29 Tb2'
_chemical_formula_weight         1256.46
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                100.2370(10)
_cell_angle_beta                 106.0700(10)
_cell_angle_gamma                95.7250(10)
_cell_formula_units_Z            2
_cell_length_a                   11.0252(9)
_cell_length_b                   12.6045(10)
_cell_length_c                   16.0080(13)
_cell_measurement_reflns_used    7268
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.000
_cell_measurement_theta_min      1.355
_cell_volume                     2077.4(3)
_computing_cell_refinement       'SAINT (Bruker, 2005)'
_computing_data_collection       'APEX2 (Bruker, 2005)'
_computing_data_reduction        SAINT
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Bruker Smart APEX CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0172
_diffrn_reflns_av_unetI/netI     0.0274
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            14459
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.000
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_min         1.355
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    3.679
_exptl_absorpt_correction_T_max  0.750
_exptl_absorpt_correction_T_min  0.609
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.009
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1208
_exptl_crystal_size_max          0.140
_exptl_crystal_size_mid          0.120
_exptl_crystal_size_min          0.080
_refine_diff_density_max         1.799
_refine_diff_density_min         -1.583
_refine_diff_density_rms         0.125
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     586
_refine_ls_number_reflns         7268
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.0339
_refine_ls_R_factor_gt           0.0281
_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)+(0.0421P)²+6.0409P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0745
_refine_ls_wR_factor_ref         0.0778
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6382
_reflns_number_total             7268
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            cg6b00903_si_004.cif
_cod_data_source_block           z4
_cod_database_code               4516583
_shelx_shelxl_version_number     2014/7
_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   0.627
_shelx_estimated_absorpt_t_max   0.757
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Tb1 Tb 1.05916(2) 0.24040(2) 0.62800(2) 0.01471(7) Uani 1 1 d . .
Tb2 Tb 0.50248(2) 0.25910(2) 0.88275(2) 0.01474(7) Uani 1 1 d . .
K1 K 0.73197(13) 0.50936(11) 0.05690(9) 0.0409(3) Uani 1 1 d . .
K2 K 0.78170(12) 0.02368(12) 0.44521(9) 0.0399(3) Uani 1 1 d . .
O1 O 0.4120(3) 0.3803(3) 0.4000(2) 0.0264(8) Uani 1 1 d . .
O2 O 0.5965(3) 0.5766(3) 0.1704(2) 0.0270(8) Uani 1 1 d . .
O3 O 0.3869(3) 0.5643(3) 0.1230(2) 0.0272(8) Uani 1 1 d . .
O4 O 0.4930(3) 0.2028(3) 0.0238(2) 0.0246(8) Uani 1 1 d . .
O5 O 0.4869(3) 0.3756(3) 0.0188(2) 0.0255(8) Uani 1 1 d . .
O6 O 0.8781(3) 0.3207(3) 0.6707(2) 0.0330(9) Uani 1 1 d . .
O7 O 0.8489(3) 0.2556(3) 0.5292(2) 0.0320(9) Uani 1 1 d . .
O8 O 0.2690(3) 0.2238(3) 0.6278(2) 0.0285(9) Uani 1 1 d . .
O9 O 0.4470(3) 0.2173(3) 0.7309(2) 0.0254(8) Uani 1 1 d . .
O10 O 1.1378(3) 0.1155(3) 0.1109(2) 0.0285(9) Uani 1 1 d . .
O11 O 0.8941(3) 0.0834(3) 0.6293(2) 0.0303(8) Uani 1 1 d . .
O12 O 1.0961(3) 0.0620(3) 0.6708(2) 0.0256(8) Uani 1 1 d . .
O13 O 1.0380(3) 0.1225(3) 0.4846(2) 0.0194(7) Uani 1 1 d . .
O14 O 1.0788(3) 0.2994(3) 0.4919(2) 0.0218(7) Uani 1 1 d . .
O15 O 1.1270(3) 0.2757(3) 0.7813(2) 0.0232(8) Uani 1 1 d . .
O16 O 1.2878(3) 0.2111(3) 0.8653(2) 0.0285(9) Uani 1 1 d . .
O17 O 0.7007(3) 0.2243(3) 0.8452(2) 0.0316(9) Uani 1 1 d . .
O18 O 0.7219(3) 0.2775(3) 0.9872(2) 0.0291(9) Uani 1 1 d . .
O19 O 1.1644(5) 0.4286(3) 0.6800(3) 0.0473(11) Uani 1 1 d . .
O20 O 0.4933(4) 0.0636(3) 0.8513(3) 0.0435(10) Uani 1 1 d . .
O21 O 0.9210(6) 0.4452(5) 0.1844(4) 0.0819(18) Uani 1 1 d . .
O22 O 0.942(3) 0.508(2) 0.000(3) 0.385(17) Uani 1 1 d . .
O23 O 0.7244(5) 0.0659(5) 0.2587(4) 0.0802(17) Uani 1 1 d . .
O24 O 0.5383(5) 0.0362(6) 0.4324(5) 0.094(2) Uani 1 1 d . .
OW1 O 0.1641(5) 0.5317(5) 0.1879(4) 0.0788(17) Uani 1 1 d . .
OW2 O 0.3296(6) 0.9585(5) 0.2928(5) 0.094(2) Uani 1 1 d . .
OW3 O 0.7772(6) 0.2429(6) 0.1773(4) 0.097(2) Uani 1 1 d . .
OW4 O 0.8448(12) 0.3999(11) 0.3974(10) 0.255(6) Uani 1 1 d . U
OW5 O 0.6394(15) 0.0243(13) 0.0214(15) 0.338(12) Uani 1 1 d . .
C1 C 0.4407(4) 0.3567(4) 0.3203(3) 0.0205(10) Uani 1 1 d . .
C2 C 0.4532(5) 0.4431(4) 0.2802(3) 0.0223(11) Uani 1 1 d . .
H2A H 0.4507 0.5133 0.3093 0.027 Uiso 1 1 calc R U
C3 C 0.4698(4) 0.4256(4) 0.1953(3) 0.0201(10) Uani 1 1 d . .
C4 C 0.4738(4) 0.3209(4) 0.1524(3) 0.0192(10) Uani 1 1 d . .
C5 C 0.4619(5) 0.2351(4) 0.1954(3) 0.0254(11) Uani 1 1 d . .
H5A H 0.4646 0.1647 0.1670 0.030 Uiso 1 1 calc R U
C6 C 0.4463(5) 0.2518(4) 0.2787(3) 0.0286(12) Uani 1 1 d . .
H6A H 0.4396 0.1938 0.3067 0.034 Uiso 1 1 calc R U
C7 C 0.4867(5) 0.5269(4) 0.1593(3) 0.0207(10) Uani 1 1 d . .
C8 C 0.4860(4) 0.2977(4) 0.0602(3) 0.0179(10) Uani 1 1 d . .
C9 C 0.4766(4) 0.3381(4) 0.4715(3) 0.0189(10) Uani 1 1 d . .
C10 C 0.6048(4) 0.3328(4) 0.4918(3) 0.0211(11) Uani 1 1 d . .
H10A H 0.6505 0.3498 0.4537 0.025 Uiso 1 1 calc R U
C11 C 0.6658(4) 0.3016(4) 0.5703(3) 0.0193(10) Uani 1 1 d . .
C12 C 0.5964(4) 0.2734(4) 0.6256(3) 0.0181(10) Uani 1 1 d . .
H12A H 0.6376 0.2547 0.6788 0.022 Uiso 1 1 calc R U
C13 C 0.4654(4) 0.2732(4) 0.6012(3) 0.0172(10) Uani 1 1 d . .
C14 C 0.4049(4) 0.3067(4) 0.5239(3) 0.0195(10) Uani 1 1 d . .
H14A H 0.3173 0.3080 0.5078 0.023 Uiso 1 1 calc R U
C15 C 0.8062(4) 0.2932(4) 0.5917(3) 0.0194(10) Uani 1 1 d . .
C16 C 0.3871(4) 0.2361(4) 0.6576(3) 0.0164(10) Uani 1 1 d . .
C17 C 1.1082(4) 0.1413(4) 0.1899(3) 0.0212(11) Uani 1 1 d . .
C18 C 1.0754(5) 0.0541(4) 0.2247(3) 0.0223(11) Uani 1 1 d . .
H18A H 1.0653 -0.0169 0.1924 0.033 Uiso 1 1 calc R U
C19 C 0.9426(4) -0.0729(4) 0.6908(3) 0.0191(10) Uani 1 1 d . .
C20 C 1.0718(4) 0.1790(4) 0.3569(3) 0.0183(10) Uani 1 1 d . .
C21 C 1.1032(5) 0.2659(4) 0.3188(3) 0.0221(11) Uani 1 1 d . .
H21B H 1.1121 0.3372 0.3502 0.027 Uiso 1 1 calc R U
C22 C 1.1211(5) 0.2475(4) 0.2356(3) 0.0242(11) Uani 1 1 d . .
H22B H 1.1415 0.3057 0.2109 0.029 Uiso 1 1 calc R U
C23 C 0.9794(5) 0.0292(4) 0.6597(3) 0.0206(10) Uani 1 1 d . .
C24 C 1.0610(4) 0.2033(4) 0.4495(3) 0.0182(10) Uani 1 1 d . .
C25 C 1.0812(4) 0.1618(4) 0.0401(3) 0.0194(10) Uani 1 1 d . .
C26 C 1.1522(4) 0.1762(4) 0.9834(3) 0.0182(10) Uani 1 1 d . .
H26B H 1.2352 0.1605 0.9958 0.027 Uiso 1 1 calc R U
C27 C 1.0978(4) 0.2148(4) 0.9065(3) 0.0158(9) Uani 1 1 d . .
C28 C 0.9727(4) 0.2357(4) 0.8877(3) 0.0190(10) Uani 1 1 d . .
H28A H 0.9353 0.2588 0.8359 0.023 Uiso 1 1 calc R U
C29 C 0.9037(4) 0.2219(4) 0.9466(3) 0.0211(11) Uani 1 1 d . .
C30 C 0.9581(5) 0.1853(4) 1.0240(3) 0.0228(11) Uani 1 1 d . .
H30B H 0.9123 0.1768 1.0639 0.034 Uiso 1 1 calc R U
C31 C 1.1770(4) 0.2345(4) 0.8462(3) 0.0166(10) Uani 1 1 d . .
C32 C 0.7679(4) 0.2431(4) 0.9253(3) 0.0200(10) 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
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'
K K 0.2009 0.2494 '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'
Tb Tb -0.1723 4.1537 '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
O15 Tb1 O8 89.31(12) . 1_655
O15 Tb1 O19 72.53(13) . .
O8 Tb1 O19 78.20(15) 1_655 .
O15 Tb1 O13 150.31(11) . .
O8 Tb1 O13 74.81(12) 1_655 .
O19 Tb1 O13 126.28(12) . .
O15 Tb1 O7 128.00(11) . .
O8 Tb1 O7 141.76(11) 1_655 .
O19 Tb1 O7 103.01(15) . .
O13 Tb1 O7 74.25(11) . .
O15 Tb1 O14 146.52(12) . .
O8 Tb1 O14 75.07(11) 1_655 .
O19 Tb1 O14 75.33(12) . .
O13 Tb1 O14 53.28(11) . .
O7 Tb1 O14 68.57(11) . .
O15 Tb1 O12 73.44(12) . .
O8 Tb1 O12 74.93(12) 1_655 .
O19 Tb1 O12 136.40(14) . .
O13 Tb1 O12 78.21(11) . .
O7 Tb1 O12 119.33(12) . .
O14 Tb1 O12 127.92(11) . .
O15 Tb1 O6 76.43(11) . .
O8 Tb1 O6 158.70(13) 1_655 .
O19 Tb1 O6 82.40(15) . .
O13 Tb1 O6 124.68(11) . .
O7 Tb1 O6 51.98(11) . .
O14 Tb1 O6 108.47(11) . .
O12 Tb1 O6 114.83(12) . .
O15 Tb1 O11 88.72(12) . .
O8 Tb1 O11 124.45(12) 1_655 .
O19 Tb1 O11 151.10(13) . .
O13 Tb1 O11 80.36(11) . .
O7 Tb1 O11 71.08(12) . .
O14 Tb1 O11 124.58(11) . .
O12 Tb1 O11 51.52(11) . .
O6 Tb1 O11 71.72(12) . .
O15 Tb1 C24 161.63(12) . .
O8 Tb1 C24 72.52(12) 1_655 .
O19 Tb1 C24 100.36(13) . .
O13 Tb1 C24 27.05(12) . .
O7 Tb1 C24 69.67(12) . .
O14 Tb1 C24 26.23(12) . .
O12 Tb1 C24 103.45(13) . .
O6 Tb1 C24 120.13(12) . .
O11 Tb1 C24 103.60(13) . .
O15 Tb1 C15 102.02(13) . .
O8 Tb1 C15 164.39(12) 1_655 .
O19 Tb1 C15 94.83(15) . .
O13 Tb1 C15 99.02(13) . .
O7 Tb1 C15 26.03(12) . .
O14 Tb1 C15 89.70(12) . .
O12 Tb1 C15 118.39(12) . .
O6 Tb1 C15 26.10(12) . .
O11 Tb1 C15 67.19(12) . .
C24 Tb1 C15 95.37(13) . .
O15 Tb1 C23 79.16(13) . .
O8 Tb1 C23 100.09(13) 1_655 .
O19 Tb1 C23 151.64(13) . .
O13 Tb1 C23 79.17(12) . .
O7 Tb1 C23 95.61(14) . .
O14 Tb1 C23 132.09(12) . .
O12 Tb1 C23 25.81(12) . .
O6 Tb1 C23 92.78(13) . .
O11 Tb1 C23 25.75(12) . .
C24 Tb1 C23 106.12(13) . .
C15 Tb1 C23 92.64(14) . .
O9 Tb2 O16 86.14(12) . 1_455
O9 Tb2 O20 77.80(13) . .
O16 Tb2 O20 82.07(15) 1_455 .
O9 Tb2 O5 148.51(12) . 1_556
O16 Tb2 O5 80.18(13) 1_455 1_556
O20 Tb2 O5 127.39(12) . 1_556
O9 Tb2 O3 87.31(12) . 2_666
O16 Tb2 O3 127.70(12) 1_455 2_666
O20 Tb2 O3 145.97(14) . 2_666
O5 Tb2 O3 79.14(11) 1_556 2_666
O9 Tb2 O17 73.94(11) . .
O16 Tb2 O17 151.25(14) 1_455 .
O20 Tb2 O17 73.71(14) . .
O5 Tb2 O17 127.04(12) 1_556 .
O3 Tb2 O17 72.80(13) 2_666 .
O9 Tb2 O18 126.12(11) . .
O16 Tb2 O18 144.02(11) 1_455 .
O20 Tb2 O18 89.27(14) . .
O5 Tb2 O18 77.66(12) 1_556 .
O3 Tb2 O18 75.01(12) 2_666 .
O17 Tb2 O18 52.30(11) . .
O9 Tb2 O4 148.40(12) . 1_556
O16 Tb2 O4 74.49(11) 1_455 1_556
O20 Tb2 O4 75.02(12) . 1_556
O5 Tb2 O4 52.57(11) 1_556 1_556
O3 Tb2 O4 124.29(12) 2_666 1_556
O17 Tb2 O4 112.75(11) . 1_556
O18 Tb2 O4 69.54(11) . 1_556
O9 Tb2 O2 73.88(12) . 2_666
O16 Tb2 O2 76.90(12) 1_455 2_666
O20 Tb2 O2 145.57(13) . 2_666
O5 Tb2 O2 75.44(11) 1_556 2_666
O3 Tb2 O2 51.54(11) 2_666 2_666
O17 Tb2 O2 115.63(12) . 2_666
O18 Tb2 O2 123.34(12) . 2_666
O4 Tb2 O2 123.62(11) 1_556 2_666
O9 Tb2 C32 100.05(12) . .
O16 Tb2 C32 158.56(13) 1_455 .
O20 Tb2 C32 79.26(15) . .
O5 Tb2 C32 103.01(13) 1_556 .
O3 Tb2 C32 73.39(13) 2_666 .
O17 Tb2 C32 26.11(12) . .
O18 Tb2 C32 26.25(12) . .
O4 Tb2 C32 90.49(12) 1_556 .
O2 Tb2 C32 124.51(12) 2_666 .
O9 Tb2 C8 161.80(12) . 1_556
O16 Tb2 C8 75.74(12) 1_455 1_556
O20 Tb2 C8 100.95(14) . 1_556
O5 Tb2 C8 26.53(12) 1_556 1_556
O3 Tb2 C8 102.33(13) 2_666 1_556
O17 Tb2 C8 123.49(12) . 1_556
O18 Tb2 C8 71.75(12) . 1_556
O4 Tb2 C8 26.03(12) 1_556 1_556
O2 Tb2 C8 99.90(12) 2_666 1_556
C32 Tb2 C8 97.51(13) . 1_556
O9 Tb2 C7 77.94(13) . 2_666
O16 Tb2 C7 102.55(14) 1_455 2_666
O20 Tb2 C7 154.92(13) . 2_666
O5 Tb2 C7 77.58(12) 1_556 2_666
O3 Tb2 C7 25.89(13) 2_666 2_666
O17 Tb2 C7 93.48(14) . 2_666
O18 Tb2 C7 99.94(13) . 2_666
O4 Tb2 C7 130.06(12) 1_556 2_666
O2 Tb2 C7 25.75(12) 2_666 2_666
C32 Tb2 C7 98.82(14) . 2_666
C8 Tb2 C7 104.08(13) 1_556 2_666
O22 K1 O2 155.2(8) . .
O22 K1 O3 80.9(10) . 2_665
O2 K1 O3 121.12(12) . 2_665
O22 K1 O21 72.6(11) . .
O2 K1 O21 94.78(15) . .
O3 K1 O21 135.32(15) 2_665 .
O22 K1 O5 138.4(6) . .
O2 K1 O5 65.90(10) . .
O3 K1 O5 67.40(10) 2_665 .
O21 K1 O5 111.78(16) . .
O22 K1 O18 77.7(6) . 1_554
O2 K1 O18 120.63(11) . 1_554
O3 K1 O18 64.12(10) 2_665 1_554
O21 K1 O18 75.29(14) . 1_554
O5 K1 O18 64.70(10) . 1_554
O22 K1 O5 122.8(10) . 2_665
O2 K1 O5 65.03(10) . 2_665
O3 K1 O5 65.47(10) 2_665 2_665
O21 K1 O5 158.59(14) . 2_665
O5 K1 O5 67.87(11) . 2_665
O18 K1 O5 120.24(10) 1_554 2_665
O22 K1 C31 90.6(6) . 2_766
O2 K1 C31 68.08(11) . 2_766
O3 K1 C31 123.93(11) 2_665 2_766
O21 K1 C31 92.24(15) . 2_766
O5 K1 C31 129.16(11) . 2_766
O18 K1 C31 164.91(11) 1_554 2_766
O5 K1 C31 74.12(11) 2_665 2_766
O22 K1 O15 91.6(7) . 2_766
O2 K1 O15 63.83(10) . 2_766
O3 K1 O15 145.78(10) 2_665 2_766
O21 K1 O15 71.48(14) . 2_766
O5 K1 O15 129.71(10) . 2_766
O18 K1 O15 146.76(10) 1_554 2_766
O5 K1 O15 92.11(9) 2_665 2_766
C31 K1 O15 22.15(9) 2_766 2_766
O22 K1 C7 172.4(9) . .
O2 K1 C7 17.89(11) . .
O3 K1 C7 106.59(11) 2_665 .
O21 K1 C7 101.70(15) . .
O5 K1 C7 48.03(10) . .
O18 K1 C7 106.06(11) 1_554 .
O5 K1 C7 61.31(10) 2_665 .
C31 K1 C7 84.52(12) 2_766 .
O15 K1 C7 81.72(10) 2_766 .
O22 K1 Tb2 100.3(7) . 1_554
O2 K1 Tb2 104.31(8) . 1_554
O3 K1 Tb2 38.20(7) 2_665 1_554
O21 K1 Tb2 112.44(14) . 1_554
O5 K1 Tb2 38.51(7) . 1_554
O18 K1 Tb2 39.21(7) 1_554 1_554
O5 K1 Tb2 81.07(7) 2_665 1_554
C31 K1 Tb2 154.98(9) 2_766 1_554
O15 K1 Tb2 168.08(7) 2_766 1_554
C7 K1 Tb2 86.42(9) . 1_554
O22 K1 Tb2 136.7(7) . 2_666
O2 K1 Tb2 36.21(7) . 2_666
O3 K1 Tb2 99.94(8) 2_665 2_666
O21 K1 Tb2 124.03(12) . 2_666
O5 K1 Tb2 77.18(7) . 2_666
O18 K1 Tb2 141.81(8) 1_554 2_666
O5 K1 Tb2 34.64(6) 2_665 2_666
C31 K1 Tb2 52.73(8) 2_766 2_666
O15 K1 Tb2 63.45(6) 2_766 2_666
C7 K1 Tb2 42.45(8) . 2_666
Tb2 K1 Tb2 106.57(3) 1_554 2_666
O24 K2 O12 133.85(17) . 2_756
O24 K2 O11 101.06(17) . .
O12 K2 O11 123.92(11) 2_756 .
O24 K2 O13 151.19(18) . .
O12 K2 O13 65.55(10) 2_756 .
O11 K2 O13 70.16(10) . .
O24 K2 O7 89.42(17) . .
O12 K2 O7 119.15(11) 2_756 .
O11 K2 O7 61.49(10) . .
O13 K2 O7 62.07(10) . .
O24 K2 O13 134.45(18) . 2_756
O12 K2 O13 66.28(10) 2_756 2_756
O11 K2 O13 66.78(10) . 2_756
O13 K2 O13 68.78(11) . 2_756
O7 K2 O13 117.15(10) . 2_756
O24 K2 O23 87.20(19) . .
O12 K2 O23 57.95(14) 2_756 .
O11 K2 O23 153.04(14) . .
O13 K2 O23 90.21(13) . .
O7 K2 O23 93.31(14) . .
O13 K2 O23 124.15(13) 2_756 .
O24 K2 O8 93.93(17) . 2_656
O12 K2 O8 61.02(10) 2_756 2_656
O11 K2 O8 113.51(11) . 2_656
O13 K2 O8 114.83(10) . 2_656
O7 K2 O8 174.52(10) . 2_656
O13 K2 O8 57.54(9) 2_756 2_656
O23 K2 O8 91.19(13) . 2_656
O24 K2 C16 73.84(17) . 2_656
O12 K2 C16 74.13(11) 2_756 2_656
O11 K2 C16 121.45(11) . 2_656
O13 K2 C16 134.55(11) . 2_656
O7 K2 C16 163.25(11) . 2_656
O13 K2 C16 76.62(10) 2_756 2_656
O23 K2 C16 85.47(13) . 2_656
O8 K2 C16 20.66(9) 2_656 2_656
O24 K2 C23 115.28(18) . .
O12 K2 C23 106.90(11) 2_756 .
O11 K2 C23 19.07(11) . .
O13 K2 C23 64.32(10) . .
O7 K2 C23 76.00(11) . .
O13 K2 C23 47.85(10) 2_756 .
O23 K2 C23 154.52(14) . .
O8 K2 C23 98.63(11) 2_656 .
C16 K2 C23 111.32(12) 2_656 .
O24 K2 Tb1 120.18(15) . .
O12 K2 Tb1 102.55(8) 2_756 .
O11 K2 Tb1 39.59(7) . .
O13 K2 Tb1 37.24(6) . .
O7 K2 Tb1 37.98(7) . .
O13 K2 Tb1 79.27(7) 2_756 .
O23 K2 Tb1 114.40(11) . .
O8 K2 Tb1 136.79(7) 2_656 .
C16 K2 Tb1 154.84(8) 2_656 .
C23 K2 Tb1 44.87(8) . .
O24 K2 Tb1 128.93(16) . 2_756
O12 K2 Tb1 37.19(7) 2_756 2_756
O11 K2 Tb1 103.47(8) . 2_756
O13 K2 Tb1 79.75(7) . 2_756
O7 K2 Tb1 141.62(8) . 2_756
O13 K2 Tb1 36.71(6) 2_756 2_756
O23 K2 Tb1 90.44(12) . 2_756
O8 K2 Tb1 35.09(6) 2_656 2_756
C16 K2 Tb1 55.12(8) 2_656 2_756
C23 K2 Tb1 84.48(9) . 2_756
Tb1 K2 Tb1 107.06(3) . 2_756
C1 O1 C9 119.4(4) . .
C7 O2 Tb2 90.2(3) . 2_666
C7 O2 K1 120.2(3) . .
Tb2 O2 K1 105.46(11) 2_666 .
C7 O3 Tb2 96.5(3) . 2_666
C7 O3 K1 118.9(3) . 2_665
Tb2 O3 K1 97.91(11) 2_666 2_665
C8 O4 Tb2 92.5(3) . 1_554
C8 O5 Tb2 94.2(3) . 1_554
C8 O5 K1 115.6(3) . .
Tb2 O5 K1 94.54(11) 1_554 .
C8 O5 K1 128.1(3) . 2_665
Tb2 O5 K1 101.16(11) 1_554 2_665
K1 O5 K1 112.13(11) . 2_665
C15 O6 Tb1 91.8(3) . .
C15 O7 Tb1 94.7(3) . .
C15 O7 K2 119.7(3) . .
Tb1 O7 K2 95.26(12) . .
C16 O8 Tb1 157.5(3) . 1_455
C16 O8 K2 98.5(3) . 2_656
Tb1 O8 K2 96.18(12) 1_455 2_656
C16 O9 Tb2 149.3(3) . .
C17 O10 C25 119.6(4) . .
C23 O11 Tb1 92.2(3) . .
C23 O11 K2 114.5(3) . .
Tb1 O11 K2 96.35(11) . .
C23 O12 Tb1 94.6(3) . .
C23 O12 K2 121.7(3) . 2_756
Tb1 O12 K2 101.79(11) . 2_756
C24 O13 Tb1 93.1(3) . .
C24 O13 K2 118.3(3) . .
Tb1 O13 K2 98.35(10) . .
C24 O13 K2 127.3(3) . 2_756
Tb1 O13 K2 96.55(10) . 2_756
K2 O13 K2 111.22(11) . 2_756
C24 O14 Tb1 92.2(3) . .
C31 O15 Tb1 142.5(3) . .
C31 O15 K1 76.5(3) . 2_766
Tb1 O15 K1 136.04(13) . 2_766
C31 O16 Tb2 149.1(3) . 1_655
C32 O17 Tb2 93.6(3) . .
C32 O18 Tb2 92.9(3) . .
C32 O18 K1 122.6(3) . 1_556
Tb2 O18 K1 93.07(11) . 1_556
O22 O22 K1 158(5) 2_765 .
C2 C1 C6 120.9(4) . .
C2 C1 O1 115.8(4) . .
C6 C1 O1 123.1(4) . .
C1 C2 C3 120.0(5) . .
C1 C2 H2A 120.0 . .
C3 C2 H2A 120.0 . .
C4 C3 C2 119.7(4) . .
C4 C3 C7 125.1(4) . .
C2 C3 C7 115.2(4) . .
C3 C4 C5 118.8(4) . .
C3 C4 C8 121.4(4) . .
C5 C4 C8 119.7(4) . .
C6 C5 C4 121.8(5) . .
C6 C5 H5A 119.1 . .
C4 C5 H5A 119.1 . .
C5 C6 C1 118.8(4) . .
C5 C6 H6A 120.6 . .
C1 C6 H6A 120.6 . .
O2 C7 O3 121.3(4) . .
O2 C7 C3 120.6(4) . .
O3 C7 C3 118.0(4) . .
O2 C7 Tb2 64.1(3) . 2_666
O3 C7 Tb2 57.6(2) . 2_666
C3 C7 Tb2 168.5(3) . 2_666
O2 C7 K1 41.9(2) . .
O3 C7 K1 119.7(3) . .
C3 C7 K1 108.5(3) . .
Tb2 C7 K1 82.00(11) 2_666 .
O4 C8 O5 120.6(4) . .
O4 C8 C4 120.2(4) . .
O5 C8 C4 119.1(4) . .
O4 C8 Tb2 61.4(2) . 1_554
O5 C8 Tb2 59.2(2) . 1_554
C4 C8 Tb2 177.8(3) . 1_554
C10 C9 C14 121.6(4) . .
C10 C9 O1 122.5(4) . .
C14 C9 O1 115.8(4) . .
C9 C10 C11 119.1(4) . .
C9 C10 H10A 120.5 . .
C11 C10 H10A 120.5 . .
C12 C11 C10 120.2(4) . .
C12 C11 C15 120.5(4) . .
C10 C11 C15 119.2(4) . .
C13 C12 C11 119.7(4) . .
C13 C12 H12A 120.1 . .
C11 C12 H12A 120.1 . .
C12 C13 C14 120.1(4) . .
C12 C13 C16 120.5(4) . .
C14 C13 C16 119.4(4) . .
C9 C14 C13 119.1(4) . .
C9 C14 H14A 120.4 . .
C13 C14 H14A 120.4 . .
O6 C15 O7 120.9(4) . .
O6 C15 C11 120.5(4) . .
O7 C15 C11 118.6(4) . .
O6 C15 Tb1 62.1(2) . .
O7 C15 Tb1 59.3(2) . .
C11 C15 Tb1 170.8(3) . .
O8 C16 O9 124.5(4) . .
O8 C16 C13 118.4(4) . .
O9 C16 C13 117.1(4) . .
O8 C16 K2 60.8(3) . 2_656
O9 C16 K2 99.2(3) . 2_656
C13 C16 K2 109.4(3) . 2_656
C22 C17 O10 122.5(4) . .
C22 C17 C18 121.3(4) . .
O10 C17 C18 115.9(5) . .
C17 C18 C19 119.7(5) . 2_756
C17 C18 H18A 120.2 . .
C19 C18 H18A 120.2 2_756 .
C20 C19 C18 119.9(4) 2_756 2_756
C20 C19 C23 125.1(4) 2_756 .
C18 C19 C23 115.0(4) 2_756 .
C19 C20 C21 118.9(4) 2_756 .
C19 C20 C24 121.9(4) 2_756 .
C21 C20 C24 119.1(4) . .
C22 C21 C20 121.3(5) . .
C22 C21 H21B 119.4 . .
C20 C21 H21B 119.4 . .
C17 C22 C21 118.9(4) . .
C17 C22 H22B 120.6 . .
C21 C22 H22B 120.6 . .
O11 C23 O12 121.4(4) . .
O11 C23 C19 119.2(4) . .
O12 C23 C19 119.2(4) . .
O11 C23 Tb1 62.0(3) . .
O12 C23 Tb1 59.6(2) . .
C19 C23 Tb1 171.4(3) . .
O11 C23 K2 46.4(2) . .
O12 C23 K2 113.4(3) . .
C19 C23 K2 110.7(3) . .
Tb1 C23 K2 76.46(10) . .
O14 C24 O13 121.4(4) . .
O14 C24 C20 120.4(4) . .
O13 C24 C20 118.1(4) . .
O14 C24 Tb1 61.6(2) . .
O13 C24 Tb1 59.8(2) . .
C20 C24 Tb1 175.2(3) . .
C26 C25 C30 121.8(4) 1_554 1_554
C26 C25 O10 115.7(4) 1_554 .
C30 C25 O10 122.3(4) 1_554 .
C25 C26 C27 119.2(4) 1_556 .
C25 C26 H26B 120.4 1_556 .
C27 C26 H26B 120.4 . .
C28 C27 C26 119.8(4) . .
C28 C27 C31 120.9(4) . .
C26 C27 C31 119.2(4) . .
C29 C28 C27 119.8(4) . .
C29 C28 H28A 120.1 . .
C27 C28 H28A 120.1 . .
C28 C29 C30 120.6(4) . .
C28 C29 C32 119.6(4) . .
C30 C29 C32 119.8(4) . .
C25 C30 C29 118.7(4) 1_556 .
C25 C30 H30B 120.6 1_556 .
C29 C30 H30B 120.6 . .
O16 C31 O15 125.2(4) . .
O16 C31 C27 117.9(4) . .
O15 C31 C27 116.9(4) . .
O16 C31 K1 94.5(3) . 2_766
O15 C31 K1 81.3(3) . 2_766
C27 C31 K1 93.0(3) . 2_766
O17 C32 O18 120.9(4) . .
O17 C32 C29 118.9(4) . .
O18 C32 C29 120.3(4) . .
O17 C32 Tb2 60.3(2) . .
O18 C32 Tb2 60.8(2) . .
C29 C32 Tb2 173.9(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Tb1 O15 2.303(3) .
Tb1 O8 2.345(3) 1_655
Tb1 O19 2.425(4) .
Tb1 O13 2.440(3) .
Tb1 O7 2.466(3) .
Tb1 O14 2.480(3) .
Tb1 O12 2.504(3) .
Tb1 O6 2.527(3) .
Tb1 O11 2.558(4) .
Tb1 C24 2.818(4) .
Tb1 C15 2.858(4) .
Tb1 C23 2.895(5) .
Tb2 O9 2.284(3) .
Tb2 O16 2.310(3) 1_455
Tb2 O20 2.412(4) .
Tb2 O5 2.459(3) 1_556
Tb2 O3 2.458(3) 2_666
Tb2 O17 2.480(3) .
Tb2 O18 2.493(3) .
Tb2 O4 2.509(3) 1_556
Tb2 O2 2.602(4) 2_666
Tb2 C32 2.851(5) .
Tb2 C8 2.855(4) 1_556
Tb2 C7 2.893(5) 2_666
K1 O22 2.711(16) .
K1 O2 2.731(4) .
K1 O3 2.756(4) 2_665
K1 O21 2.780(6) .
K1 O5 2.886(4) .
K1 O18 2.917(4) 1_554
K1 O5 3.016(4) 2_665
K1 C31 3.248(5) 2_766
K1 O15 3.302(4) 2_766
K1 C7 3.535(5) .
K1 Tb2 3.9371(14) 1_554
K1 Tb2 4.2447(14) 2_666
K2 O24 2.657(6) .
K2 O12 2.719(4) 2_756
K2 O11 2.791(4) .
K2 O13 2.822(3) .
K2 O7 2.919(4) .
K2 O13 2.973(3) 2_756
K2 O23 3.030(6) .
K2 O8 3.066(4) 2_656
K2 C16 3.473(5) 2_656
K2 C23 3.506(5) .
K2 Tb1 4.0557(14) 2_756
O1 C1 1.386(5) .
O1 C9 1.393(5) .
O2 C7 1.257(6) .
O2 Tb2 2.602(3) 2_666
O3 C7 1.271(6) .
O3 Tb2 2.458(3) 2_666
O3 K1 2.756(4) 2_665
O4 C8 1.254(6) .
O4 Tb2 2.509(3) 1_554
O5 C8 1.279(5) .
O5 Tb2 2.459(3) 1_554
O5 K1 3.016(4) 2_665
O6 C15 1.258(6) .
O7 C15 1.258(6) .
O8 C16 1.239(5) .
O8 Tb1 2.345(3) 1_455
O8 K2 3.066(4) 2_656
O9 C16 1.254(5) .
O10 C17 1.384(6) .
O10 C25 1.389(5) .
O11 C23 1.259(6) .
O12 C23 1.265(6) .
O12 K2 2.719(4) 2_756
O13 C24 1.284(5) .
O13 K2 2.973(3) 2_756
O14 C24 1.246(6) .
O15 C31 1.259(5) .
O15 K1 3.302(4) 2_766
O16 C31 1.253(5) .
O16 Tb2 2.310(3) 1_655
O17 C32 1.257(6) .
O18 C32 1.263(6) .
O18 K1 2.917(4) 1_556
O22 O22 1.32(5) 2_765
C1 C2 1.374(7) .
C1 C6 1.386(7) .
C2 C3 1.403(6) .
C2 H2A 0.9300 .
C3 C4 1.386(7) .
C3 C7 1.506(6) .
C4 C5 1.395(7) .
C4 C8 1.500(6) .
C5 C6 1.373(7) .
C5 H5A 0.9300 .
C6 H6A 0.9300 .
C7 Tb2 2.893(5) 2_666
C8 Tb2 2.854(4) 1_554
C9 C10 1.371(6) .
C9 C14 1.381(6) .
C10 C11 1.396(6) .
C10 H10A 0.9300 .
C11 C12 1.389(6) .
C11 C15 1.509(6) .
C12 C13 1.388(6) .
C12 H12A 0.9300 .
C13 C14 1.393(6) .
C13 C16 1.509(6) .
C14 H14A 0.9300 .
C16 K2 3.473(5) 2_656
C17 C22 1.379(7) .
C17 C18 1.379(7) .
C18 C19 1.403(6) 2_756
C18 H18A 0.9300 .
C19 C20 1.386(7) 2_756
C19 C18 1.403(6) 2_756
C19 C23 1.518(6) .
C20 C19 1.386(7) 2_756
C20 C21 1.403(6) .
C20 C24 1.500(6) .
C21 C22 1.383(7) .
C21 H21B 0.9300 .
C22 H22B 0.9300 .
C25 C26 1.377(6) 1_554
C25 C30 1.381(7) 1_554
C26 C25 1.377(6) 1_556
C26 C27 1.405(6) .
C26 H26B 0.9300 .
C27 C28 1.390(6) .
C27 C31 1.505(6) .
C28 C29 1.387(6) .
C28 H28A 0.9300 .
C29 C30 1.399(6) .
C29 C32 1.503(6) .
C30 C25 1.381(7) 1_556
C30 H30B 0.9300 .
C31 K1 3.248(5) 2_766
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
C9 O1 C1 C2 -135.9(5) . .
C9 O1 C1 C6 49.4(7) . .
C6 C1 C2 C3 1.0(7) . .
O1 C1 C2 C3 -173.8(4) . .
C1 C2 C3 C4 -0.1(7) . .
C1 C2 C3 C7 -178.1(4) . .
C2 C3 C4 C5 -0.4(7) . .
C7 C3 C4 C5 177.3(5) . .
C2 C3 C4 C8 177.5(4) . .
C7 C3 C4 C8 -4.8(7) . .
C3 C4 C5 C6 0.1(8) . .
C8 C4 C5 C6 -177.9(5) . .
C4 C5 C6 C1 0.8(8) . .
C2 C1 C6 C5 -1.4(8) . .
O1 C1 C6 C5 173.1(5) . .
Tb2 O2 C7 O3 7.1(5) 2_666 .
K1 O2 C7 O3 -101.0(5) . .
Tb2 O2 C7 C3 -168.1(4) 2_666 .
K1 O2 C7 C3 83.8(5) . .
K1 O2 C7 Tb2 -108.1(2) . 2_666
Tb2 O2 C7 K1 108.1(2) 2_666 .
Tb2 O3 C7 O2 -7.5(5) 2_666 .
K1 O3 C7 O2 95.3(5) 2_665 .
Tb2 O3 C7 C3 167.8(4) 2_666 .
K1 O3 C7 C3 -89.4(4) 2_665 .
K1 O3 C7 Tb2 102.8(2) 2_665 2_666
Tb2 O3 C7 K1 -56.5(3) 2_666 .
K1 O3 C7 K1 46.3(4) 2_665 .
C4 C3 C7 O2 -84.5(6) . .
C2 C3 C7 O2 93.3(6) . .
C4 C3 C7 O3 100.2(6) . .
C2 C3 C7 O3 -82.0(6) . .
C4 C3 C7 Tb2 164.3(15) . 2_666
C2 C3 C7 Tb2 -18(2) . 2_666
C4 C3 C7 K1 -40.1(5) . .
C2 C3 C7 K1 137.7(4) . .
Tb2 O4 C8 O5 -0.4(5) 1_554 .
Tb2 O4 C8 C4 178.4(4) 1_554 .
Tb2 O5 C8 O4 0.4(5) 1_554 .
K1 O5 C8 O4 -96.7(4) . .
K1 O5 C8 O4 108.1(4) 2_665 .
Tb2 O5 C8 C4 -178.4(4) 1_554 .
K1 O5 C8 C4 84.5(4) . .
K1 O5 C8 C4 -70.7(5) 2_665 .
K1 O5 C8 Tb2 -97.1(2) . 1_554
K1 O5 C8 Tb2 107.7(3) 2_665 1_554
C3 C4 C8 O4 178.0(4) . .
C5 C4 C8 O4 -4.2(7) . .
C3 C4 C8 O5 -3.2(7) . .
C5 C4 C8 O5 174.6(4) . .
C1 O1 C9 C10 40.0(7) . .
C1 O1 C9 C14 -143.2(5) . .
C14 C9 C10 C11 -4.1(8) . .
O1 C9 C10 C11 172.5(5) . .
C9 C10 C11 C12 1.8(8) . .
C9 C10 C11 C15 178.6(4) . .
C10 C11 C12 C13 1.9(7) . .
C15 C11 C12 C13 -174.8(4) . .
C11 C12 C13 C14 -3.4(7) . .
C11 C12 C13 C16 176.2(4) . .
C10 C9 C14 C13 2.6(8) . .
O1 C9 C14 C13 -174.2(4) . .
C12 C13 C14 C9 1.2(7) . .
C16 C13 C14 C9 -178.4(4) . .
Tb1 O6 C15 O7 -8.3(5) . .
Tb1 O6 C15 C11 169.9(4) . .
Tb1 O7 C15 O6 8.6(5) . .
K2 O7 C15 O6 107.3(5) . .
Tb1 O7 C15 C11 -169.7(4) . .
K2 O7 C15 C11 -70.9(5) . .
K2 O7 C15 Tb1 98.8(2) . .
C12 C11 C15 O6 -39.9(7) . .
C10 C11 C15 O6 143.4(5) . .
C12 C11 C15 O7 138.4(5) . .
C10 C11 C15 O7 -38.4(7) . .
Tb1 O8 C16 O9 49.5(11) 1_455 .
K2 O8 C16 O9 -80.7(5) 2_656 .
Tb1 O8 C16 C13 -132.2(7) 1_455 .
K2 O8 C16 C13 97.6(4) 2_656 .
Tb1 O8 C16 K2 130.2(9) 1_455 2_656
Tb2 O9 C16 O8 -65.7(9) . .
Tb2 O9 C16 C13 116.0(6) . .
Tb2 O9 C16 K2 -126.5(5) . 2_656
C12 C13 C16 O8 -170.9(5) . .
C14 C13 C16 O8 8.7(7) . .
C12 C13 C16 O9 7.4(7) . .
C14 C13 C16 O9 -172.9(4) . .
C12 C13 C16 K2 -104.3(4) . 2_656
C14 C13 C16 K2 75.3(5) . 2_656
C25 O10 C17 C22 -54.7(6) . .
C25 O10 C17 C18 130.8(5) . .
C22 C17 C18 C19 -1.4(7) . 2_756
O10 C17 C18 C19 173.2(4) . 2_756
C19 C20 C21 C22 -0.7(7) 2_756 .
C24 C20 C21 C22 176.4(4) . .
O10 C17 C22 C21 -172.9(4) . .
C18 C17 C22 C21 1.4(7) . .
C20 C21 C22 C17 -0.3(7) . .
Tb1 O11 C23 O12 -4.5(5) . .
K2 O11 C23 O12 93.5(5) . .
Tb1 O11 C23 C19 170.3(4) . .
K2 O11 C23 C19 -91.6(4) . .
K2 O11 C23 Tb1 98.0(2) . .
Tb1 O11 C23 K2 -98.0(2) . .
Tb1 O12 C23 O11 4.6(5) . .
K2 O12 C23 O11 -102.3(5) 2_756 .
Tb1 O12 C23 C19 -170.2(4) . .
K2 O12 C23 C19 82.9(4) 2_756 .
K2 O12 C23 Tb1 -106.9(3) 2_756 .
Tb1 O12 C23 K2 56.6(2) . .
K2 O12 C23 K2 -50.3(4) 2_756 .
C20 C19 C23 O11 102.1(6) 2_756 .
C18 C19 C23 O11 -78.7(6) 2_756 .
C20 C19 C23 O12 -82.9(6) 2_756 .
C18 C19 C23 O12 96.2(5) 2_756 .
C20 C19 C23 K2 51.4(5) 2_756 .
C18 C19 C23 K2 -129.5(4) 2_756 .
Tb1 O14 C24 O13 2.4(4) . .
Tb1 O14 C24 C20 -175.0(4) . .
Tb1 O13 C24 O14 -2.4(5) . .
K2 O13 C24 O14 98.8(4) . .
K2 O13 C24 O14 -103.1(5) 2_756 .
Tb1 O13 C24 C20 175.0(4) . .
K2 O13 C24 C20 -83.8(4) . .
K2 O13 C24 C20 74.3(5) 2_756 .
K2 O13 C24 Tb1 101.2(2) . .
K2 O13 C24 Tb1 -100.7(3) 2_756 .
C19 C20 C24 O14 177.5(4) 2_756 .
C21 C20 C24 O14 0.5(7) . .
C19 C20 C24 O13 0.1(7) 2_756 .
C21 C20 C24 O13 -176.9(4) . .
C17 O10 C25 C26 150.6(5) . 1_554
C17 O10 C25 C30 -33.6(7) . 1_554
C25 C26 C27 C28 -1.4(7) 1_556 .
C25 C26 C27 C31 177.8(4) 1_556 .
C26 C27 C28 C29 2.2(7) . .
C31 C27 C28 C29 -176.9(5) . .
C27 C28 C29 C30 -1.2(8) . .
C27 C28 C29 C32 -179.1(4) . .
C28 C29 C30 C25 -0.7(8) . 1_556
C32 C29 C30 C25 177.2(5) . 1_556
Tb2 O16 C31 O15 44.3(9) 1_655 .
Tb2 O16 C31 C27 -134.0(5) 1_655 .
Tb2 O16 C31 K1 -38.3(6) 1_655 2_766
Tb1 O15 C31 O16 65.1(7) . .
K1 O15 C31 O16 -89.4(5) 2_766 .
Tb1 O15 C31 C27 -116.6(5) . .
K1 O15 C31 C27 88.9(4) 2_766 .
Tb1 O15 C31 K1 154.5(4) . 2_766
C28 C27 C31 O16 -178.0(5) . .
C26 C27 C31 O16 2.9(7) . .
C28 C27 C31 O15 3.6(7) . .
C26 C27 C31 O15 -175.6(4) . .
C28 C27 C31 K1 85.4(4) . 2_766
C26 C27 C31 K1 -93.8(4) . 2_766
Tb2 O17 C32 O18 -5.7(5) . .
Tb2 O17 C32 C29 173.1(4) . .
Tb2 O18 C32 O17 5.7(5) . .
K1 O18 C32 O17 -89.8(5) 1_556 .
Tb2 O18 C32 C29 -173.1(4) . .
K1 O18 C32 C29 91.4(5) 1_556 .
K1 O18 C32 Tb2 -95.5(2) 1_556 .
C28 C29 C32 O17 32.0(7) . .
C30 C29 C32 O17 -146.0(5) . .
C28 C29 C32 O18 -149.2(5) . .
C30 C29 C32 O18 32.8(7) . .
