#------------------------------------------------------------------------------
#$Date: 2016-03-23 03:30:50 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179249 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/69/4316961.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_4316961
loop_
_publ_author_name
'Ji-Jun Jiang'
'Mei Pan'
'Jun-Min Liu'
'Wei Wang'
'Cheng-Yong Su'
_publ_section_title
;
 Assembly of Robust and Porous Hydrogen-Bonded Coordination Frameworks:
 Isomorphism, Polymorphism, and Selective Adsorption
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              10166
_journal_page_last               10173
_journal_paper_doi               10.1021/ic1014384
_journal_volume                  49
_journal_year                    2010
_chemical_formula_sum            'C24 H25 N10 O11 Yb'
_chemical_formula_weight         802.58
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 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                 97.984(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   26.5349(18)
_cell_length_b                   14.2013(12)
_cell_length_c                   17.1284(8)
_cell_measurement_temperature    293(2)
_cell_volume                     6391.9(8)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.963
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measurement_device_type  Apex
_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  0.0393
_diffrn_reflns_av_sigmaI/netI    0.0678
_diffrn_reflns_limit_h_max       32
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            17281
_diffrn_reflns_theta_full        27.00
_diffrn_reflns_theta_max         27.00
_diffrn_reflns_theta_min         2.73
_exptl_absorpt_coefficient_mu    2.997
_exptl_absorpt_correction_T_max  0.6620
_exptl_absorpt_correction_T_min  0.4667
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.668
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             3176
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.962
_refine_diff_density_min         -0.692
_refine_diff_density_rms         0.116
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    geom
_refine_ls_matrix_type           full
_refine_ls_number_parameters     436
_refine_ls_number_reflns         6721
_refine_ls_number_restraints     37
_refine_ls_restrained_S_all      1.046
_refine_ls_R_factor_all          0.0911
_refine_ls_R_factor_gt           0.0388
_refine_ls_shift/su_max          0.034
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0546P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0928
_refine_ls_wR_factor_ref         0.1155
_reflns_number_gt                3744
_reflns_number_total             6721
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic1014384_si_001_02.cif
_cod_data_source_block           1-yb-2H2O
_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 
;
_cod_database_code               4316961
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, 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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Yb1 Yb 0.337903(9) -0.00230(2) -0.402033(13) 0.05055(11) Uani 1 1 d . A .
O1 O 0.35571(18) -0.1634(3) -0.3529(2) 0.0748(14) Uani 1 1 d . A .
N1 N 0.31576(18) -0.0003(4) -0.5592(3) 0.0504(11) Uani 1 1 d . A .
C1 C 0.3644(2) 0.0055(5) -0.5957(3) 0.0575(15) Uani 1 1 d . . .
H1A H 0.3589 -0.0206 -0.6485 0.069 Uiso 1 1 calc R A .
H1B H 0.3745 0.0708 -0.5993 0.069 Uiso 1 1 calc R . .
O2 O 0.3171(2) -0.0707(4) -0.2820(2) 0.0734(14) Uani 1 1 d . A .
N2 N 0.40500(19) -0.0651(4) -0.4709(3) 0.0539(13) Uani 1 1 d . A .
C2 C 0.4048(2) -0.0472(4) -0.5470(3) 0.0520(15) Uani 1 1 d . A .
O3 O 0.3423(2) -0.2049(4) -0.2346(3) 0.114(2) Uani 1 1 d . . .
N3 N 0.26187(18) -0.0967(3) -0.4562(3) 0.0512(12) Uani 1 1 d . A .
C3 C 0.4759(3) -0.1216(5) -0.5131(4) 0.0567(16) Uani 1 1 d . . .
O4 O 0.32590(19) 0.1167(4) -0.2964(2) 0.0706(13) Uani 1 1 d . A .
N4 N 0.33621(19) 0.1553(4) -0.4646(3) 0.0541(13) Uani 1 1 d . A .
C4 C 0.5234(3) -0.1659(6) -0.5080(4) 0.076(2) Uani 1 1 d . . .
H4A H 0.5408 -0.1709 -0.5513 0.092 Uiso 1 1 calc R . .
O5 O 0.26024(17) 0.0765(3) -0.3792(2) 0.0641(12) Uani 1 1 d . A .
N5 N 0.44642(19) -0.0786(4) -0.5736(3) 0.0614(15) Uani 1 1 d . . .
H5A H 0.4534 -0.0726 -0.6209 0.074 Uiso 1 1 calc R A .
C5 C 0.5428(3) -0.2013(6) -0.4357(5) 0.079(2) Uani 1 1 d . . .
H5B H 0.5735 -0.2339 -0.4305 0.094 Uiso 1 1 calc R . .
O6 O 0.2540(2) 0.1871(4) -0.2935(3) 0.0942(18) Uani 1 1 d . . .
N6 N 0.2056(2) -0.1480(4) -0.5569(3) 0.0603(14) Uani 1 1 d . . .
H6A H 0.1925 -0.1609 -0.6045 0.072 Uiso 1 1 calc R . .
C6 C 0.5182(3) -0.1904(6) -0.3695(4) 0.078(2) Uani 1 1 d . . .
H6B H 0.5337 -0.2129 -0.3211 0.094 Uiso 1 1 calc R . .
N7 N 0.3078(2) 0.2536(4) -0.5620(3) 0.0599(14) Uani 1 1 d . . .
H7A H 0.2927 0.2732 -0.6067 0.072 Uiso 1 1 calc R . .
C7 C 0.4712(2) -0.1469(5) -0.3743(4) 0.0673(19) Uani 1 1 d . . .
H7B H 0.4544 -0.1415 -0.3303 0.081 Uiso 1 1 calc R . .
N8 N 0.3381(2) -0.1485(5) -0.2888(3) 0.0775(18) Uani 1 1 d . A .
C8 C 0.4502(2) -0.1117(4) -0.4470(3) 0.0530(15) Uani 1 1 d . . .
N9 N 0.2791(2) 0.1280(4) -0.3219(3) 0.0647(15) Uani 1 1 d . . .
C9 C 0.2885(2) -0.0874(5) -0.5877(3) 0.0565(16) Uani 1 1 d . . .
H9A H 0.2706 -0.0777 -0.6404 0.068 Uiso 1 1 calc R A .
H9B H 0.3126 -0.1385 -0.5896 0.068 Uiso 1 1 calc R . .
C10 C 0.2525(3) -0.1109(4) -0.5336(3) 0.0548(16) Uani 1 1 d . A .
C11 C 0.18346(14) -0.1609(2) -0.49142(19) 0.0608(17) Uani 1 1 d G . .
C12 C 0.13610(15) -0.1954(3) -0.4795(2) 0.086(2) Uani 1 1 d G . .
H12A H 0.1130 -0.2152 -0.5223 0.103 Uiso 1 1 calc R . .
C13 C 0.12321(13) -0.2005(3) -0.4037(3) 0.089(3) Uani 1 1 d G . .
H13A H 0.0915 -0.2236 -0.3957 0.106 Uiso 1 1 calc R . .
C14 C 0.15767(18) -0.1710(3) -0.3398(2) 0.096(3) Uani 1 1 d G . .
H14A H 0.1490 -0.1743 -0.2891 0.115 Uiso 1 1 calc R . .
C15 C 0.20502(17) -0.1365(3) -0.35168(18) 0.079(2) Uani 1 1 d G A .
H15A H 0.2281 -0.1167 -0.3089 0.095 Uiso 1 1 calc R . .
C16 C 0.21792(11) -0.1314(2) -0.42750(18) 0.0555(16) Uani 1 1 d G . .
C17 C 0.2850(2) 0.0840(4) -0.5804(3) 0.0570(16) Uani 1 1 d G . .
H17A H 0.2509 0.0752 -0.5673 0.068 Uiso 1 1 calc R A .
H17B H 0.2825 0.0957 -0.6366 0.068 Uiso 1 1 calc R . .
C18 C 0.3098(2) 0.1645(5) -0.5360(3) 0.0547(16) Uani 1 1 d . A .
C19 C 0.3345(3) 0.3082(5) -0.5034(4) 0.0648(18) Uani 1 1 d . . .
C20 C 0.3455(3) 0.4038(6) -0.4994(5) 0.081(2) Uani 1 1 d . . .
H20A H 0.3337 0.4443 -0.5405 0.097 Uiso 1 1 calc R . .
C21 C 0.3743(4) 0.4356(6) -0.4321(5) 0.090(3) Uani 1 1 d . . .
H21A H 0.3829 0.4990 -0.4276 0.108 Uiso 1 1 calc R . .
C22 C 0.3903(4) 0.3765(6) -0.3723(5) 0.095(3) Uani 1 1 d . . .
H22A H 0.4086 0.4017 -0.3268 0.114 Uiso 1 1 calc R . .
C23 C 0.3812(3) 0.2790(5) -0.3745(4) 0.079(2) Uani 1 1 d . . .
H23A H 0.3939 0.2393 -0.3333 0.095 Uiso 1 1 calc R . .
C24 C 0.3520(2) 0.2460(5) -0.4423(4) 0.0563(16) Uani 1 1 d . . .
N10 N 0.4301(3) 0.0524(6) -0.2736(6) 0.084(2) Uani 1 1 d . A 1
O7 O 0.4184(10) 0.072(2) -0.3549(12) 0.076(6) Uani 0.50 1 d P A 1
O8 O 0.4328(4) -0.0145(9) -0.2227(5) 0.061(3) Uani 0.50 1 d P A 1
O9 O 0.4347(6) 0.1357(9) -0.2350(8) 0.086(4) Uani 0.50 1 d P A 1
O7' O 0.4112(12) 0.046(2) -0.3381(16) 0.072(5) Uani 0.50 1 d PU A 2
O8' O 0.4104(7) -0.0170(12) -0.2694(11) 0.123(5) Uani 0.50 1 d PU A 2
O9' O 0.4613(5) 0.0995(14) -0.2426(9) 0.100(5) Uani 0.50 1 d PU B 2
O1W O 0.3460(6) 0.6082(9) -0.2856(7) 0.296(6) Uani 1 1 d U C 1
O2W O 0.5369(13) 0.534(2) -0.341(2) 0.303(14) Uani 0.50 1 d PU D 1
O3W O 0.4693(12) 0.559(2) -0.259(3) 0.357(16) Uani 0.50 1 d PU . 2
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'
N N 0.0061 0.0033 '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'
Yb Yb -0.3850 5.5486 '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
O7' Yb1 O2 89.6(5) . . ?
O7' Yb1 O7 11.7(9) . . ?
O2 Yb1 O7 100.8(5) . . ?
O7' Yb1 O5 119.1(9) . . ?
O2 Yb1 O5 75.37(16) . . ?
O7 Yb1 O5 118.5(8) . . ?
O7' Yb1 N2 72.6(8) . . ?
O2 Yb1 N2 122.38(17) . . ?
O7 Yb1 N2 69.5(7) . . ?
O5 Yb1 N2 160.32(16) . . ?
O7' Yb1 O1 90.4(8) . . ?
O2 Yb1 O1 52.29(15) . . ?
O7 Yb1 O1 99.9(7) . . ?
O5 Yb1 O1 120.08(15) . . ?
N2 Yb1 O1 72.96(16) . . ?
O7' Yb1 N4 83.9(7) . . ?
O2 Yb1 N4 137.85(17) . . ?
O7 Yb1 N4 73.4(6) . . ?
O5 Yb1 N4 71.83(15) . . ?
N2 Yb1 N4 95.26(16) . . ?
O1 Yb1 N4 168.03(15) . . ?
O7' Yb1 N3 164.9(8) . . ?
O2 Yb1 N3 80.24(16) . . ?
O7 Yb1 N3 172.2(8) . . ?
O5 Yb1 N3 69.27(16) . . ?
N2 Yb1 N3 103.37(16) . . ?
O1 Yb1 N3 74.58(16) . . ?
N4 Yb1 N3 111.09(16) . . ?
O7' Yb1 O4 68.0(9) . . ?
O2 Yb1 O4 65.91(17) . . ?
O7 Yb1 O4 70.4(7) . . ?
O5 Yb1 O4 51.78(15) . . ?
N2 Yb1 O4 139.83(16) . . ?
O1 Yb1 O4 114.45(15) . . ?
N4 Yb1 O4 73.11(15) . . ?
N3 Yb1 O4 116.74(15) . . ?
O7' Yb1 N1 123.5(5) . . ?
O2 Yb1 N1 145.06(17) . . ?
O7 Yb1 N1 113.1(5) . . ?
O5 Yb1 N1 94.87(14) . . ?
N2 Yb1 N1 65.78(15) . . ?
O1 Yb1 N1 111.05(15) . . ?
N4 Yb1 N1 64.34(16) . . ?
N3 Yb1 N1 65.03(15) . . ?
O4 Yb1 N1 132.95(15) . . ?
O7' Yb1 O8' 32.2(6) . . ?
O2 Yb1 O8' 59.0(3) . . ?
O7 Yb1 O8' 43.8(6) . . ?
O5 Yb1 O8' 114.3(3) . . ?
N2 Yb1 O8' 84.2(3) . . ?
O1 Yb1 O8' 64.6(4) . . ?
N4 Yb1 O8' 113.0(4) . . ?
N3 Yb1 O8' 134.3(4) . . ?
O4 Yb1 O8' 66.8(3) . . ?
N1 Yb1 O8' 148.8(3) . . ?
O7' Yb1 N8 88.4(6) . . ?
O2 Yb1 N8 25.93(15) . . ?
O7 Yb1 N8 99.9(6) . . ?
O5 Yb1 N8 98.55(17) . . ?
N2 Yb1 N8 97.50(18) . . ?
O1 Yb1 N8 26.45(16) . . ?
N4 Yb1 N8 162.42(18) . . ?
N3 Yb1 N8 77.60(17) . . ?
O4 Yb1 N8 89.36(19) . . ?
N1 Yb1 N8 132.38(18) . . ?
O8' Yb1 N8 56.7(4) . . ?
N8 O1 Yb1 93.7(4) . . ?
C17 N1 C9 111.8(4) . . ?
C17 N1 C1 109.4(4) . . ?
C9 N1 C1 108.4(4) . . ?
C17 N1 Yb1 107.1(3) . . ?
C9 N1 Yb1 110.6(3) . . ?
C1 N1 Yb1 109.6(3) . . ?
C2 C1 N1 109.6(5) . . ?
C2 C1 H1A 109.7 . . ?
N1 C1 H1A 109.7 . . ?
C2 C1 H1B 109.7 . . ?
N1 C1 H1B 109.7 . . ?
H1A C1 H1B 108.2 . . ?
N8 O2 Yb1 96.8(4) . . ?
C2 N2 C8 105.6(5) . . ?
C2 N2 Yb1 120.1(4) . . ?
C8 N2 Yb1 134.0(4) . . ?
N2 C2 N5 112.4(6) . . ?
N2 C2 C1 123.9(5) . . ?
N5 C2 C1 123.5(5) . . ?
C10 N3 C16 104.1(5) . . ?
C10 N3 Yb1 118.8(4) . . ?
C16 N3 Yb1 136.2(3) . . ?
N5 C3 C4 132.0(6) . . ?
N5 C3 C8 106.1(6) . . ?
C4 C3 C8 121.9(7) . . ?
N9 O4 Yb1 93.1(3) . . ?
C18 N4 C24 105.2(5) . . ?
C18 N4 Yb1 117.5(4) . . ?
C24 N4 Yb1 136.9(4) . . ?
C5 C4 C3 116.3(7) . . ?
C5 C4 H4A 121.9 . . ?
C3 C4 H4A 121.9 . . ?
N9 O5 Yb1 97.9(4) . . ?
C2 N5 C3 108.0(5) . . ?
C2 N5 H5A 126.0 . . ?
C3 N5 H5A 126.0 . . ?
C4 C5 C6 122.4(7) . . ?
C4 C5 H5B 118.8 . . ?
C6 C5 H5B 118.8 . . ?
C11 N6 C10 107.1(5) . . ?
C11 N6 H6A 126.4 . . ?
C10 N6 H6A 126.4 . . ?
C7 C6 C5 121.5(7) . . ?
C7 C6 H6B 119.3 . . ?
C5 C6 H6B 119.3 . . ?
C18 N7 C19 107.2(5) . . ?
C18 N7 H7A 126.4 . . ?
C19 N7 H7A 126.4 . . ?
C6 C7 C8 117.4(6) . . ?
C6 C7 H7B 121.3 . . ?
C8 C7 H7B 121.3 . . ?
O3 N8 O2 120.3(6) . . ?
O3 N8 O1 122.9(7) . . ?
O2 N8 O1 116.8(6) . . ?
O3 N8 Yb1 172.4(6) . . ?
O2 N8 Yb1 57.3(3) . . ?
O1 N8 Yb1 59.8(3) . . ?
N2 C8 C7 131.6(5) . . ?
N2 C8 C3 107.9(5) . . ?
C7 C8 C3 120.4(6) . . ?
O6 N9 O4 121.0(6) . . ?
O6 N9 O5 121.9(6) . . ?
O4 N9 O5 117.1(5) . . ?
O6 N9 Yb1 174.8(4) . . ?
O4 N9 Yb1 60.9(3) . . ?
O5 N9 Yb1 56.3(3) . . ?
C10 C9 N1 108.4(5) . . ?
C10 C9 H9A 110.0 . . ?
N1 C9 H9A 110.0 . . ?
C10 C9 H9B 110.0 . . ?
N1 C9 H9B 110.0 . . ?
H9A C9 H9B 108.4 . . ?
N3 C10 N6 112.9(6) . . ?
N3 C10 C9 123.4(6) . . ?
N6 C10 C9 123.7(6) . . ?
N6 C11 C12 132.6(3) . . ?
N6 C11 C16 107.4(3) . . ?
C12 C11 C16 120.0 . . ?
C11 C12 C13 120.0 . . ?
C11 C12 H12A 120.0 . . ?
C13 C12 H12A 120.0 . . ?
C14 C13 C12 120.0 . . ?
C14 C13 H13A 120.0 . . ?
C12 C13 H13A 120.0 . . ?
C13 C14 C15 120.0 . . ?
C13 C14 H14A 120.0 . . ?
C15 C14 H14A 120.0 . . ?
C14 C15 C16 120.0 . . ?
C14 C15 H15A 120.0 . . ?
C16 C15 H15A 120.0 . . ?
C15 C16 C11 120.0 . . ?
C15 C16 N3 131.6(3) . . ?
C11 C16 N3 108.4(3) . . ?
N1 C17 C18 108.2(5) . . ?
N1 C17 H17A 110.1 . . ?
C18 C17 H17A 110.1 . . ?
N1 C17 H17B 110.1 . . ?
C18 C17 H17B 110.1 . . ?
H17A C17 H17B 108.4 . . ?
N4 C18 N7 112.9(6) . . ?
N4 C18 C17 122.6(6) . . ?
N7 C18 C17 124.5(6) . . ?
N7 C19 C20 131.8(7) . . ?
N7 C19 C24 105.8(6) . . ?
C20 C19 C24 122.3(7) . . ?
C21 C20 C19 117.0(8) . . ?
C21 C20 H20A 121.5 . . ?
C19 C20 H20A 121.5 . . ?
C22 C21 C20 121.0(8) . . ?
C22 C21 H21A 119.5 . . ?
C20 C21 H21A 119.5 . . ?
C21 C22 C23 124.0(8) . . ?
C21 C22 H22A 118.0 . . ?
C23 C22 H22A 118.0 . . ?
C24 C23 C22 115.5(7) . . ?
C24 C23 H23A 122.3 . . ?
C22 C23 H23A 122.3 . . ?
C23 C24 N4 130.9(6) . . ?
C23 C24 C19 120.2(7) . . ?
N4 C24 C19 108.9(6) . . ?
O8 N10 O9 108.9(11) . . ?
O8 N10 O7 142.8(15) . . ?
O9 N10 O7 107.8(14) . . ?
N10 O7 Yb1 107.9(11) . . ?
O8' O7' Yb1 95.5(15) . . ?
O7' O8' Yb1 52.3(14) . . ?
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
Yb1 O7' 2.21(3) . ?
Yb1 O2 2.406(4) . ?
Yb1 O7 2.42(3) . ?
Yb1 O5 2.424(4) . ?
Yb1 N2 2.437(5) . ?
Yb1 O1 2.461(5) . ?
Yb1 N4 2.480(5) . ?
Yb1 N3 2.491(5) . ?
Yb1 O4 2.528(4) . ?
Yb1 N1 2.675(4) . ?
Yb1 O8' 2.77(2) . ?
Yb1 N8 2.841(6) . ?
O1 N8 1.268(6) . ?
N1 C17 1.466(7) . ?
N1 C9 1.480(7) . ?
N1 C1 1.511(7) . ?
C1 C2 1.468(9) . ?
C1 H1A 0.9700 . ?
C1 H1B 0.9700 . ?
O2 N8 1.251(7) . ?
N2 C2 1.328(7) . ?
N2 C8 1.381(7) . ?
C2 N5 1.329(7) . ?
O3 N8 1.219(7) . ?
N3 C10 1.330(7) . ?
N3 C16 1.415(5) . ?
C3 N5 1.355(8) . ?
C3 C4 1.399(9) . ?
C3 C8 1.408(8) . ?
O4 N9 1.268(7) . ?
N4 C18 1.329(7) . ?
N4 C24 1.392(8) . ?
C4 C5 1.370(10) . ?
C4 H4A 0.9300 . ?
O5 N9 1.269(6) . ?
N5 H5A 0.8600 . ?
C5 C6 1.392(9) . ?
C5 H5B 0.9300 . ?
O6 N9 1.214(6) . ?
N6 C11 1.349(6) . ?
N6 C10 1.359(7) . ?
N6 H6A 0.8600 . ?
C6 C7 1.383(9) . ?
C6 H6B 0.9300 . ?
N7 C18 1.341(7) . ?
N7 C19 1.383(8) . ?
N7 H7A 0.8600 . ?
C7 C8 1.386(8) . ?
C7 H7B 0.9300 . ?
C9 C10 1.460(8) . ?
C9 H9A 0.9700 . ?
C9 H9B 0.9700 . ?
C11 C12 1.3900 . ?
C11 C16 1.3900 . ?
C12 C13 1.3900 . ?
C12 H12A 0.9300 . ?
C13 C14 1.3900 . ?
C13 H13A 0.9300 . ?
C14 C15 1.3900 . ?
C14 H14A 0.9300 . ?
C15 C16 1.3900 . ?
C15 H15A 0.9300 . ?
C17 C18 1.476(8) . ?
C17 H17A 0.9700 . ?
C17 H17B 0.9700 . ?
C19 C20 1.387(10) . ?
C19 C24 1.398(9) . ?
C20 C21 1.369(10) . ?
C20 H20A 0.9300 . ?
C21 C22 1.347(10) . ?
C21 H21A 0.9300 . ?
C22 C23 1.406(10) . ?
C22 H22A 0.9300 . ?
C23 C24 1.385(9) . ?
C23 H23A 0.9300 . ?
N10 O8 1.286(13) . ?
N10 O9 1.352(15) . ?
N10 O7 1.41(2) . ?
O7' O8' 1.48(3) . ?
O3W O3W 1.62(6) 2_654 ?
