#------------------------------------------------------------------------------
#$Date: 2016-03-24 02:15:46 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179565 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/34/4503417.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_4503417
loop_
_publ_author_name
'Zhu, Xiandong'
'Lü, Jian'
'Li, Xiaoju'
'Gao, Shuiying'
'Li, Guoliang'
'Xiao, Fuxian'
'Cao, Rong'
_publ_section_title
;
 Syntheses, Structures, Near-Infrared, and Visible Luminescence of
 Lanthanide-Organic Frameworks with Flexible Macrocyclic Polyamine Ligands
;
_journal_issue                   6
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              1897
_journal_paper_doi               10.1021/cg701098t
_journal_volume                  8
_journal_year                    2008
_chemical_formula_sum            'C18 H34 N5 O13 Tb'
_chemical_formula_weight         687.42
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                101.5940(10)
_cell_angle_beta                 108.7800(10)
_cell_angle_gamma                111.3990(10)
_cell_formula_units_Z            2
_cell_length_a                   8.9441(3)
_cell_length_b                   12.0863(4)
_cell_length_c                   13.5695(4)
_cell_measurement_reflns_used    3692
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.4835
_cell_measurement_theta_min      2.5052
_cell_volume                     1205.72(7)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker XSCANS'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'Siemens SMART CCD'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0236
_diffrn_reflns_av_sigmaI/netI    0.0344
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            6666
_diffrn_reflns_theta_full        25.68
_diffrn_reflns_theta_max         25.68
_diffrn_reflns_theta_min         1.70
_exptl_absorpt_coefficient_mu    3.010
_exptl_absorpt_correction_T_max  0.878
_exptl_absorpt_correction_T_min  0.442
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.893
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             692
_exptl_crystal_size_max          0.2500
_exptl_crystal_size_mid          0.3000
_exptl_crystal_size_min          0.0520
_refine_diff_density_max         2.476
_refine_diff_density_min         -1.423
_refine_diff_density_rms         0.355
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.276
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     334
_refine_ls_number_reflns         4533
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.276
_refine_ls_R_factor_all          0.0559
_refine_ls_R_factor_gt           0.0489
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0646P)²+9.8001P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1276
_refine_ls_wR_factor_ref         0.1437
_reflns_number_gt                4290
_reflns_number_total             4533
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg701098t-file002.cif
_cod_data_source_block           CCDC_661350_Tb
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4503417
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Tb1 Tb 0.25636(4) 0.49930(3) 0.51009(3) 0.01804(15) Uani 1 1 d .
O1 O -0.0432(7) 0.3580(6) 0.4143(5) 0.0291(13) Uani 1 1 d .
O2 O -0.3309(7) 0.2951(6) 0.3612(5) 0.0277(12) Uani 1 1 d .
O3 O -0.2251(7) -0.2839(5) 0.5098(5) 0.0265(12) Uani 1 1 d .
O4 O -0.4973(8) -0.3608(6) 0.4990(5) 0.0311(13) Uani 1 1 d .
O5 O 0.2305(7) 0.3994(6) 0.3270(4) 0.0270(12) Uani 1 1 d .
O6 O 0.4966(7) 0.4519(6) 0.3238(4) 0.0243(12) Uani 1 1 d .
O7 O 0.8441(7) 0.5520(5) 0.3521(4) 0.0238(12) Uani 1 1 d .
O8 O 1.1260(7) 0.5941(5) 0.3863(5) 0.0237(11) Uani 1 1 d .
O9 O 0.8522(18) 0.2215(16) -0.1007(14) 0.130(6) Uani 1 1 d .
O10 O 0.615(3) 0.089(3) -0.154(3) 0.32(2) Uani 1 1 d .
O11 O 0.792(7) 0.087(3) -0.038(3) 0.33(2) Uani 1 1 d .
N1 N -0.1274(11) 0.0947(7) 0.3355(7) 0.0409(19) Uani 1 1 d .
N2 N -0.1671(11) -0.0348(8) 0.6070(8) 0.0412(19) Uani 1 1 d .
N3 N 0.3626(9) 0.3813(7) 0.0999(5) 0.0250(14) Uani 1 1 d .
N4 N 0.7474(9) 0.4765(7) 0.1201(5) 0.0245(14) Uani 1 1 d .
N5 N 0.752(2) 0.1292(13) -0.1034(14) 0.079(4) Uani 1 1 d .
C1 C -0.2028(10) 0.2774(7) 0.3613(6) 0.0225(16) Uani 1 1 d .
C2 C -0.2409(13) 0.1493(10) 0.2850(9) 0.047(3) Uani 1 1 d .
H2A H -0.3643 0.0891 0.2610 0.057 Uiso 1 1 calc R
H2B H -0.2265 0.1597 0.2190 0.057 Uiso 1 1 calc R
C3 C -0.1978(18) 0.0231(15) 0.3976(13) 0.069(4) Uani 1 1 d .
H3A H -0.1284 -0.0203 0.4213 0.082 Uiso 1 1 calc R
H3B H -0.3194 -0.0415 0.3484 0.082 Uiso 1 1 calc R
C4 C -0.196(2) 0.1048(12) 0.5005(12) 0.069(4) Uani 1 1 d .
H4A H -0.0793 0.1781 0.5420 0.083 Uiso 1 1 calc R
H4B H -0.2813 0.1365 0.4749 0.083 Uiso 1 1 calc R
C5 C -0.233(3) 0.049(2) 0.5693(15) 0.113(8) Uani 1 1 d .
H5A H -0.3622 0.0016 0.5363 0.136 Uiso 1 1 calc R
H5B H -0.1994 0.1178 0.6365 0.136 Uiso 1 1 calc R
C6 C -0.310(2) -0.1414(13) 0.600(2) 0.128(10) Uani 1 1 d .
H6A H -0.4171 -0.1320 0.5702 0.154 Uiso 1 1 calc R
H6B H -0.2885 -0.1400 0.6750 0.154 Uiso 1 1 calc R
C7 C -0.3465(11) -0.2699(8) 0.5305(7) 0.0277(18) Uani 1 1 d .
C8 C -0.0160(19) 0.0409(16) 0.7129(11) 0.072(4) Uani 1 1 d .
H8A H -0.0593 0.0589 0.7681 0.087 Uiso 1 1 calc R
H8B H 0.0530 0.1216 0.7088 0.087 Uiso 1 1 calc R
C9 C 0.1046(18) -0.0119(14) 0.7539(10) 0.063(4) Uani 1 1 d .
H9A H 0.0612 -0.0624 0.7951 0.075 Uiso 1 1 calc R
H9B H 0.2208 0.0582 0.8059 0.075 Uiso 1 1 calc R
C10 C 0.3332(10) 0.4132(7) 0.2808(6) 0.0207(15) Uani 1 1 d .
C11 C 0.2437(12) 0.3843(10) 0.1563(7) 0.032(2) Uani 1 1 d .
H11A H 0.1376 0.3025 0.1219 0.038 Uiso 1 1 calc R
H11B H 0.2066 0.4485 0.1446 0.038 Uiso 1 1 calc R
C12 C 0.3860(13) 0.2615(9) 0.0931(7) 0.0330(19) Uani 1 1 d .
H12A H 0.4313 0.2602 0.1679 0.040 Uiso 1 1 calc R
H12B H 0.2698 0.1877 0.0497 0.040 Uiso 1 1 calc R
C13 C 0.5079(12) 0.2486(9) 0.0427(7) 0.0319(19) Uani 1 1 d .
H13A H 0.4670 0.2561 -0.0300 0.038 Uiso 1 1 calc R
H13B H 0.4963 0.1634 0.0305 0.038 Uiso 1 1 calc R
C14 C 0.7055(12) 0.3438(9) 0.1094(7) 0.0307(19) Uani 1 1 d .
H14A H 0.7459 0.3402 0.1836 0.037 Uiso 1 1 calc R
H14B H 0.7718 0.3180 0.0738 0.037 Uiso 1 1 calc R
C15 C 0.9326(10) 0.5614(9) 0.2043(7) 0.0286(18) Uani 1 1 d .
H15A H 0.9646 0.6467 0.2031 0.034 Uiso 1 1 calc R
H15B H 1.0101 0.5333 0.1829 0.034 Uiso 1 1 calc R
C16 C 0.9691(10) 0.5678(7) 0.3243(6) 0.0194(15) Uani 1 1 d .
C17 C 0.2777(12) 0.3815(9) -0.0162(7) 0.0290(18) Uani 1 1 d .
H17A H 0.1584 0.3106 -0.0562 0.035 Uiso 1 1 calc R
H17B H 0.3463 0.3695 -0.0563 0.035 Uiso 1 1 calc R
C18 C 0.7323(11) 0.4937(8) 0.0139(7) 0.0288(18) Uani 1 1 d .
H18A H 0.6261 0.4224 -0.0472 0.035 Uiso 1 1 calc R
H18B H 0.8348 0.4966 0.0021 0.035 Uiso 1 1 calc R
OW1 O 0.6347(10) 0.6693(7) 0.2388(6) 0.0441(17) Uani 1 1 d .
OW2 O 1.3828(11) 0.7193(10) 0.2960(9) 0.068(3) 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'
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'
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
O1 Tb1 O4 145.5(2) . 1_665
O1 Tb1 O6 138.7(2) . 2_666
O4 Tb1 O6 74.7(2) 1_665 2_666
O1 Tb1 O7 73.42(19) . 2_666
O4 Tb1 O7 140.16(19) 1_665 2_666
O6 Tb1 O7 70.21(18) 2_666 2_666
O1 Tb1 O5 77.9(2) . .
O4 Tb1 O5 74.5(2) 1_665 .
O6 Tb1 O5 121.66(18) 2_666 .
O7 Tb1 O5 141.2(2) 2_666 .
O1 Tb1 O2 115.5(2) . 2_566
O4 Tb1 O2 76.9(2) 1_665 2_566
O6 Tb1 O2 73.23(19) 2_666 2_566
O7 Tb1 O2 75.5(2) 2_666 2_566
O5 Tb1 O2 141.8(2) . 2_566
O1 Tb1 O8 74.3(2) . 1_455
O4 Tb1 O8 78.1(2) 1_665 1_455
O6 Tb1 O8 143.1(2) 2_666 1_455
O7 Tb1 O8 121.84(18) 2_666 1_455
O5 Tb1 O8 72.89(19) . 1_455
O2 Tb1 O8 76.77(19) 2_566 1_455
O1 Tb1 O3 72.5(2) . 2_556
O4 Tb1 O3 116.3(2) 1_665 2_556
O6 Tb1 O3 80.11(19) 2_666 2_556
O7 Tb1 O3 75.61(19) 2_666 2_556
O5 Tb1 O3 71.2(2) . 2_556
O2 Tb1 O3 145.81(19) 2_566 2_556
O8 Tb1 O3 135.06(19) 1_455 2_556
C1 O1 Tb1 177.1(6) . .
C1 O2 Tb1 115.9(5) . 2_566
C7 O3 Tb1 111.5(5) . 2_556
C7 O4 Tb1 159.0(6) . 1_445
C10 O5 Tb1 135.9(5) . .
C10 O6 Tb1 143.8(5) . 2_666
C16 O7 Tb1 142.9(5) . 2_666
C16 O8 Tb1 134.2(5) . 1_655
C3 N1 C2 111.3(9) . .
C3 N1 C9 111.0(10) . 2_556
C2 N1 C9 110.5(9) . 2_556
C6 N2 C8 118.5(15) . .
C6 N2 C5 108.6(14) . .
C8 N2 C5 107.1(13) . .
C11 N3 C17 108.7(6) . .
C11 N3 C12 109.6(7) . .
C17 N3 C12 110.1(6) . .
C18 N4 C14 110.7(6) . .
C18 N4 C15 107.9(6) . .
C14 N4 C15 109.0(6) . .
O10 N5 O9 123(3) . .
O10 N5 O11 116(3) . .
O9 N5 O11 120(3) . .
O2 C1 O1 125.6(8) . .
O2 C1 C2 118.4(7) . .
O1 C1 C2 115.9(8) . .
N1 C2 C1 115.0(8) . .
N1 C2 H2A 108.5 . .
C1 C2 H2A 108.5 . .
N1 C2 H2B 108.5 . .
C1 C2 H2B 108.5 . .
H2A C2 H2B 107.5 . .
N1 C3 C4 113.9(12) . .
N1 C3 H3A 108.8 . .
C4 C3 H3A 108.8 . .
N1 C3 H3B 108.8 . .
C4 C3 H3B 108.8 . .
H3A C3 H3B 107.7 . .
C5 C4 C3 116.9(12) . .
C5 C4 H4A 108.1 . .
C3 C4 H4A 108.1 . .
C5 C4 H4B 108.1 . .
C3 C4 H4B 108.1 . .
H4A C4 H4B 107.3 . .
C4 C5 N2 126.1(16) . .
C4 C5 H5A 105.8 . .
N2 C5 H5A 105.8 . .
C4 C5 H5B 105.8 . .
N2 C5 H5B 105.8 . .
H5A C5 H5B 106.2 . .
N2 C6 C7 117.0(11) . .
N2 C6 H6A 108.0 . .
C7 C6 H6A 108.0 . .
N2 C6 H6B 108.0 . .
C7 C6 H6B 108.0 . .
H6A C6 H6B 107.3 . .
O4 C7 O3 122.7(8) . .
O4 C7 C6 117.2(9) . .
O3 C7 C6 120.0(8) . .
N2 C8 C9 117.6(11) . .
N2 C8 H8A 107.9 . .
C9 C8 H8A 107.9 . .
N2 C8 H8B 107.9 . .
C9 C8 H8B 107.9 . .
H8A C8 H8B 107.2 . .
C8 C9 N1 115.6(10) . 2_556
C8 C9 H9A 108.4 . .
N1 C9 H9A 108.4 2_556 .
C8 C9 H9B 108.4 . .
N1 C9 H9B 108.4 2_556 .
H9A C9 H9B 107.4 . .
O6 C10 O5 128.8(7) . .
O6 C10 C11 116.8(7) . .
O5 C10 C11 114.3(7) . .
N3 C11 C10 113.1(6) . .
N3 C11 H11A 109.0 . .
C10 C11 H11A 109.0 . .
N3 C11 H11B 109.0 . .
C10 C11 H11B 109.0 . .
H11A C11 H11B 107.8 . .
C13 C12 N3 115.4(7) . .
C13 C12 H12A 108.4 . .
N3 C12 H12A 108.4 . .
C13 C12 H12B 108.4 . .
N3 C12 H12B 108.4 . .
H12A C12 H12B 107.5 . .
C12 C13 C14 116.7(7) . .
C12 C13 H13A 108.1 . .
C14 C13 H13A 108.1 . .
C12 C13 H13B 108.1 . .
C14 C13 H13B 108.1 . .
H13A C13 H13B 107.3 . .
N4 C14 C13 114.5(7) . .
N4 C14 H14A 108.6 . .
C13 C14 H14A 108.6 . .
N4 C14 H14B 108.6 . .
C13 C14 H14B 108.6 . .
H14A C14 H14B 107.6 . .
N4 C15 C16 115.4(7) . .
N4 C15 H15A 108.4 . .
C16 C15 H15A 108.4 . .
N4 C15 H15B 108.4 . .
C16 C15 H15B 108.4 . .
H15A C15 H15B 107.5 . .
O7 C16 O8 126.7(7) . .
O7 C16 C15 117.7(6) . .
O8 C16 C15 115.6(6) . .
N3 C17 C18 112.2(7) . 2_665
N3 C17 H17A 109.2 . .
C18 C17 H17A 109.2 2_665 .
N3 C17 H17B 109.2 . .
C18 C17 H17B 109.2 2_665 .
H17A C17 H17B 107.9 . .
N4 C18 C17 109.6(6) . 2_665
N4 C18 H18A 109.7 . .
C17 C18 H18A 109.7 2_665 .
N4 C18 H18B 109.7 . .
C17 C18 H18B 109.7 2_665 .
H18A C18 H18B 108.2 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Tb1 O1 2.305(6) .
Tb1 O4 2.310(6) 1_665
Tb1 O6 2.370(5) 2_666
Tb1 O7 2.415(5) 2_666
Tb1 O5 2.430(5) .
Tb1 O2 2.442(6) 2_566
Tb1 O8 2.446(5) 1_455
Tb1 O3 2.463(6) 2_556
O1 C1 1.244(10) .
O2 C1 1.240(10) .
O2 Tb1 2.442(6) 2_566
O3 C7 1.264(10) .
O3 Tb1 2.463(6) 2_556
O4 C7 1.252(10) .
O4 Tb1 2.310(6) 1_445
O5 C10 1.250(9) .
O6 C10 1.240(9) .
O6 Tb1 2.370(5) 2_666
O7 C16 1.254(9) .
O7 Tb1 2.415(5) 2_666
O8 C16 1.259(9) .
O8 Tb1 2.446(5) 1_655
O9 N5 1.133(17) .
O10 N5 1.04(3) .
O11 N5 1.14(3) .
N1 C3 1.446(16) .
N1 C2 1.469(12) .
N1 C9 1.528(13) 2_556
N2 C6 1.405(17) .
N2 C8 1.431(16) .
N2 C5 1.451(15) .
N3 C11 1.503(10) .
N3 C17 1.513(9) .
N3 C12 1.527(11) .
N4 C18 1.467(10) .
N4 C14 1.472(11) .
N4 C15 1.474(10) .
C1 C2 1.525(12) .
C2 H2A 0.9700 .
C2 H2B 0.9700 .
C3 C4 1.533(19) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 C5 1.31(2) .
C4 H4A 0.9700 .
C4 H4B 0.9700 .
C5 H5A 0.9700 .
C5 H5B 0.9700 .
C6 C7 1.500(16) .
C6 H6A 0.9700 .
C6 H6B 0.9700 .
C8 C9 1.462(18) .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 N1 1.528(13) 2_556
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 C11 1.519(10) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 C13 1.498(13) .
C12 H12A 0.9700 .
C12 H12B 0.9700 .
C13 C14 1.528(13) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
C15 C16 1.533(10) .
C15 H15A 0.9700 .
C15 H15B 0.9700 .
C17 C18 1.538(12) 2_665
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C18 C17 1.538(12) 2_665
C18 H18A 0.9700 .
C18 H18B 0.9700 .
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
O4 Tb1 O1 C1 89(11) 1_665 .
O6 Tb1 O1 C1 -73(11) 2_666 .
O7 Tb1 O1 C1 -102(11) 2_666 .
O5 Tb1 O1 C1 52(11) . .
O2 Tb1 O1 C1 -166(11) 2_566 .
O8 Tb1 O1 C1 127(11) 1_455 .
O3 Tb1 O1 C1 -22(11) 2_556 .
O1 Tb1 O5 C10 176.2(8) . .
O4 Tb1 O5 C10 17.1(7) 1_665 .
O6 Tb1 O5 C10 -43.4(8) 2_666 .
O7 Tb1 O5 C10 -141.0(7) 2_666 .
O2 Tb1 O5 C10 60.2(8) 2_566 .
O8 Tb1 O5 C10 99.1(8) 1_455 .
O3 Tb1 O5 C10 -108.4(8) 2_556 .
Tb1 O2 C1 O1 -5.7(10) 2_566 .
Tb1 O2 C1 C2 178.3(7) 2_566 .
Tb1 O1 C1 O2 172(10) . .
Tb1 O1 C1 C2 -12(11) . .
C3 N1 C2 C1 85.2(12) . .
C9 N1 C2 C1 -151.0(10) 2_556 .
O2 C1 C2 N1 -137.5(9) . .
O1 C1 C2 N1 46.1(13) . .
C2 N1 C3 C4 -65.8(14) . .
C9 N1 C3 C4 170.7(11) 2_556 .
N1 C3 C4 C5 -170.2(17) . .
C3 C4 C5 N2 43(3) . .
C6 N2 C5 C4 -134(2) . .
C8 N2 C5 C4 97(2) . .
C8 N2 C6 C7 -114.3(19) . .
C5 N2 C6 C7 123.2(18) . .
Tb1 O4 C7 O3 123.3(15) 1_445 .
Tb1 O4 C7 C6 -54(2) 1_445 .
Tb1 O3 C7 O4 -28.0(10) 2_556 .
Tb1 O3 C7 C6 149.0(14) 2_556 .
N2 C6 C7 O4 -161.3(14) . .
N2 C6 C7 O3 21(3) . .
C6 N2 C8 C9 73.8(16) . .
C5 N2 C8 C9 -163.0(15) . .
N2 C8 C9 N1 34(2) . 2_556
Tb1 O6 C10 O5 11.9(15) 2_666 .
Tb1 O6 C10 C11 -171.6(6) 2_666 .
Tb1 O5 C10 O6 28.8(13) . .
Tb1 O5 C10 C11 -147.8(6) . .
C17 N3 C11 C10 -167.5(7) . .
C12 N3 C11 C10 72.1(9) . .
O6 C10 C11 N3 12.1(11) . .
O5 C10 C11 N3 -170.8(7) . .
C11 N3 C12 C13 -177.6(7) . .
C17 N3 C12 C13 62.9(9) . .
N3 C12 C13 C14 67.9(10) . .
C18 N4 C14 C13 -73.1(9) . .
C15 N4 C14 C13 168.3(7) . .
C12 C13 C14 N4 -66.7(10) . .
C18 N4 C15 C16 173.3(7) . .
C14 N4 C15 C16 -66.3(9) . .
Tb1 O7 C16 O8 -21.5(14) 2_666 .
Tb1 O7 C16 C15 161.8(6) 2_666 .
Tb1 O8 C16 O7 53.1(11) 1_655 .
Tb1 O8 C16 C15 -130.1(7) 1_655 .
N4 C15 C16 O7 -30.5(11) . .
N4 C15 C16 O8 152.4(7) . .
C11 N3 C17 C18 65.5(9) . 2_665
C12 N3 C17 C18 -174.5(7) . 2_665
C14 N4 C18 C17 163.6(7) . 2_665
C15 N4 C18 C17 -77.1(8) . 2_665
