#------------------------------------------------------------------------------
#$Date: 2016-03-25 23:26:29 +0200 (Fri, 25 Mar 2016) $
#$Revision: 180039 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/33/7033392.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_7033392
loop_
_publ_author_name
'Zhang, Hui-Jie'
'Fan, Rui-Qing'
'Wang, Xin-Ming'
'Wang, Ping'
'Wang, Yu-Lei'
'Yang, Yu-Lin'
_publ_section_title
;
 Preparation, characterization, and properties of PMMA-doped polymer film
 materials: a study on the effect of terbium ions on luminescence and
 lifetime enhancement.
;
_journal_issue                   6
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2871
_journal_page_last               2879
_journal_paper_doi               10.1039/c4dt03348e
_journal_volume                  44
_journal_year                    2015
_chemical_formula_sum            'C10 H17 N4 O12 Tb3'
_chemical_formula_weight         862.04
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2014-11-26 deposited with the CCDC.
2014-12-10 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 96.40(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.187(3)
_cell_length_b                   10.817(2)
_cell_length_c                   12.567(3)
_cell_measurement_reflns_used    4071
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      3.03
_cell_volume                     1781.4(7)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_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  0.0534
_diffrn_reflns_av_sigmaI/netI    0.0470
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            17042
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.03
_exptl_absorpt_coefficient_mu    11.854
_exptl_absorpt_correction_T_max  0.2765
_exptl_absorpt_correction_T_min  0.1101
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    3.214
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1584
_exptl_crystal_preparation       Luminescent
_exptl_crystal_size_max          0.33
_exptl_crystal_size_mid          0.33
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.855
_refine_diff_density_min         -2.412
_refine_diff_density_rms         0.239
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     262
_refine_ls_number_reflns         4071
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.063
_refine_ls_R_factor_all          0.0415
_refine_ls_R_factor_gt           0.0324
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0153P)²+11.5985P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0662
_refine_ls_wR_factor_ref         0.0696
_reflns_number_gt                3317
_reflns_number_total             4071
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt03348e2.cif
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2935 2014-11-11 08:27:57Z andrius 

 Adding full bibliography for 7033392.cif.
;
_cod_original_cell_volume        1781.4(6)
_cod_original_sg_symbol_H-M      'P2(1)/c  '
_cod_database_code               7033392
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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
O1W O 0.1759(7) 0.6065(6) 0.1487(6) 0.061(2) Uani 1 1 d .
H1WA H 0.1182 0.6349 0.1229 0.092 Uiso 1 1 d R
H1WC H 0.2073 0.5788 0.0982 0.092 Uiso 1 1 d R
Tb1 Tb 0.43748(2) 0.07780(2) 0.61959(2) 0.00976(8) Uani 1 1 d .
Tb2 Tb 0.45141(2) -0.08622(2) 0.86673(2) 0.00965(8) Uani 1 1 d .
Tb3 Tb 0.44279(2) 0.25454(2) 0.36880(2) 0.00906(8) Uani 1 1 d .
O1 O 0.2791(4) 0.2329(4) 0.4216(4) 0.0248(12) Uani 1 1 d .
O2 O 0.2614(4) 0.1032(4) 0.5556(4) 0.0237(11) Uani 1 1 d .
O3 O 0.2830(4) -0.1419(4) 0.8828(4) 0.0276(12) Uani 1 1 d .
O4 O 0.2499(5) -0.3413(5) 0.9036(6) 0.0401(16) Uani 1 1 d .
O5 O 0.3514(4) 0.0780(3) 0.7755(3) 0.0112(9) Uani 1 1 d .
H5B H 0.3047 0.0810 0.8169 0.017 Uiso 1 1 d R
O6 O 0.5382(3) 0.2240(4) 0.5395(3) 0.0108(8) Uani 1 1 d .
H15 H 0.5580 0.2708 0.4916 0.016 Uiso 1 1 d R
O7 O 0.4192(4) 0.0701(3) 0.9893(3) 0.0122(9) Uani 1 1 d .
H7E H 0.3945 0.0034 1.0112 0.018 Uiso 1 1 d R
O8 O 0.5383(4) 0.0862(4) 0.7918(3) 0.0124(9) Uani 1 1 d .
H8B H 0.5943 0.1024 0.8296 0.019 Uiso 1 1 d R
O9 O 0.4170(4) -0.1321(3) 0.6759(3) 0.0115(9) Uani 1 1 d .
H9B H 0.4073 -0.2084 0.6619 0.017 Uiso 1 1 d R
O10 O 0.4114(4) 0.2945(4) 0.6872(3) 0.0131(9) Uani 1 1 d .
H14 H 0.4235 0.3495 0.7353 0.020 Uiso 1 1 d R
O11 O 0.4213(4) 0.0409(4) 0.4244(3) 0.0122(9) Uani 1 1 d .
H11A H 0.3640 0.0103 0.4002 0.018 Uiso 1 1 d R
N1 N 0.1491(5) 0.5873(5) 0.5310(5) 0.0204(12) Uani 1 1 d .
N2 N 0.1739(6) 0.3957(6) 0.5929(5) 0.0304(15) Uani 1 1 d .
N3 N 0.0811(5) 0.2878(5) 0.3907(5) 0.0216(13) Uani 1 1 d .
N4 N 0.0690(6) 0.4743(6) 0.3173(5) 0.0300(15) Uani 1 1 d .
C1 C 0.0982(6) 0.4116(6) 0.4058(5) 0.0210(14) Uani 1 1 d .
C2 C 0.0404(7) 0.2736(7) 0.2880(6) 0.0289(17) Uani 1 1 d .
H2B H 0.0219 0.1992 0.2541 0.035 Uiso 1 1 calc R
C3 C 0.0316(8) 0.3876(7) 0.2434(6) 0.035(2) Uani 1 1 d .
H3A H 0.0044 0.4045 0.1734 0.042 Uiso 1 1 calc R
C4 C 0.2033(7) 0.4796(8) 0.6729(6) 0.0338(19) Uani 1 1 d .
H4B H 0.2293 0.4588 0.7424 0.041 Uiso 1 1 calc R
C5 C 0.1890(7) 0.5962(7) 0.6360(6) 0.0285(17) Uani 1 1 d .
H5A H 0.2035 0.6687 0.6746 0.034 Uiso 1 1 calc R
C6 C 0.1417(6) 0.4629(6) 0.5074(5) 0.0218(15) Uani 1 1 d .
C7 C 0.1121(6) 0.1868(6) 0.4632(6) 0.0213(15) Uani 1 1 d .
H7B H 0.0826 0.1103 0.4337 0.026 Uiso 1 1 calc R
H7C H 0.0859 0.2012 0.5313 0.026 Uiso 1 1 calc R
C8 C 0.2269(5) 0.1736(5) 0.4815(5) 0.0138(13) Uani 1 1 d .
C9 C 0.1321(6) -0.1939(6) 0.9585(6) 0.0236(15) Uani 1 1 d .
H9A H 0.0798 -0.1735 0.9006 0.035 Uiso 1 1 calc R
H9C H 0.1081 -0.2635 0.9974 0.035 Uiso 1 1 calc R
C10 C 0.2301(7) -0.2304(7) 0.9118(6) 0.0263(16) 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
O6 Tb1 O5 134.04(13) . .
O6 Tb1 O11 76.72(14) . 3_656
O5 Tb1 O11 130.71(14) . 3_656
O6 Tb1 O2 110.59(16) . .
O5 Tb1 O2 75.00(16) . .
O11 Tb1 O2 137.85(16) 3_656 .
O6 Tb1 O9 147.74(14) . .
O5 Tb1 O9 71.20(13) . .
O11 Tb1 O9 71.02(14) 3_656 .
O2 Tb1 O9 94.05(16) . .
O6 Tb1 O8 94.42(14) . .
O5 Tb1 O8 61.66(15) . .
O11 Tb1 O8 82.04(14) 3_656 .
O2 Tb1 O8 135.74(15) . .
O9 Tb1 O8 80.82(14) . .
O6 Tb1 O11 71.06(14) . .
O5 Tb1 O11 145.52(16) . .
O11 Tb1 O11 70.42(18) 3_656 .
O2 Tb1 O11 73.21(16) . .
O9 Tb1 O11 98.02(13) . .
O8 Tb1 O11 151.01(15) . .
O6 Tb1 O10 68.07(13) . .
O5 Tb1 O10 68.03(13) . .
O11 Tb1 O10 135.89(15) 3_656 .
O2 Tb1 O10 80.98(16) . .
O9 Tb1 O10 138.83(13) . .
O8 Tb1 O10 75.26(14) . .
O11 Tb1 O10 118.90(13) . .
O6 Tb1 Tb3 94.35(10) . 4_566
O5 Tb1 Tb3 41.23(10) . 4_566
O11 Tb1 Tb3 122.20(11) 3_656 4_566
O2 Tb1 Tb3 99.12(12) . 4_566
O9 Tb1 Tb3 102.19(9) . 4_566
O8 Tb1 Tb3 41.23(10) . 4_566
O11 Tb1 Tb3 158.87(9) . 4_566
O10 Tb1 Tb3 39.99(9) . 4_566
O6 Tb1 Tb2 34.05(9) . 2_656
O5 Tb1 Tb2 100.02(9) . 2_656
O11 Tb1 Tb2 102.28(10) 3_656 2_656
O2 Tb1 Tb2 104.68(12) . 2_656
O9 Tb1 Tb2 156.67(11) . 2_656
O8 Tb1 Tb2 76.07(9) . 2_656
O11 Tb1 Tb2 100.60(9) . 2_656
O10 Tb1 Tb2 35.85(10) . 2_656
Tb3 Tb1 Tb2 61.640(14) 4_566 2_656
O6 Tb1 Tb3 112.74(10) . 3_656
O5 Tb1 Tb3 101.42(9) . 3_656
O11 Tb1 Tb3 36.02(10) 3_656 3_656
O2 Tb1 Tb3 119.36(12) . 3_656
O9 Tb1 Tb3 35.01(10) . 3_656
O8 Tb1 Tb3 79.74(9) . 3_656
O11 Tb1 Tb3 83.04(9) . 3_656
O10 Tb1 Tb3 154.94(11) . 3_656
Tb3 Tb1 Tb3 117.322(16) 4_566 3_656
Tb2 Tb1 Tb3 134.584(16) 2_656 3_656
O6 Tb1 Tb1 70.11(10) . 3_656
O5 Tb1 Tb1 154.89(9) . 3_656
O11 Tb1 Tb1 35.98(11) 3_656 3_656
O2 Tb1 Tb1 105.36(12) . 3_656
O9 Tb1 Tb1 83.79(9) . 3_656
O8 Tb1 Tb1 117.54(10) . 3_656
O11 Tb1 Tb1 34.44(10) . 3_656
O10 Tb1 Tb1 137.08(9) . 3_656
Tb3 Tb1 Tb1 154.361(17) 4_566 3_656
Tb2 Tb1 Tb1 104.022(17) 2_656 3_656
Tb3 Tb1 Tb1 55.871(11) 3_656 3_656
O3 Tb2 O7 124.70(17) . 3_657
O3 Tb2 O7 83.45(18) . .
O7 Tb2 O7 67.18(18) 3_657 .
O3 Tb2 O6 74.67(17) . 2_646
O7 Tb2 O6 71.57(14) 3_657 2_646
O7 Tb2 O6 107.57(13) . 2_646
O3 Tb2 O10 130.24(17) . 2_646
O7 Tb2 O10 75.53(15) 3_657 2_646
O7 Tb2 O10 140.59(17) . 2_646
O6 Tb2 O10 70.59(14) 2_646 2_646
O3 Tb2 O5 75.93(16) . .
O7 Tb2 O5 128.29(14) 3_657 .
O7 Tb2 O5 69.82(14) . .
O6 Tb2 O5 150.58(16) 2_646 .
O10 Tb2 O5 130.77(13) 2_646 .
O3 Tb2 O8 136.53(16) . .
O7 Tb2 O8 84.73(15) 3_657 .
O7 Tb2 O8 80.21(13) . .
O6 Tb2 O8 148.77(16) 2_646 .
O10 Tb2 O8 84.23(14) 2_646 .
O5 Tb2 O8 60.65(15) . .
O3 Tb2 O9 87.59(18) . .
O7 Tb2 O9 144.15(15) 3_657 .
O7 Tb2 O9 139.48(14) . .
O6 Tb2 O9 107.90(13) 2_646 .
O10 Tb2 O9 70.98(15) 2_646 .
O5 Tb2 O9 69.67(13) . .
O8 Tb2 O9 79.62(14) . .
O3 Tb2 Tb3 103.07(12) . 4_566
O7 Tb2 Tb3 86.63(9) 3_657 4_566
O7 Tb2 Tb3 43.14(9) . 4_566
O6 Tb2 Tb3 149.84(10) 2_646 4_566
O10 Tb2 Tb3 124.70(10) 2_646 4_566
O5 Tb2 Tb3 41.81(10) . 4_566
O8 Tb2 Tb3 41.69(9) . 4_566
O9 Tb2 Tb3 101.99(9) . 4_566
O3 Tb2 Tb3 93.82(13) . 2_646
O7 Tb2 Tb3 37.77(10) 3_657 2_646
O7 Tb2 Tb3 80.32(10) . 2_646
O6 Tb2 Tb3 35.75(11) 2_646 2_646
O10 Tb2 Tb3 77.91(10) 2_646 2_646
O5 Tb2 Tb3 149.22(9) . 2_646
O8 Tb2 Tb3 122.29(11) . 2_646
O9 Tb2 Tb3 139.83(9) . 2_646
Tb3 Tb2 Tb3 116.621(11) 4_566 2_646
O3 Tb2 Tb3 111.92(14) . 3_656
O7 Tb2 Tb3 109.35(10) 3_657 3_656
O7 Tb2 Tb3 160.87(10) . 3_656
O6 Tb2 Tb3 88.10(10) 2_646 3_656
O10 Tb2 Tb3 34.54(11) 2_646 3_656
O5 Tb2 Tb3 101.94(9) . 3_656
O8 Tb2 Tb3 80.73(9) . 3_656
O9 Tb2 Tb3 36.45(10) . 3_656
Tb3 Tb2 Tb3 119.386(11) 4_566 3_656
Tb3 Tb2 Tb3 108.792(16) 2_646 3_656
O3 Tb2 Tb1 96.43(12) . 2_646
O7 Tb2 Tb1 78.41(9) 3_657 2_646
O7 Tb2 Tb1 136.96(10) . 2_646
O6 Tb2 Tb1 34.02(10) 2_646 2_646
O10 Tb2 Tb1 38.47(10) 2_646 2_646
O5 Tb2 Tb1 151.96(9) . 2_646
O8 Tb2 Tb1 122.58(10) . 2_646
O9 Tb2 Tb1 83.23(9) . 2_646
Tb3 Tb2 Tb1 159.956(13) 4_566 2_646
Tb3 Tb2 Tb1 56.692(11) 2_646 2_646
Tb3 Tb2 Tb1 55.330(10) 3_656 2_646
O10 Tb3 O1 100.71(19) 4_565 .
O10 Tb3 O6 149.98(15) 4_565 .
O1 Tb3 O6 98.16(18) . .
O10 Tb3 O9 72.68(15) 4_565 3_656
O1 Tb3 O9 140.65(15) . 3_656
O6 Tb3 O9 77.90(14) . 3_656
O10 Tb3 O8 79.22(15) 4_565 4_565
O1 Tb3 O8 136.74(15) . 4_565
O6 Tb3 O8 102.35(15) . 4_565
O9 Tb3 O8 81.28(14) 3_656 4_565
O10 Tb3 O5 70.75(14) 4_565 4_565
O1 Tb3 O5 77.62(16) . 4_565
O6 Tb3 O5 136.66(14) . 4_565
O9 Tb3 O5 131.35(13) 3_656 4_565
O8 Tb3 O5 61.34(15) 4_565 4_565
O10 Tb3 O11 92.94(14) 4_565 .
O1 Tb3 O11 71.58(15) . .
O6 Tb3 O11 71.19(15) . .
O9 Tb3 O11 70.14(14) 3_656 .
O8 Tb3 O11 151.40(14) 4_565 .
O5 Tb3 O11 141.69(16) 4_565 .
O10 Tb3 O7 138.90(14) 4_565 4_565
O1 Tb3 O7 73.71(17) . 4_565
O6 Tb3 O7 69.18(14) . 4_565
O9 Tb3 O7 136.31(16) 3_656 4_565
O8 Tb3 O7 78.67(13) 4_565 4_565
O5 Tb3 O7 68.28(14) 4_565 4_565
O11 Tb3 O7 121.70(13) . 4_565
O10 Tb3 Tb2 102.85(10) 4_565 4_565
O1 Tb3 Tb2 97.63(11) . 4_565
O6 Tb3 Tb2 97.52(10) . 4_565
O9 Tb3 Tb2 121.72(10) 3_656 4_565
O8 Tb3 Tb2 42.39(9) 4_565 4_565
O5 Tb3 Tb2 42.17(10) 4_565 4_565
O11 Tb3 Tb2 162.44(9) . 4_565
O7 Tb3 Tb2 40.77(9) 4_565 4_565
O10 Tb3 Tb1 44.16(10) 4_565 4_565
O1 Tb3 Tb1 111.50(13) . 4_565
O6 Tb3 Tb1 143.73(10) . 4_565
O9 Tb3 Tb1 90.88(10) 3_656 4_565
O8 Tb3 Tb1 41.48(11) 4_565 4_565
O5 Tb3 Tb1 40.51(9) 4_565 4_565
O11 Tb3 Tb1 137.07(10) . 4_565
O7 Tb3 Tb1 98.88(9) 4_565 4_565
Tb2 Tb3 Tb1 59.310(10) 4_565 4_565
O10 Tb3 Tb2 161.79(11) 4_565 2_656
O1 Tb3 Tb2 93.25(14) . 2_656
O6 Tb3 Tb2 35.36(10) . 2_656
O9 Tb3 Tb2 103.55(11) 3_656 2_656
O8 Tb3 Tb2 82.61(10) 4_565 2_656
O5 Tb3 Tb2 101.34(10) 4_565 2_656
O11 Tb3 Tb2 102.59(10) . 2_656
O7 Tb3 Tb2 35.68(11) 4_565 2_656
Tb2 Tb3 Tb2 63.379(11) 4_565 2_656
Tb1 Tb3 Tb2 119.480(17) 4_565 2_656
O10 Tb3 Tb2 35.34(11) 4_565 3_656
O1 Tb3 Tb2 126.39(13) . 3_656
O6 Tb3 Tb2 115.10(10) . 3_656
O9 Tb3 Tb2 37.34(11) 3_656 3_656
O8 Tb3 Tb2 77.23(9) 4_565 3_656
O5 Tb3 Tb2 100.68(9) 4_565 3_656
O11 Tb3 Tb2 80.60(9) . 3_656
O7 Tb3 Tb2 155.86(10) 4_565 3_656
Tb2 Tb3 Tb2 116.793(11) 4_565 3_656
Tb1 Tb3 Tb2 63.030(16) 4_565 3_656
Tb2 Tb3 Tb2 137.913(16) 2_656 3_656
C8 O1 Tb3 143.9(5) . .
C8 O2 Tb1 125.5(4) . .
C10 O3 Tb2 141.6(5) . .
Tb1 O5 Tb3 98.26(15) . 4_566
Tb1 O5 Tb2 96.02(15) . .
Tb3 O5 Tb2 96.03(16) 4_566 .
Tb1 O6 Tb2 111.93(16) . 2_656
Tb1 O6 Tb3 102.17(17) . .
Tb2 O6 Tb3 108.89(16) 2_656 .
Tb2 O7 Tb2 112.82(18) 3_657 .
Tb2 O7 Tb3 106.55(17) 3_657 4_566
Tb2 O7 Tb3 96.10(14) . 4_566
Tb3 O8 Tb1 97.30(16) 4_566 .
Tb3 O8 Tb2 95.91(14) 4_566 .
Tb1 O8 Tb2 94.69(15) . .
Tb3 O9 Tb1 109.81(16) 3_656 .
Tb3 O9 Tb2 106.21(18) 3_656 .
Tb1 O9 Tb2 94.72(14) . .
Tb3 O10 Tb2 110.12(19) 4_566 2_656
Tb3 O10 Tb1 95.85(14) 4_566 .
Tb2 O10 Tb1 105.68(16) 2_656 .
Tb1 O11 Tb3 109.02(17) 3_656 .
Tb1 O11 Tb1 109.58(18) 3_656 .
Tb3 O11 Tb1 97.57(14) . .
C5 N1 C6 106.6(6) . .
C5 N1 C9 123.9(6) . 4_565
C6 N1 C9 129.0(6) . 4_565
C6 N2 C4 105.6(6) . .
C2 N3 C1 106.6(6) . .
C2 N3 C7 124.6(6) . .
C1 N3 C7 128.3(6) . .
C1 N4 C3 105.5(6) . .
N4 C1 N3 110.9(6) . .
N4 C1 C6 126.4(6) . .
N3 C1 C6 122.7(6) . .
N3 C2 C3 107.3(7) . .
C2 C3 N4 109.6(7) . .
C5 C4 N2 110.3(7) . .
C4 C5 N1 106.8(7) . .
N2 C6 N1 110.6(7) . .
N2 C6 C1 124.2(6) . .
N1 C6 C1 125.0(6) . .
N3 C7 C8 111.9(5) . .
O2 C8 O1 125.5(7) . .
O2 C8 C7 116.5(5) . .
O1 C8 C7 118.0(6) . .
N1 C9 C10 111.3(6) 4_566 .
O4 C10 O3 125.8(8) . .
O4 C10 C9 118.6(6) . .
O3 C10 C9 115.6(6) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Tb1 O6 2.361(4) .
Tb1 O5 2.371(4) .
Tb1 O11 2.378(4) 3_656
Tb1 O2 2.387(6) .
Tb1 O9 2.402(4) .
Tb1 O8 2.412(5) .
Tb1 O11 2.470(4) .
Tb1 O10 2.530(4) .
Tb1 Tb3 3.6129(7) 4_566
Tb1 Tb2 3.9152(8) 2_656
Tb1 Tb3 3.9225(8) 3_656
Tb1 Tb1 3.9613(10) 3_656
Tb2 O3 2.332(5) .
Tb2 O7 2.351(5) 3_657
Tb2 O7 2.357(4) .
Tb2 O6 2.363(4) 2_646
Tb2 O10 2.382(4) 2_646
Tb2 O5 2.423(4) .
Tb2 O8 2.433(4) .
Tb2 O9 2.442(4) .
Tb2 Tb3 3.5898(8) 4_566
Tb2 Tb3 3.8634(9) 2_646
Tb2 Tb3 3.8657(8) 3_656
Tb2 Tb1 3.9152(8) 2_646
Tb3 O10 2.334(4) 4_565
Tb3 O1 2.340(5) .
Tb3 O6 2.386(4) .
Tb3 O9 2.392(4) 3_656
Tb3 O8 2.400(4) 4_565
Tb3 O5 2.406(4) 4_565
Tb3 O11 2.440(4) .
Tb3 O7 2.468(4) 4_565
Tb3 Tb2 3.5898(8) 4_565
Tb3 Tb1 3.6129(7) 4_565
Tb3 Tb2 3.8635(9) 2_656
Tb3 Tb2 3.8657(8) 3_656
O1 C8 1.252(8) .
O2 C8 1.250(8) .
O3 C10 1.262(9) .
O4 C10 1.235(9) .
O5 Tb3 2.406(4) 4_566
O6 Tb2 2.363(4) 2_656
O7 Tb2 2.351(5) 3_657
O7 Tb3 2.468(4) 4_566
O8 Tb3 2.400(4) 4_566
O9 Tb3 2.392(4) 3_656
O10 Tb3 2.334(4) 4_566
O10 Tb2 2.382(4) 2_656
O11 Tb1 2.378(4) 3_656
N1 C5 1.369(10) .
N1 C6 1.378(9) .
N1 C9 1.471(9) 4_565
N2 C6 1.326(9) .
N2 C4 1.378(10) .
N3 C2 1.351(10) .
N3 C1 1.368(9) .
N3 C7 1.451(9) .
N4 C1 1.324(9) .
N4 C3 1.372(10) .
C1 C6 1.450(10) .
C2 C3 1.354(11) .
C4 C5 1.350(11) .
C7 C8 1.512(10) .
C9 N1 1.471(9) 4_566
C9 C10 1.529(11) .
