# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2016

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_1-Eu
_database_code_depnum_ccdc_archive 'CCDC 1439280'
_audit_update_record             
;
2016-02-10 deposited with the CCDC.
2016-02-15 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C42 H24 Co Eu N6 O17, 8(O)'
_chemical_formula_sum            'C42 H24 Co Eu N6 O25'
_chemical_formula_weight         1223.56

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'
Co Co 0.3494 0.9721 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 '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'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 21/n'
_symmetry_space_group_name_Hall  '-P 2yn'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   20.9010(8)
_cell_length_b                   9.7122(4)
_cell_length_c                   25.5412(16)
_cell_angle_alpha                90.00
_cell_angle_beta                 99.292(5)
_cell_angle_gamma                90.00
_cell_volume                     5116.7(4)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    8338
_cell_measurement_theta_min      2.8989
_cell_measurement_theta_max      29.2117

_exptl_crystal_description       block
_exptl_crystal_colour            green
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.10
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.588
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2432
_exptl_absorpt_coefficient_mu    1.629
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6862
_exptl_absorpt_correction_T_max  0.8541
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'X-calibur S oxford'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            43018
_diffrn_reflns_av_R_equivalents  0.0546
_diffrn_reflns_av_sigmaI/netI    0.0498
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         2.90
_diffrn_reflns_theta_max         26.00
_reflns_number_total             10036
_reflns_number_gt                8718
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'X-calibur S oxford'
_computing_cell_refinement       'X-calibur S SAINT'
_computing_data_reduction        'X-calibur S SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Oxford SHELXTL'
_computing_publication_material  'Oxford SHELXTL'

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0525P)²+8.3254P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         10036
_refine_ls_number_parameters     701
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0537
_refine_ls_R_factor_gt           0.0442
_refine_ls_wR_factor_ref         0.1142
_refine_ls_wR_factor_gt          0.1093
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_restrained_S_all      1.063
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
C1 C 0.5680(2) -0.1009(5) 0.30449(18) 0.0266(10) Uani 1 1 d . . .
C2 C 0.6157(2) -0.0121(4) 0.33878(18) 0.0262(10) Uani 1 1 d . . .
C3 C 0.6383(3) -0.0518(5) 0.3898(2) 0.0402(13) Uani 1 1 d . . .
H3 H 0.6225 -0.1340 0.4033 0.048 Uiso 1 1 calc R . .
C4 C 0.6837(3) 0.0263(5) 0.4218(2) 0.0415(14) Uani 1 1 d . . .
H4 H 0.6983 -0.0014 0.4574 0.050 Uiso 1 1 calc R . .
C5 C 0.7083(2) 0.1446(4) 0.40244(18) 0.0231(9) Uani 1 1 d . . .
C6 C 0.6854(3) 0.1849(5) 0.3515(2) 0.0385(13) Uani 1 1 d . . .
H6 H 0.7010 0.2674 0.3381 0.046 Uiso 1 1 calc R . .
C7 C 0.6396(3) 0.1057(5) 0.3195(2) 0.0409(13) Uani 1 1 d . . .
H7 H 0.6246 0.1333 0.2839 0.049 Uiso 1 1 calc R . .
C8 C 0.8177(2) 0.1749(5) 0.4392(2) 0.0312(11) Uani 1 1 d . . .
C9 C 0.8642(2) 0.2641(4) 0.4745(2) 0.0265(10) Uani 1 1 d . . .
C10 C 0.9309(2) 0.2485(5) 0.4866(2) 0.0373(12) Uani 1 1 d . . .
H10 H 0.9523 0.1752 0.4718 0.045 Uiso 1 1 calc R . .
C11 C 0.9654(2) 0.3425(5) 0.5206(2) 0.0370(12) Uani 1 1 d . . .
H11 H 1.0110 0.3333 0.5298 0.044 Uiso 1 1 calc R . .
C12 C 0.9341(2) 0.4497(5) 0.5414(2) 0.0315(11) Uani 1 1 d . . .
H12 H 0.9577 0.5141 0.5650 0.038 Uiso 1 1 calc R . .
C13 C 0.86757(19) 0.4613(4) 0.52702(17) 0.0213(9) Uani 1 1 d . . .
C14 C 0.8239(2) 0.5632(4) 0.54651(17) 0.0227(9) Uani 1 1 d . . .
C15 C 0.7135(2) 0.6279(4) 0.54160(17) 0.0207(9) Uani 1 1 d . . .
C16 C 0.7027(2) 0.6228(5) 0.59392(19) 0.0308(11) Uani 1 1 d . . .
H16 H 0.7278 0.5631 0.6186 0.037 Uiso 1 1 calc R . .
C17 C 0.6558(2) 0.7040(5) 0.6097(2) 0.0333(11) Uani 1 1 d . . .
H17 H 0.6499 0.7021 0.6458 0.040 Uiso 1 1 calc R . .
C18 C 0.6171(2) 0.7885(4) 0.57464(19) 0.0257(10) Uani 1 1 d . . .
C19 C 0.6262(2) 0.7898(5) 0.5219(2) 0.0294(10) Uani 1 1 d . . .
H19 H 0.5994 0.8456 0.4968 0.035 Uiso 1 1 calc R . .
C20 C 0.6743(2) 0.7103(4) 0.50585(19) 0.0271(10) Uani 1 1 d . . .
H20 H 0.6805 0.7123 0.4698 0.033 Uiso 1 1 calc R . .
C21 C 0.5701(2) 0.8860(5) 0.5927(2) 0.0335(11) Uani 1 1 d . . .
C22 C 0.8879(2) -0.0520(4) 0.67787(17) 0.0225(9) Uani 1 1 d . . .
C23 C 0.8411(2) 0.0358(4) 0.64251(17) 0.0228(9) Uani 1 1 d . . .
C24 C 0.7898(2) -0.0243(4) 0.60924(19) 0.0310(11) Uani 1 1 d . . .
H24 H 0.7827 -0.1207 0.6106 0.037 Uiso 1 1 calc R . .
C25 C 0.7490(2) 0.0574(5) 0.5740(2) 0.0325(11) Uani 1 1 d . . .
H25 H 0.7146 0.0159 0.5505 0.039 Uiso 1 1 calc R . .
C26 C 0.7577(2) 0.1994(4) 0.57255(17) 0.0215(9) Uani 1 1 d . . .
C27 C 0.8075(2) 0.2585(4) 0.60788(19) 0.0264(10) Uani 1 1 d . . .
H27 H 0.8128 0.3556 0.6086 0.032 Uiso 1 1 calc R . .
C28 C 0.8492(2) 0.1768(5) 0.64203(18) 0.0274(10) Uani 1 1 d . . .
H28 H 0.8839 0.2180 0.6654 0.033 Uiso 1 1 calc R . .
C29 C 0.6544(2) 0.2818(5) 0.53491(19) 0.0266(10) Uani 1 1 d . . .
C30 C 0.61779(19) 0.3518(4) 0.48732(17) 0.0209(9) Uani 1 1 d . . .
C31 C 0.5512(2) 0.3634(5) 0.4737(2) 0.0313(11) Uani 1 1 d . . .
H31 H 0.5229 0.3245 0.4954 0.038 Uiso 1 1 calc R . .
C32 C 0.5270(2) 0.4332(5) 0.4278(2) 0.0345(12) Uani 1 1 d . . .
H32 H 0.4815 0.4435 0.4178 0.041 Uiso 1 1 calc R . .
C33 C 0.5680(2) 0.4883(5) 0.39614(18) 0.0282(10) Uani 1 1 d . . .
H33 H 0.5513 0.5355 0.3643 0.034 Uiso 1 1 calc R . .
C34 C 0.6339(2) 0.4733(4) 0.41181(17) 0.0216(9) Uani 1 1 d . . .
C35 C 0.6875(2) 0.5298(4) 0.38569(17) 0.0214(9) Uani 1 1 d . . .
C36 C 0.8011(2) 0.5614(4) 0.39634(17) 0.0213(9) Uani 1 1 d . . .
C37 C 0.8179(2) 0.6970(5) 0.4085(2) 0.0305(11) Uani 1 1 d . . .
H37 H 0.7922 0.7504 0.4284 0.037 Uiso 1 1 calc R . .
C38 C 0.8712(2) 0.7552(4) 0.3921(2) 0.0318(11) Uani 1 1 d . . .
H38 H 0.8821 0.8485 0.4005 0.038 Uiso 1 1 calc R . .
C39 C 0.9092(2) 0.6783(4) 0.36329(19) 0.0247(9) Uani 1 1 d . . .
C40 C 0.8935(2) 0.5419(5) 0.3516(2) 0.0327(11) Uani 1 1 d . . .
H40 H 0.9194 0.4884 0.3319 0.039 Uiso 1 1 calc R . .
C41 C 0.8397(2) 0.4837(5) 0.3686(2) 0.0315(11) Uani 1 1 d . . .
H41 H 0.8294 0.3897 0.3612 0.038 Uiso 1 1 calc R . .
C42 C 0.9659(2) 0.7403(5) 0.3431(2) 0.0303(11) Uani 1 1 d . . .
N1 N 0.75737(17) 0.2207(3) 0.43542(15) 0.0225(8) Uani 1 1 d . . .
N2 N 0.83514(15) 0.3683(3) 0.49446(14) 0.0189(7) Uani 1 1 d . . .
N3 N 0.76218(15) 0.5460(3) 0.52404(14) 0.0198(7) Uani 1 1 d . . .
N4 N 0.74532(15) 0.5027(3) 0.41344(14) 0.0187(7) Uani 1 1 d . . .
N5 N 0.65654(15) 0.4052(3) 0.45650(13) 0.0180(7) Uani 1 1 d . . .
N6 N 0.71775(17) 0.2799(3) 0.53365(15) 0.0210(8) Uani 1 1 d . . .
O1 O 0.67564(15) 0.5957(4) 0.34342(13) 0.0347(8) Uani 1 1 d . . .
O2 O 0.62614(16) 0.2344(4) 0.57056(15) 0.0428(10) Uani 1 1 d . . .
O1W O 0.94217(16) -0.0727(4) 0.80233(13) 0.0379(8) Uani 1 1 d . . .
O3 O 0.83723(18) 0.0730(4) 0.41719(18) 0.0595(13) Uani 1 1 d . . .
O2W O 0.91012(18) -0.3750(4) 0.78419(16) 0.0522(11) Uani 1 1 d . . .
O4 O 0.84572(15) 0.6502(3) 0.58105(14) 0.0365(8) Uani 1 1 d . . .
O3W O 0.9365(2) -0.4146(4) 0.67602(16) 0.0560(12) Uani 1 1 d . . .
O5 O 0.54077(15) -0.1996(3) 0.32464(12) 0.0283(7) Uani 1 1 d . . .
O4W O 1.0347(2) -0.2174(4) 0.66020(15) 0.0480(10) Uani 1 1 d . . .
O6 O 0.55551(19) -0.0784(4) 0.25554(14) 0.0477(10) Uani 1 1 d . . .
O5W O 1.07423(16) -0.0784(4) 0.76079(14) 0.0409(9) Uani 1 1 d . . .
O7 O 0.53304(19) 0.9476(4) 0.55383(15) 0.0504(10) Uani 1 1 d . . .
H7A H 0.5151 1.0157 0.5656 0.076 Uiso 1 1 calc R . .
O6W O 0.9427(2) 0.8282(5) 0.56978(19) 0.0376(15) Uani 0.727(8) 1 d P A 1
O8 O 0.5675(2) 0.9060(4) 0.63944(15) 0.0508(10) Uani 1 1 d . . .
O7W O 0.9466(3) 0.2102(5) 0.7803(2) 0.095(2) Uani 1 1 d . . .
O9 O 0.87098(15) -0.1686(3) 0.69235(14) 0.0333(8) Uani 1 1 d . . .
O8W O 0.6719(2) 0.3440(7) 0.6700(2) 0.0933(18) Uani 1 1 d . . .
O10 O 0.94525(13) -0.0106(3) 0.69200(13) 0.0274(7) Uani 1 1 d . . .
O9W O 0.7409(4) 0.7152(10) 0.2661(3) 0.075(3) Uani 0.727(8) 1 d P A 1
O11 O 0.97205(18) 0.8725(3) 0.35314(19) 0.0498(11) Uani 1 1 d . . .
H11A H 1.0067 0.9012 0.3443 0.075 Uiso 1 1 calc R . .
O10W O 0.6545(3) 0.6140(10) 0.1833(3) 0.078(2) Uani 0.727(8) 1 d P A 1
O12 O 1.00244(16) 0.6759(4) 0.32036(17) 0.0462(10) Uani 1 1 d . . .
O11W O 0.7448(6) 0.2499(11) 0.7667(5) 0.206(5) Uiso 1 1 d . . .
O12W O 0.50005(16) 1.1920(4) 0.58043(14) 0.0364(8) Uani 1 1 d . . .
Co1 Co 0.74577(2) 0.38703(5) 0.47614(2) 0.01520(13) Uani 1 1 d . . .
Eu1 Eu 0.980320(11) -0.23041(2) 0.738784(9) 0.02287(8) Uani 1 1 d . . .
O13W O 0.8000(6) 0.481(2) 0.7304(6) 0.353(10) Uani 1 1 d . . .
O6W1 O 0.9237(6) 0.9280(13) 0.5386(5) 0.040(4) Uani 0.273(8) 1 d P A 2
O14 O 0.6787(9) 0.515(2) 0.2008(7) 0.064(6) Uani 0.273(8) 1 d P A 2
O9W1 O 0.7458(13) 0.825(3) 0.2697(8) 0.096(8) Uani 0.273(8) 1 d P A 2


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
C1 O6 1.254(5) . ?
C1 O5 1.266(5) . ?
C1 C2 1.490(6) . ?
C1 Eu1 2.805(4) 4 ?
C2 C3 1.368(6) . ?
C2 C7 1.372(6) . ?
C3 C4 1.375(6) . ?
C3 H3 0.9500 . ?
C4 C5 1.382(6) . ?
C4 H4 0.9500 . ?
C5 C6 1.368(7) . ?
C5 N1 1.425(5) . ?
C6 C7 1.388(6) . ?
C6 H6 0.9500 . ?
C7 H7 0.9500 . ?
C8 O3 1.239(6) . ?
C8 N1 1.327(6) . ?
C8 C9 1.492(6) . ?
C9 N2 1.324(5) . ?
C9 C10 1.386(7) . ?
C10 C11 1.380(7) . ?
C10 H10 0.9500 . ?
C11 C12 1.381(7) . ?
C11 H11 0.9500 . ?
C12 C13 1.383(6) . ?
C12 H12 0.9500 . ?
C13 N2 1.336(5) . ?
C13 C14 1.485(6) . ?
C14 O4 1.253(5) . ?
C14 N3 1.336(5) . ?
C15 C20 1.379(6) . ?
C15 C16 1.391(6) . ?
C15 N3 1.420(5) . ?
C16 C17 1.369(6) . ?
C16 H16 0.9500 . ?
C17 C18 1.378(7) . ?
C17 H17 0.9500 . ?
C18 C19 1.391(7) . ?
C18 C21 1.490(6) . ?
C19 C20 1.381(6) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C21 O8 1.219(6) . ?
C21 O7 1.302(6) . ?
C22 O9 1.259(5) . ?
C22 O10 1.260(5) . ?
C22 C23 1.488(6) . ?
C22 Eu1 2.861(4) . ?
C23 C28 1.379(6) . ?
C23 C24 1.385(6) . ?
C24 C25 1.385(6) . ?
C24 H24 0.9500 . ?
C25 C26 1.392(6) . ?
C25 H25 0.9500 . ?
C26 C27 1.387(6) . ?
C26 N6 1.424(5) . ?
C27 C28 1.381(6) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 O2 1.250(6) . ?
C29 N6 1.330(6) . ?
C29 C30 1.491(6) . ?
C30 N5 1.323(5) . ?
C30 C31 1.385(6) . ?
C31 C32 1.379(6) . ?
C31 H31 0.9500 . ?
C32 C33 1.377(6) . ?
C32 H32 0.9500 . ?
C33 C34 1.378(6) . ?
C33 H33 0.9500 . ?
C34 N5 1.338(5) . ?
C34 C35 1.498(6) . ?
C35 O1 1.245(5) . ?
C35 N4 1.324(5) . ?
C36 C41 1.380(6) . ?
C36 C37 1.386(6) . ?
C36 N4 1.428(5) . ?
C37 C38 1.375(7) . ?
C37 H37 0.9500 . ?
C38 C39 1.385(7) . ?
C38 H38 0.9500 . ?
C39 C40 1.385(6) . ?
C39 C42 1.495(6) . ?
C40 C41 1.390(6) . ?
C40 H40 0.9500 . ?
C41 H41 0.9500 . ?
C42 O12 1.206(6) . ?
C42 O11 1.312(5) . ?
N1 Co1 1.957(3) . ?
N2 Co1 1.860(3) . ?
N3 Co1 1.966(3) . ?
N4 Co1 1.955(3) . ?
N5 Co1 1.860(3) . ?
N6 Co1 1.965(4) . ?
O1W Eu1 2.457(3) . ?
O2W Eu1 2.454(4) . ?
O3W Eu1 2.477(4) . ?
O5 Eu1 2.444(3) 4 ?
O4W Eu1 2.464(4) . ?
O6 Eu1 2.426(3) 4 ?
O5W Eu1 2.448(3) . ?
O7 H7A 0.8400 . ?
O9 Eu1 2.473(3) . ?
O10 Eu1 2.498(3) . ?
O11 H11A 0.8400 . ?
Eu1 O6 2.426(3) 4_656 ?
Eu1 O5 2.444(3) 4_656 ?
Eu1 C1 2.805(4) 4_656 ?

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
O6 C1 O5 120.1(4) . . ?
O6 C1 C2 119.8(4) . . ?
O5 C1 C2 120.1(4) . . ?
O6 C1 Eu1 59.6(2) . 4 ?
O5 C1 Eu1 60.5(2) . 4 ?
C2 C1 Eu1 178.8(3) . 4 ?
C3 C2 C7 119.2(4) . . ?
C3 C2 C1 119.5(4) . . ?
C7 C2 C1 121.3(4) . . ?
C2 C3 C4 120.6(5) . . ?
C2 C3 H3 119.7 . . ?
C4 C3 H3 119.7 . . ?
C3 C4 C5 120.5(4) . . ?
C3 C4 H4 119.8 . . ?
C5 C4 H4 119.8 . . ?
C6 C5 C4 119.0(4) . . ?
C6 C5 N1 121.4(4) . . ?
C4 C5 N1 119.6(4) . . ?
C5 C6 C7 120.3(4) . . ?
C5 C6 H6 119.9 . . ?
C7 C6 H6 119.9 . . ?
C2 C7 C6 120.4(5) . . ?
C2 C7 H7 119.8 . . ?
C6 C7 H7 119.8 . . ?
O3 C8 N1 127.9(4) . . ?
O3 C8 C9 120.5(4) . . ?
N1 C8 C9 111.6(4) . . ?
N2 C9 C10 120.4(4) . . ?
N2 C9 C8 112.5(4) . . ?
C10 C9 C8 127.2(4) . . ?
C11 C10 C9 118.1(5) . . ?
C11 C10 H10 120.9 . . ?
C9 C10 H10 120.9 . . ?
C10 C11 C12 120.6(4) . . ?
C10 C11 H11 119.7 . . ?
C12 C11 H11 119.7 . . ?
C11 C12 C13 118.5(4) . . ?
C11 C12 H12 120.7 . . ?
C13 C12 H12 120.7 . . ?
N2 C13 C12 119.8(4) . . ?
N2 C13 C14 112.5(3) . . ?
C12 C13 C14 127.6(4) . . ?
O4 C14 N3 127.1(4) . . ?
O4 C14 C13 120.8(4) . . ?
N3 C14 C13 112.1(4) . . ?
C20 C15 C16 119.0(4) . . ?
C20 C15 N3 119.7(4) . . ?
C16 C15 N3 121.2(4) . . ?
C17 C16 C15 119.8(4) . . ?
C17 C16 H16 120.1 . . ?
C15 C16 H16 120.1 . . ?
C16 C17 C18 121.7(5) . . ?
C16 C17 H17 119.2 . . ?
C18 C17 H17 119.2 . . ?
C17 C18 C19 118.5(4) . . ?
C17 C18 C21 121.6(4) . . ?
C19 C18 C21 119.7(4) . . ?
C20 C19 C18 120.2(4) . . ?
C20 C19 H19 119.9 . . ?
C18 C19 H19 119.9 . . ?
C15 C20 C19 120.7(4) . . ?
C15 C20 H20 119.6 . . ?
C19 C20 H20 119.6 . . ?
O8 C21 O7 124.0(5) . . ?
O8 C21 C18 122.7(5) . . ?
O7 C21 C18 113.3(4) . . ?
O9 C22 O10 120.2(4) . . ?
O9 C22 C23 120.3(4) . . ?
O10 C22 C23 119.5(4) . . ?
O9 C22 Eu1 59.5(2) . . ?
O10 C22 Eu1 60.7(2) . . ?
C23 C22 Eu1 175.7(3) . . ?
C28 C23 C24 119.8(4) . . ?
C28 C23 C22 120.3(4) . . ?
C24 C23 C22 119.9(4) . . ?
C25 C24 C23 119.4(4) . . ?
C25 C24 H24 120.3 . . ?
C23 C24 H24 120.3 . . ?
C24 C25 C26 121.1(4) . . ?
C24 C25 H25 119.5 . . ?
C26 C25 H25 119.5 . . ?
C27 C26 C25 118.6(4) . . ?
C27 C26 N6 121.4(4) . . ?
C25 C26 N6 119.9(4) . . ?
C28 C27 C26 120.3(4) . . ?
C28 C27 H27 119.8 . . ?
C26 C27 H27 119.8 . . ?
C23 C28 C27 120.7(4) . . ?
C23 C28 H28 119.7 . . ?
C27 C28 H28 119.7 . . ?
O2 C29 N6 127.0(4) . . ?
O2 C29 C30 121.4(4) . . ?
N6 C29 C30 111.6(4) . . ?
N5 C30 C31 120.4(4) . . ?
N5 C30 C29 112.4(3) . . ?
C31 C30 C29 127.2(4) . . ?
C32 C31 C30 118.0(4) . . ?
C32 C31 H31 121.0 . . ?
C30 C31 H31 121.0 . . ?
C33 C32 C31 120.9(4) . . ?
C33 C32 H32 119.6 . . ?
C31 C32 H32 119.6 . . ?
C32 C33 C34 118.4(4) . . ?
C32 C33 H33 120.8 . . ?
C34 C33 H33 120.8 . . ?
N5 C34 C33 120.0(4) . . ?
N5 C34 C35 111.9(3) . . ?
C33 C34 C35 128.1(4) . . ?
O1 C35 N4 127.1(4) . . ?
O1 C35 C34 121.0(4) . . ?
N4 C35 C34 111.9(4) . . ?
C41 C36 C37 119.2(4) . . ?
C41 C36 N4 120.8(4) . . ?
C37 C36 N4 120.0(4) . . ?
C38 C37 C36 120.7(4) . . ?
C38 C37 H37 119.6 . . ?
C36 C37 H37 119.6 . . ?
C37 C38 C39 120.2(4) . . ?
C37 C38 H38 119.9 . . ?
C39 C38 H38 119.9 . . ?
C38 C39 C40 119.6(4) . . ?
C38 C39 C42 121.4(4) . . ?
C40 C39 C42 119.0(4) . . ?
C39 C40 C41 119.8(4) . . ?
C39 C40 H40 120.1 . . ?
C41 C40 H40 120.1 . . ?
C36 C41 C40 120.5(4) . . ?
C36 C41 H41 119.8 . . ?
C40 C41 H41 119.8 . . ?
O12 C42 O11 123.5(4) . . ?
O12 C42 C39 123.8(4) . . ?
O11 C42 C39 112.7(4) . . ?
C8 N1 C5 117.0(4) . . ?
C8 N1 Co1 115.9(3) . . ?
C5 N1 Co1 127.1(3) . . ?
C9 N2 C13 122.6(4) . . ?
C9 N2 Co1 118.9(3) . . ?
C13 N2 Co1 118.6(3) . . ?
C14 N3 C15 119.1(3) . . ?
C14 N3 Co1 115.2(3) . . ?
C15 N3 Co1 125.1(3) . . ?
C35 N4 C36 118.4(3) . . ?
C35 N4 Co1 115.8(3) . . ?
C36 N4 Co1 125.7(3) . . ?
C30 N5 C34 122.4(3) . . ?
C30 N5 Co1 119.1(3) . . ?
C34 N5 Co1 118.6(3) . . ?
C29 N6 C26 117.7(4) . . ?
C29 N6 Co1 115.4(3) . . ?
C26 N6 Co1 126.9(3) . . ?
C1 O5 Eu1 92.7(3) . 4 ?
C1 O6 Eu1 93.9(3) . 4 ?
C21 O7 H7A 109.5 . . ?
C22 O9 Eu1 94.4(3) . . ?
C22 O10 Eu1 93.2(2) . . ?
C42 O11 H11A 109.5 . . ?
N5 Co1 N2 178.92(16) . . ?
N5 Co1 N4 81.52(14) . . ?
N2 Co1 N4 97.71(14) . . ?
N5 Co1 N1 98.03(15) . . ?
N2 Co1 N1 81.22(15) . . ?
N4 Co1 N1 91.35(15) . . ?
N5 Co1 N6 81.08(15) . . ?
N2 Co1 N6 99.70(15) . . ?
N4 Co1 N6 162.57(14) . . ?
N1 Co1 N6 92.16(16) . . ?
N5 Co1 N3 99.21(14) . . ?
N2 Co1 N3 81.55(14) . . ?
N4 Co1 N3 92.04(14) . . ?
N1 Co1 N3 162.74(14) . . ?
N6 Co1 N3 89.65(15) . . ?
O6 Eu1 O5 53.30(11) 4_656 4_656 ?
O6 Eu1 O5W 87.05(14) 4_656 . ?
O5 Eu1 O5W 71.49(11) 4_656 . ?
O6 Eu1 O2W 84.16(14) 4_656 . ?
O5 Eu1 O2W 71.26(12) 4_656 . ?
O5W Eu1 O2W 139.05(13) . . ?
O6 Eu1 O1W 129.12(11) 4_656 . ?
O5 Eu1 O1W 75.91(11) 4_656 . ?
O5W Eu1 O1W 78.81(12) . . ?
O2W Eu1 O1W 76.24(13) . . ?
O6 Eu1 O4W 79.18(13) 4_656 . ?
O5 Eu1 O4W 120.37(12) 4_656 . ?
O5W Eu1 O4W 72.43(13) . . ?
O2W Eu1 O4W 143.50(14) . . ?
O1W Eu1 O4W 138.39(13) . . ?
O6 Eu1 O9 142.46(12) 4_656 . ?
O5 Eu1 O9 143.30(11) 4_656 . ?
O5W Eu1 O9 127.47(11) . . ?
O2W Eu1 O9 77.81(12) . . ?
O1W Eu1 O9 77.99(11) . . ?
O4W Eu1 O9 96.25(12) . . ?
O6 Eu1 O3W 73.89(12) 4_656 . ?
O5 Eu1 O3W 117.60(12) 4_656 . ?
O5W Eu1 O3W 141.55(14) . . ?
O2W Eu1 O3W 72.88(15) . . ?
O1W Eu1 O3W 138.81(13) . . ?
O4W Eu1 O3W 71.38(15) . . ?
O9 Eu1 O3W 69.43(12) . . ?
O6 Eu1 O10 150.50(12) 4_656 . ?
O5 Eu1 O10 137.40(11) 4_656 . ?
O5W Eu1 O10 75.93(11) . . ?
O2W Eu1 O10 124.31(11) . . ?
O1W Eu1 O10 71.43(11) . . ?
O4W Eu1 O10 72.83(11) . . ?
O9 Eu1 O10 52.11(10) . . ?
O3W Eu1 O10 104.99(12) . . ?
O6 Eu1 C1 26.50(12) 4_656 4_656 ?
O5 Eu1 C1 26.80(11) 4_656 4_656 ?
O5W Eu1 C1 78.03(13) . 4_656 ?
O2W Eu1 C1 76.45(13) . 4_656 ?
O1W Eu1 C1 102.68(12) . 4_656 ?
O4W Eu1 C1 100.06(13) . 4_656 ?
O9 Eu1 C1 153.24(12) . 4_656 ?
O3W Eu1 C1 95.90(13) . 4_656 ?
O10 Eu1 C1 153.94(12) . 4_656 ?
O6 Eu1 C22 157.07(12) 4_656 . ?
O5 Eu1 C22 149.59(11) 4_656 . ?
O5W Eu1 C22 101.85(12) . . ?
O2W Eu1 C22 101.60(12) . . ?
O1W Eu1 C22 73.67(12) . . ?
O4W Eu1 C22 83.42(12) . . ?
O9 Eu1 C22 26.04(11) . . ?
O3W Eu1 C22 86.51(12) . . ?
O10 Eu1 C22 26.09(10) . . ?
C1 Eu1 C22 176.25(13) 4_656 . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O6 C1 C2 C3 -167.8(5) . . . . ?
O5 C1 C2 C3 11.5(7) . . . . ?
Eu1 C1 C2 C3 -107(17) 4 . . . ?
O6 C1 C2 C7 9.3(8) . . . . ?
O5 C1 C2 C7 -171.5(5) . . . . ?
Eu1 C1 C2 C7 70(17) 4 . . . ?
C7 C2 C3 C4 1.0(8) . . . . ?
C1 C2 C3 C4 178.1(5) . . . . ?
C2 C3 C4 C5 -1.4(9) . . . . ?
C3 C4 C5 C6 1.8(8) . . . . ?
C3 C4 C5 N1 -177.2(5) . . . . ?
C4 C5 C6 C7 -1.8(8) . . . . ?
N1 C5 C6 C7 177.2(5) . . . . ?
C3 C2 C7 C6 -1.0(8) . . . . ?
C1 C2 C7 C6 -178.0(5) . . . . ?
C5 C6 C7 C2 1.4(9) . . . . ?
O3 C8 C9 N2 179.8(5) . . . . ?
N1 C8 C9 N2 0.4(6) . . . . ?
O3 C8 C9 C10 0.8(9) . . . . ?
N1 C8 C9 C10 -178.7(5) . . . . ?
N2 C9 C10 C11 1.3(8) . . . . ?
C8 C9 C10 C11 -179.7(5) . . . . ?
C9 C10 C11 C12 -0.8(8) . . . . ?
C10 C11 C12 C13 -0.4(8) . . . . ?
C11 C12 C13 N2 1.1(7) . . . . ?
C11 C12 C13 C14 176.6(5) . . . . ?
N2 C13 C14 O4 173.6(4) . . . . ?
C12 C13 C14 O4 -2.2(7) . . . . ?
N2 C13 C14 N3 -4.8(5) . . . . ?
C12 C13 C14 N3 179.5(4) . . . . ?
C20 C15 C16 C17 -3.2(7) . . . . ?
N3 C15 C16 C17 179.4(4) . . . . ?
C15 C16 C17 C18 2.1(8) . . . . ?
C16 C17 C18 C19 0.2(8) . . . . ?
C16 C17 C18 C21 -174.5(5) . . . . ?
C17 C18 C19 C20 -1.5(7) . . . . ?
C21 C18 C19 C20 173.3(4) . . . . ?
C16 C15 C20 C19 1.9(7) . . . . ?
N3 C15 C20 C19 179.4(4) . . . . ?
C18 C19 C20 C15 0.5(7) . . . . ?
C17 C18 C21 O8 7.1(8) . . . . ?
C19 C18 C21 O8 -167.6(5) . . . . ?
C17 C18 C21 O7 -173.5(5) . . . . ?
C19 C18 C21 O7 11.8(6) . . . . ?
O9 C22 C23 C28 155.9(5) . . . . ?
O10 C22 C23 C28 -26.1(7) . . . . ?
Eu1 C22 C23 C28 -117(4) . . . . ?
O9 C22 C23 C24 -25.2(7) . . . . ?
O10 C22 C23 C24 152.8(5) . . . . ?
Eu1 C22 C23 C24 62(4) . . . . ?
C28 C23 C24 C25 3.1(7) . . . . ?
C22 C23 C24 C25 -175.8(4) . . . . ?
C23 C24 C25 C26 -1.8(8) . . . . ?
C24 C25 C26 C27 -1.2(8) . . . . ?
C24 C25 C26 N6 175.9(5) . . . . ?
C25 C26 C27 C28 2.9(7) . . . . ?
N6 C26 C27 C28 -174.1(4) . . . . ?
C24 C23 C28 C27 -1.4(7) . . . . ?
C22 C23 C28 C27 177.5(4) . . . . ?
C26 C27 C28 C23 -1.7(8) . . . . ?
O2 C29 C30 N5 174.5(4) . . . . ?
N6 C29 C30 N5 -4.7(5) . . . . ?
O2 C29 C30 C31 -5.9(8) . . . . ?
N6 C29 C30 C31 174.9(4) . . . . ?
N5 C30 C31 C32 -0.7(7) . . . . ?
C29 C30 C31 C32 179.8(5) . . . . ?
C30 C31 C32 C33 0.7(8) . . . . ?
C31 C32 C33 C34 -0.7(8) . . . . ?
C32 C33 C34 N5 0.8(7) . . . . ?
C32 C33 C34 C35 -176.7(5) . . . . ?
N5 C34 C35 O1 179.6(4) . . . . ?
C33 C34 C35 O1 -2.7(7) . . . . ?
N5 C34 C35 N4 -1.7(5) . . . . ?
C33 C34 C35 N4 176.0(4) . . . . ?
C41 C36 C37 C38 1.8(7) . . . . ?
N4 C36 C37 C38 -179.6(4) . . . . ?
C36 C37 C38 C39 -0.4(8) . . . . ?
C37 C38 C39 C40 -0.6(8) . . . . ?
C37 C38 C39 C42 177.6(5) . . . . ?
C38 C39 C40 C41 0.2(7) . . . . ?
C42 C39 C40 C41 -178.1(5) . . . . ?
C37 C36 C41 C40 -2.2(7) . . . . ?
N4 C36 C41 C40 179.3(4) . . . . ?
C39 C40 C41 C36 1.2(8) . . . . ?
C38 C39 C42 O12 175.9(5) . . . . ?
C40 C39 C42 O12 -5.8(8) . . . . ?
C38 C39 C42 O11 -3.8(7) . . . . ?
C40 C39 C42 O11 174.5(5) . . . . ?
O3 C8 N1 C5 0.2(8) . . . . ?
C9 C8 N1 C5 179.7(4) . . . . ?
O3 C8 N1 Co1 -179.7(5) . . . . ?
C9 C8 N1 Co1 -0.3(5) . . . . ?
C6 C5 N1 C8 -98.3(6) . . . . ?
C4 C5 N1 C8 80.7(6) . . . . ?
C6 C5 N1 Co1 81.6(6) . . . . ?
C4 C5 N1 Co1 -99.4(5) . . . . ?
C10 C9 N2 C13 -0.7(7) . . . . ?
C8 C9 N2 C13 -179.8(4) . . . . ?
C10 C9 N2 Co1 178.8(4) . . . . ?
C8 C9 N2 Co1 -0.3(5) . . . . ?
C12 C13 N2 C9 -0.6(7) . . . . ?
C14 C13 N2 C9 -176.7(4) . . . . ?
C12 C13 N2 Co1 179.9(3) . . . . ?
C14 C13 N2 Co1 3.8(5) . . . . ?
O4 C14 N3 C15 -3.4(7) . . . . ?
C13 C14 N3 C15 174.8(4) . . . . ?
O4 C14 N3 Co1 -174.5(4) . . . . ?
C13 C14 N3 Co1 3.7(5) . . . . ?
C20 C15 N3 C14 121.8(4) . . . . ?
C16 C15 N3 C14 -60.7(6) . . . . ?
C20 C15 N3 Co1 -68.0(5) . . . . ?
C16 C15 N3 Co1 109.4(4) . . . . ?
O1 C35 N4 C36 4.6(7) . . . . ?
C34 C35 N4 C36 -174.0(4) . . . . ?
O1 C35 N4 Co1 -176.7(4) . . . . ?
C34 C35 N4 Co1 4.7(4) . . . . ?
C41 C36 N4 C35 -101.3(5) . . . . ?
C37 C36 N4 C35 80.1(5) . . . . ?
C41 C36 N4 Co1 80.2(5) . . . . ?
C37 C36 N4 Co1 -98.4(4) . . . . ?
C31 C30 N5 C34 0.8(7) . . . . ?
C29 C30 N5 C34 -179.6(4) . . . . ?
C31 C30 N5 Co1 -179.9(3) . . . . ?
C29 C30 N5 Co1 -0.3(5) . . . . ?
C33 C34 N5 C30 -0.9(6) . . . . ?
C35 C34 N5 C30 177.0(4) . . . . ?
C33 C34 N5 Co1 179.9(3) . . . . ?
C35 C34 N5 Co1 -2.3(5) . . . . ?
O2 C29 N6 C26 9.6(7) . . . . ?
C30 C29 N6 C26 -171.2(4) . . . . ?
O2 C29 N6 Co1 -171.8(4) . . . . ?
C30 C29 N6 Co1 7.4(5) . . . . ?
C27 C26 N6 C29 -120.3(5) . . . . ?
C25 C26 N6 C29 62.7(6) . . . . ?
C27 C26 N6 Co1 61.3(6) . . . . ?
C25 C26 N6 Co1 -115.7(4) . . . . ?
O6 C1 O5 Eu1 0.4(5) . . . 4 ?
C2 C1 O5 Eu1 -178.8(4) . . . 4 ?
O5 C1 O6 Eu1 -0.4(5) . . . 4 ?
C2 C1 O6 Eu1 178.8(4) . . . 4 ?
O10 C22 O9 Eu1 -3.0(5) . . . . ?
C23 C22 O9 Eu1 175.0(4) . . . . ?
O9 C22 O10 Eu1 2.9(4) . . . . ?
C23 C22 O10 Eu1 -175.0(4) . . . . ?
C30 N5 Co1 N2 140(8) . . . . ?
C34 N5 Co1 N2 -41(8) . . . . ?
C30 N5 Co1 N4 -175.5(3) . . . . ?
C34 N5 Co1 N4 3.8(3) . . . . ?
C30 N5 Co1 N1 94.3(3) . . . . ?
C34 N5 Co1 N1 -86.4(3) . . . . ?
C30 N5 Co1 N6 3.4(3) . . . . ?
C34 N5 Co1 N6 -177.3(3) . . . . ?
C30 N5 Co1 N3 -84.8(3) . . . . ?
C34 N5 Co1 N3 94.5(3) . . . . ?
C9 N2 Co1 N5 -46(8) . . . . ?
C13 N2 Co1 N5 134(8) . . . . ?
C9 N2 Co1 N4 -90.1(4) . . . . ?
C13 N2 Co1 N4 89.5(3) . . . . ?
C9 N2 Co1 N1 0.1(3) . . . . ?
C13 N2 Co1 N1 179.7(3) . . . . ?
C9 N2 Co1 N6 90.8(4) . . . . ?
C13 N2 Co1 N6 -89.6(3) . . . . ?
C9 N2 Co1 N3 179.0(4) . . . . ?
C13 N2 Co1 N3 -1.5(3) . . . . ?
C35 N4 Co1 N5 -4.8(3) . . . . ?
C36 N4 Co1 N5 173.8(3) . . . . ?
C35 N4 Co1 N2 174.5(3) . . . . ?
C36 N4 Co1 N2 -7.0(3) . . . . ?
C35 N4 Co1 N1 93.2(3) . . . . ?
C36 N4 Co1 N1 -88.3(3) . . . . ?
C35 N4 Co1 N6 -8.4(7) . . . . ?
C36 N4 Co1 N6 170.1(4) . . . . ?
C35 N4 Co1 N3 -103.8(3) . . . . ?
C36 N4 Co1 N3 74.8(3) . . . . ?
C8 N1 Co1 N5 179.3(4) . . . . ?
C5 N1 Co1 N5 -0.6(4) . . . . ?
C8 N1 Co1 N2 0.1(4) . . . . ?
C5 N1 Co1 N2 -179.8(4) . . . . ?
C8 N1 Co1 N4 97.7(4) . . . . ?
C5 N1 Co1 N4 -82.2(4) . . . . ?
C8 N1 Co1 N6 -99.4(4) . . . . ?
C5 N1 Co1 N6 80.7(4) . . . . ?
C8 N1 Co1 N3 -3.6(8) . . . . ?
C5 N1 Co1 N3 176.5(4) . . . . ?
C29 N6 Co1 N5 -6.1(3) . . . . ?
C26 N6 Co1 N5 172.3(4) . . . . ?
C29 N6 Co1 N2 174.6(3) . . . . ?
C26 N6 Co1 N2 -7.0(4) . . . . ?
C29 N6 Co1 N4 -2.5(7) . . . . ?
C26 N6 Co1 N4 176.0(4) . . . . ?
C29 N6 Co1 N1 -103.9(3) . . . . ?
C26 N6 Co1 N1 74.5(4) . . . . ?
C29 N6 Co1 N3 93.2(3) . . . . ?
C26 N6 Co1 N3 -88.3(4) . . . . ?
C14 N3 Co1 N5 179.3(3) . . . . ?
C15 N3 Co1 N5 8.8(4) . . . . ?
C14 N3 Co1 N2 -1.5(3) . . . . ?
C15 N3 Co1 N2 -172.0(4) . . . . ?
C14 N3 Co1 N4 -99.0(3) . . . . ?
C15 N3 Co1 N4 90.5(3) . . . . ?
C14 N3 Co1 N1 2.2(7) . . . . ?
C15 N3 Co1 N1 -168.3(5) . . . . ?
C14 N3 Co1 N6 98.4(3) . . . . ?
C15 N3 Co1 N6 -72.1(3) . . . . ?
C22 O9 Eu1 O6 -141.2(3) . . . 4_656 ?
C22 O9 Eu1 O5 122.8(3) . . . 4_656 ?
C22 O9 Eu1 O5W 11.7(3) . . . . ?
C22 O9 Eu1 O2W 155.6(3) . . . . ?
C22 O9 Eu1 O1W 77.3(3) . . . . ?
C22 O9 Eu1 O4W -60.9(3) . . . . ?
C22 O9 Eu1 O3W -128.3(3) . . . . ?
C22 O9 Eu1 O10 1.6(2) . . . . ?
C22 O9 Eu1 C1 171.7(3) . . . 4_656 ?
C22 O10 Eu1 O6 130.0(3) . . . 4_656 ?
C22 O10 Eu1 O5 -132.5(3) . . . 4_656 ?
C22 O10 Eu1 O5W -173.4(3) . . . . ?
C22 O10 Eu1 O2W -32.9(3) . . . . ?
C22 O10 Eu1 O1W -90.7(3) . . . . ?
C22 O10 Eu1 O4W 111.0(3) . . . . ?
C22 O10 Eu1 O9 -1.6(2) . . . . ?
C22 O10 Eu1 O3W 46.4(3) . . . . ?
C22 O10 Eu1 C1 -171.5(3) . . . 4_656 ?
O9 C22 Eu1 O6 78.3(5) . . . 4_656 ?
O10 C22 Eu1 O6 -104.6(4) . . . 4_656 ?
C23 C22 Eu1 O6 -11(4) . . . 4_656 ?
O9 C22 Eu1 O5 -97.0(3) . . . 4_656 ?
O10 C22 Eu1 O5 80.1(4) . . . 4_656 ?
C23 C22 Eu1 O5 174(4) . . . 4_656 ?
O9 C22 Eu1 O5W -170.5(3) . . . . ?
O10 C22 Eu1 O5W 6.5(3) . . . . ?
C23 C22 Eu1 O5W 100(4) . . . . ?
O9 C22 Eu1 O2W -24.3(3) . . . . ?
O10 C22 Eu1 O2W 152.7(3) . . . . ?
C23 C22 Eu1 O2W -114(4) . . . . ?
O9 C22 Eu1 O1W -96.1(3) . . . . ?
O10 C22 Eu1 O1W 81.0(3) . . . . ?
C23 C22 Eu1 O1W 175(4) . . . . ?
O9 C22 Eu1 O4W 119.1(3) . . . . ?
O10 C22 Eu1 O4W -63.9(3) . . . . ?
C23 C22 Eu1 O4W 30(4) . . . . ?
O10 C22 Eu1 O9 177.1(4) . . . . ?
C23 C22 Eu1 O9 -89(4) . . . . ?
O9 C22 Eu1 O3W 47.4(3) . . . . ?
O10 C22 Eu1 O3W -135.5(3) . . . . ?
C23 C22 Eu1 O3W -42(4) . . . . ?
O9 C22 Eu1 O10 -177.1(4) . . . . ?
C23 C22 Eu1 O10 94(4) . . . . ?
O9 C22 Eu1 C1 -83(2) . . . 4_656 ?
O10 C22 Eu1 C1 94(2) . . . 4_656 ?
C23 C22 Eu1 C1 -172(3) . . . 4_656 ?

_diffrn_measured_fraction_theta_max 0.999
_diffrn_reflns_theta_full        26.00
_diffrn_measured_fraction_theta_full 0.999
_refine_diff_density_max         0.796
_refine_diff_density_min         -0.906
_refine_diff_density_rms         0.105
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_1-Tb
_database_code_depnum_ccdc_archive 'CCDC 1439281'
_audit_update_record             
;
2016-02-10 deposited with the CCDC.
2016-02-15 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C84 H44 Co2 N12 O34 Tb2, 20(O), 4(H2O)'
_chemical_formula_sum            'C84 H52 Co2 N12 O58 Tb2'
_chemical_formula_weight         2593.08

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'
Co Co 0.3494 0.9721 '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'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-P 1'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.4727(12)
_cell_length_b                   15.695(2)
_cell_length_c                   17.302(2)
_cell_angle_alpha                63.879(13)
_cell_angle_beta                 79.754(10)
_cell_angle_gamma                82.500(10)
_cell_volume                     2747.9(6)
_cell_formula_units_Z            1
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    3038
_cell_measurement_theta_min      3.1720
_cell_measurement_theta_max      21.1900

_exptl_crystal_description       block
_exptl_crystal_colour            green
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.13
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.567
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1288
_exptl_absorpt_coefficient_mu    1.672
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.7310
_exptl_absorpt_correction_T_max  0.8120
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'X-calibur S oxford'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            28496
_diffrn_reflns_av_R_equivalents  0.1175
_diffrn_reflns_av_sigmaI/netI    0.1856
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         2.97
_diffrn_reflns_theta_max         26.00
_reflns_number_total             10719
_reflns_number_gt                6067
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'X-calibur S oxford'
_computing_cell_refinement       'X-calibur S SAINT'
_computing_data_reduction        'X-calibur S SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Oxford SHELXTL'
_computing_publication_material  'Oxford SHELXTL'

_refine_special_details          
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0472P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         10719
_refine_ls_number_parameters     720
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.1473
_refine_ls_R_factor_gt           0.0783
_refine_ls_wR_factor_ref         0.1667
_refine_ls_wR_factor_gt          0.1372
_refine_ls_goodness_of_fit_ref   0.958
_refine_ls_restrained_S_all      0.958
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
O6W2 O -0.097(3) 0.865(2) 0.347(2) 0.098(16) Uiso 0.31(3) 1 d P A 1
O8W1 O 0.0320(10) 1.1517(11) -0.0792(8) 0.085(5) Uiso 0.77(3) 1 d P B 1
O6W1 O -0.0355(17) 0.8914(14) 0.2901(14) 0.156(9) Uiso 0.69(3) 1 d PD A 2
O8W2 O 0.014(3) 1.078(4) -0.034(3) 0.087(17) Uiso 0.23(3) 1 d P B 2
Tb1 Tb 0.50341(4) 0.95279(3) 0.17682(3) 0.03238(16) Uani 1 1 d . . .
Co1 Co 0.01411(9) 0.62428(8) 0.70933(7) 0.0265(3) Uani 1 1 d . . .
O1 O -0.1066(5) 0.4450(5) 0.9524(4) 0.0493(18) Uani 1 1 d . . .
N1 N -0.0389(6) 0.7160(5) 0.6005(4) 0.0307(17) Uani 1 1 d . . .
C1 C 0.3267(8) 0.8742(6) 0.3177(6) 0.036(2) Uani 1 1 d . . .
O2 O -0.2072(5) 0.8003(5) 0.5408(4) 0.057(2) Uani 1 1 d . . .
N2 N -0.1480(6) 0.6274(5) 0.7478(5) 0.0289(17) Uani 1 1 d . . .
C2 C 0.2227(7) 0.8374(5) 0.3867(5) 0.028(2) Uani 1 1 d . . .
O3 O 0.2140(5) 0.8183(5) 0.7067(4) 0.0494(19) Uani 1 1 d . . .
N3 N 0.0182(6) 0.5340(5) 0.8291(4) 0.0304(18) Uani 1 1 d . . .
C3 C 0.1762(7) 0.8839(6) 0.4384(5) 0.035(2) Uani 1 1 d . . .
H3 H 0.2084 0.9414 0.4279 0.042 Uiso 1 1 calc R . .
O4 O 0.1529(5) 0.4292(4) 0.6216(4) 0.0444(17) Uani 1 1 d . . .
N4 N 0.0200(5) 0.5196(5) 0.6762(4) 0.0306(18) Uani 1 1 d . . .
C4 C 0.0849(8) 0.8488(6) 0.5045(6) 0.040(2) Uani 1 1 d . . .
H4 H 0.0513 0.8832 0.5373 0.047 Uiso 1 1 calc R . .
O5 O 0.3883(5) 0.9375(4) 0.3134(4) 0.0420(16) Uani 1 1 d . . .
N5 N 0.1745(5) 0.6216(4) 0.6683(4) 0.0272(17) Uani 1 1 d . . .
C5 C 0.0416(7) 0.7617(6) 0.5229(5) 0.027(2) Uani 1 1 d . . .
O6 O 0.3531(5) 0.8395(4) 0.2628(4) 0.0478(18) Uani 1 1 d . . .
N6 N 0.0548(6) 0.7281(5) 0.7307(4) 0.0306(18) Uani 1 1 d . . .
C6 C 0.0854(7) 0.7167(6) 0.4704(6) 0.036(2) Uani 1 1 d . . .
H6 H 0.0534 0.6594 0.4801 0.043 Uiso 1 1 calc R . .
O7 O 0.5179(6) 0.3926(5) 0.9657(6) 0.068(2) Uani 1 1 d . . .
H7 H 0.5713 0.3588 0.9952 0.102 Uiso 1 1 calc R . .
C7 C 0.1759(8) 0.7550(6) 0.4034(6) 0.045(3) Uani 1 1 d . . .
H7A H 0.2063 0.7228 0.3681 0.054 Uiso 1 1 calc R . .
O8 O 0.4681(6) 0.2537(4) 0.9809(4) 0.0499(18) Uani 1 1 d . . .
C8 C -0.1555(7) 0.7401(6) 0.6017(6) 0.035(2) Uani 1 1 d . . .
O9 O -0.4359(5) 0.3912(5) 0.6071(5) 0.0548(19) Uani 1 1 d . . .
H9 H -0.4965 0.3637 0.6116 0.082 Uiso 1 1 calc R . .
C9 C -0.2202(7) 0.6863(6) 0.6907(6) 0.033(2) Uani 1 1 d . . .
O10 O -0.4877(5) 0.3438(5) 0.7511(5) 0.0501(19) Uani 1 1 d . . .
C10 C -0.3406(7) 0.6930(7) 0.7196(7) 0.052(3) Uani 1 1 d . . .
H10 H -0.3939 0.7347 0.6811 0.062 Uiso 1 1 calc R . .
O11 O 0.3414(5) 1.0372(4) 0.1154(4) 0.0430(17) Uani 1 1 d . . .
C11 C -0.3805(9) 0.6381(8) 0.8047(7) 0.060(3) Uani 1 1 d . . .
H11 H -0.4625 0.6430 0.8254 0.072 Uiso 1 1 calc R . .
O12 O 0.2253(5) 1.0979(4) 0.0119(4) 0.0457(18) Uani 1 1 d . . .
C12 C -0.3049(8) 0.5754(7) 0.8618(6) 0.045(3) Uani 1 1 d . . .
H12 H -0.3337 0.5361 0.9205 0.055 Uiso 1 1 calc R . .
C13 C -0.1860(7) 0.5725(6) 0.8301(6) 0.033(2) Uani 1 1 d . . .
C14 C -0.0870(8) 0.5093(7) 0.8782(6) 0.036(2) Uani 1 1 d . . .
C15 C 0.1269(7) 0.4836(6) 0.8612(5) 0.029(2) Uani 1 1 d . . .
C16 C 0.2086(7) 0.5304(6) 0.8762(6) 0.036(2) Uani 1 1 d . . .
H16 H 0.1915 0.5949 0.8666 0.044 Uiso 1 1 calc R . .
C17 C 0.3150(7) 0.4846(6) 0.9052(6) 0.037(2) Uani 1 1 d . . .
H17 H 0.3705 0.5180 0.9143 0.045 Uiso 1 1 calc R . .
C18 C 0.3397(7) 0.3908(6) 0.9205(6) 0.034(2) Uani 1 1 d . . .
C19 C 0.2602(8) 0.3444(6) 0.9040(6) 0.041(2) Uani 1 1 d . . .
H19 H 0.2779 0.2799 0.9136 0.049 Uiso 1 1 calc R . .
C20 C 0.1549(8) 0.3900(6) 0.8738(6) 0.041(2) Uani 1 1 d . . .
H20 H 0.1017 0.3573 0.8616 0.049 Uiso 1 1 calc R . .
C21 C 0.4473(8) 0.3378(7) 0.9583(7) 0.044(3) Uani 1 1 d . . .
C22 C -0.4190(8) 0.3791(7) 0.6841(7) 0.040(3) Uani 1 1 d . . .
C23 C -0.3003(7) 0.4136(6) 0.6832(6) 0.035(2) Uani 1 1 d . . .
C24 C -0.2531(8) 0.3835(6) 0.7577(6) 0.039(2) Uani 1 1 d . . .
H24 H -0.2946 0.3420 0.8113 0.047 Uiso 1 1 calc R . .
C25 C -0.1414(8) 0.4142(6) 0.7556(6) 0.042(2) Uani 1 1 d . . .
H25 H -0.1070 0.3914 0.8076 0.050 Uiso 1 1 calc R . .
C26 C -0.0818(7) 0.4770(6) 0.6782(6) 0.033(2) Uani 1 1 d . . .
C27 C -0.1330(8) 0.5062(7) 0.6029(6) 0.042(2) Uani 1 1 d . . .
H27 H -0.0932 0.5487 0.5491 0.051 Uiso 1 1 calc R . .
C28 C -0.2413(8) 0.4743(7) 0.6050(7) 0.046(3) Uani 1 1 d . . .
H28 H -0.2746 0.4941 0.5528 0.055 Uiso 1 1 calc R . .
C29 C 0.1272(7) 0.4940(6) 0.6462(5) 0.031(2) Uani 1 1 d . . .
C30 C 0.2198(7) 0.5579(6) 0.6381(6) 0.029(2) Uani 1 1 d . . .
C31 C 0.3377(8) 0.5591(6) 0.6022(6) 0.039(2) Uani 1 1 d . . .
H31 H 0.3713 0.5138 0.5808 0.047 Uiso 1 1 calc R . .
C32 C 0.4046(7) 0.6271(7) 0.5984(7) 0.047(3) Uani 1 1 d . . .
H32 H 0.4857 0.6284 0.5740 0.056 Uiso 1 1 calc R . .
C33 C 0.3575(7) 0.6941(6) 0.6290(6) 0.043(3) Uani 1 1 d . . .
H33 H 0.4041 0.7418 0.6255 0.052 Uiso 1 1 calc R . .
C34 C 0.2385(7) 0.6882(6) 0.6651(5) 0.031(2) Uani 1 1 d . . .
C35 C 0.1670(8) 0.7519(6) 0.7024(6) 0.034(2) Uani 1 1 d . . .
C36 C -0.0219(7) 0.7751(6) 0.7766(5) 0.027(2) Uani 1 1 d . . .
C37 C -0.1080(8) 0.8431(6) 0.7358(6) 0.041(3) Uani 1 1 d . . .
H37 H -0.1138 0.8608 0.6765 0.049 Uiso 1 1 calc R . .
C38 C -0.1864(8) 0.8857(6) 0.7825(6) 0.041(3) Uani 1 1 d . . .
C39 C 0.1742(7) 1.1370(6) 0.1322(6) 0.033(2) Uani 1 1 d . . .
C40 C -0.0877(7) 0.7933(6) 0.9098(6) 0.037(2) Uani 1 1 d . . .
C41 C -0.0155(7) 0.7481(6) 0.8628(6) 0.040(2) Uani 1 1 d . . .
H41 H 0.0391 0.6975 0.8914 0.048 Uiso 1 1 calc R . .
C42 C 0.2522(7) 1.0866(6) 0.0823(6) 0.034(2) Uani 1 1 d . . .
O1W O 0.6169(5) 0.8040(4) 0.2154(4) 0.0436(17) Uani 1 1 d . . .
O2W O 0.6498(5) 0.9499(4) 0.2625(4) 0.0479(17) Uani 1 1 d . . .
O3W O 0.6595(5) 1.0110(4) 0.0571(4) 0.0340(15) Uani 1 1 d . . .
O4W O 0.5263(5) 1.1145(4) 0.1515(4) 0.0478(18) Uani 1 1 d . . .
O5W O 0.4741(5) 0.8859(4) 0.0808(4) 0.0408(16) Uani 1 1 d . . .
O7W O 0.1446(13) 0.8666(10) 0.1805(9) 0.224(7) Uani 1 1 d D . .
O9W O -0.2456(10) 1.0002(7) 0.4574(7) 0.127(4) Uani 1 1 d . . .
O10W O -0.1591(6) 1.0567(5) 0.2173(5) 0.076(2) Uani 1 1 d . . .
O11W O -0.3808(7) 0.8212(5) 0.4455(5) 0.087(3) Uani 1 1 d . . .
O12W O -0.3709(6) 0.6554(5) 0.4183(5) 0.058(2) Uani 1 1 d G . .
H12A H -0.3945 0.6611 0.4665 0.088 Uiso 1 1 d G . .
H12B H -0.3484 0.7098 0.3774 0.088 Uiso 1 1 d G . .
O13W O -0.5467(8) 0.9769(8) 0.4342(6) 0.120(4) Uani 1 1 d . . .
O14W O 0.4436(7) 0.8507(6) 0.7128(6) 0.099(3) Uani 1 1 d . . .
O15W O 0.7196(5) 0.3189(5) 1.0199(5) 0.066(2) Uani 1 1 d . . .
O16W O 0.8521(6) 0.7631(5) 0.2541(6) 0.085(3) Uani 1 1 d . . .
O17W O 0.8182(7) 1.1390(6) 0.0392(7) 0.086(3) Uani 1 1 d G . .
H17A H 0.8573 1.1613 -0.0130 0.128 Uiso 1 1 d G . .
H17B H 0.7804 1.0904 0.0477 0.128 Uiso 1 1 d G . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
Tb1 O11 2.271(5) . ?
Tb1 O1W 2.395(5) . ?
Tb1 O3W 2.403(5) . ?
Tb1 O5W 2.409(6) . ?
Tb1 O2W 2.414(6) . ?
Tb1 O5 2.420(5) . ?
Tb1 O4W 2.420(6) . ?
Tb1 O6 2.431(6) . ?
Tb1 C1 2.797(9) . ?
Co1 N5 1.853(6) . ?
Co1 N2 1.862(6) . ?
Co1 N3 1.934(7) . ?
Co1 N1 1.945(7) . ?
Co1 N6 1.949(7) . ?
Co1 N4 1.953(7) . ?
O1 C14 1.239(10) . ?
N1 C8 1.341(10) . ?
N1 C5 1.433(10) . ?
C1 O5 1.262(10) . ?
C1 O6 1.266(9) . ?
C1 C2 1.499(11) . ?
O2 C8 1.248(10) . ?
N2 C13 1.325(10) . ?
N2 C9 1.344(10) . ?
C2 C7 1.357(12) . ?
C2 C3 1.387(10) . ?
O3 C35 1.269(10) . ?
N3 C14 1.340(10) . ?
N3 C15 1.446(10) . ?
C3 C4 1.370(11) . ?
C3 H3 0.9500 . ?
O4 C29 1.250(9) . ?
N4 C29 1.332(9) . ?
N4 C26 1.407(10) . ?
C4 C5 1.397(12) . ?
C4 H4 0.9500 . ?
N5 C34 1.330(10) . ?
N5 C30 1.331(9) . ?
C5 C6 1.373(10) . ?
N6 C35 1.333(10) . ?
N6 C36 1.430(9) . ?
C6 C7 1.380(11) . ?
C6 H6 0.9500 . ?
O7 C21 1.314(11) . ?
O7 H7 0.8400 . ?
C7 H7A 0.9500 . ?
O8 C21 1.203(10) . ?
C8 C9 1.498(11) . ?
O9 C22 1.307(10) . ?
O9 H9 0.8400 . ?
C9 C10 1.390(11) . ?
O10 C22 1.223(11) . ?
C10 C11 1.366(12) . ?
C10 H10 0.9500 . ?
O11 C42 1.260(9) . ?
C11 C12 1.387(13) . ?
C11 H11 0.9500 . ?
O12 C42 1.241(10) . ?
C12 C13 1.380(11) . ?
C12 H12 0.9500 . ?
C13 C14 1.510(12) . ?
C15 C16 1.385(11) . ?
C15 C20 1.388(11) . ?
C16 C17 1.388(11) . ?
C16 H16 0.9500 . ?
C17 C18 1.377(11) . ?
C17 H17 0.9500 . ?
C18 C19 1.375(12) . ?
C18 C21 1.478(12) . ?
C19 C20 1.385(11) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C22 C23 1.525(12) . ?
C23 C24 1.352(12) . ?
C23 C28 1.379(12) . ?
C24 C25 1.415(12) . ?
C24 H24 0.9500 . ?
C25 C26 1.386(12) . ?
C25 H25 0.9500 . ?
C26 C27 1.388(12) . ?
C27 C28 1.388(12) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 C30 1.502(11) . ?
C30 C31 1.383(11) . ?
C31 C32 1.365(12) . ?
C31 H31 0.9500 . ?
C32 C33 1.386(11) . ?
C32 H32 0.9500 . ?
C33 C34 1.394(10) . ?
C33 H33 0.9500 . ?
C34 C35 1.501(10) . ?
C36 C41 1.373(11) . ?
C36 C37 1.387(11) . ?
C37 C38 1.404(10) . ?
C37 H37 0.9500 . ?
C38 C39 1.386(12) 2_576 ?
C39 C38 1.386(12) 2_576 ?
C39 C40 1.408(11) 2_576 ?
C39 C42 1.521(10) . ?
C40 C41 1.401(10) . ?
C40 C39 1.408(11) 2_576 ?
C41 H41 0.9500 . ?
O12W H12A 0.8705 . ?
O12W H12B 0.8701 . ?
O17W H17A 0.8702 . ?
O17W H17B 0.8702 . ?

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
O11 Tb1 O1W 144.3(2) . . ?
O11 Tb1 O3W 101.8(2) . . ?
O1W Tb1 O3W 84.47(19) . . ?
O11 Tb1 O5W 75.92(19) . . ?
O1W Tb1 O5W 71.8(2) . . ?
O3W Tb1 O5W 75.2(2) . . ?
O11 Tb1 O2W 143.0(2) . . ?
O1W Tb1 O2W 72.2(2) . . ?
O3W Tb1 O2W 84.3(2) . . ?
O5W Tb1 O2W 139.87(19) . . ?
O11 Tb1 O5 85.7(2) . . ?
O1W Tb1 O5 103.3(2) . . ?
O3W Tb1 O5 155.3(2) . . ?
O5W Tb1 O5 129.5(2) . . ?
O2W Tb1 O5 76.1(2) . . ?
O11 Tb1 O4W 75.0(2) . . ?
O1W Tb1 O4W 139.4(2) . . ?
O3W Tb1 O4W 74.08(19) . . ?
O5W Tb1 O4W 131.7(2) . . ?
O2W Tb1 O4W 71.7(2) . . ?
O5 Tb1 O4W 85.5(2) . . ?
O11 Tb1 O6 80.2(2) . . ?
O1W Tb1 O6 78.0(2) . . ?
O3W Tb1 O6 150.57(19) . . ?
O5W Tb1 O6 76.9(2) . . ?
O2W Tb1 O6 111.9(2) . . ?
O5 Tb1 O6 53.5(2) . . ?
O4W Tb1 O6 133.39(19) . . ?
O11 Tb1 C1 80.3(2) . . ?
O1W Tb1 C1 92.3(2) . . ?
O3W Tb1 C1 176.7(2) . . ?
O5W Tb1 C1 103.0(2) . . ?
O2W Tb1 C1 95.5(2) . . ?
O5 Tb1 C1 26.8(2) . . ?
O4W Tb1 C1 109.1(2) . . ?
O6 Tb1 C1 26.9(2) . . ?
N5 Co1 N2 178.5(3) . . ?
N5 Co1 N3 99.5(3) . . ?
N2 Co1 N3 81.7(3) . . ?
N5 Co1 N1 97.1(3) . . ?
N2 Co1 N1 81.6(3) . . ?
N3 Co1 N1 163.4(3) . . ?
N5 Co1 N6 82.6(3) . . ?
N2 Co1 N6 98.2(3) . . ?
N3 Co1 N6 92.5(3) . . ?
N1 Co1 N6 89.8(3) . . ?
N5 Co1 N4 81.6(3) . . ?
N2 Co1 N4 97.6(3) . . ?
N3 Co1 N4 90.0(3) . . ?
N1 Co1 N4 92.2(3) . . ?
N6 Co1 N4 164.2(3) . . ?
C8 N1 C5 120.2(7) . . ?
C8 N1 Co1 117.0(6) . . ?
C5 N1 Co1 122.7(5) . . ?
O5 C1 O6 119.6(8) . . ?
O5 C1 C2 122.2(8) . . ?
O6 C1 C2 118.2(8) . . ?
O5 C1 Tb1 59.7(5) . . ?
O6 C1 Tb1 60.2(4) . . ?
C2 C1 Tb1 174.0(6) . . ?
C13 N2 C9 123.4(7) . . ?
C13 N2 Co1 118.5(6) . . ?
C9 N2 Co1 118.1(6) . . ?
C7 C2 C3 118.2(8) . . ?
C7 C2 C1 121.0(7) . . ?
C3 C2 C1 120.7(8) . . ?
C14 N3 C15 120.7(7) . . ?
C14 N3 Co1 116.4(6) . . ?
C15 N3 Co1 122.2(5) . . ?
C4 C3 C2 121.5(8) . . ?
C4 C3 H3 119.3 . . ?
C2 C3 H3 119.3 . . ?
C29 N4 C26 121.1(7) . . ?
C29 N4 Co1 115.5(6) . . ?
C26 N4 Co1 123.3(5) . . ?
C3 C4 C5 119.3(7) . . ?
C3 C4 H4 120.4 . . ?
C5 C4 H4 120.4 . . ?
C1 O5 Tb1 93.5(5) . . ?
C34 N5 C30 122.5(7) . . ?
C34 N5 Co1 118.0(5) . . ?
C30 N5 Co1 119.4(6) . . ?
C6 C5 C4 119.3(8) . . ?
C6 C5 N1 120.6(8) . . ?
C4 C5 N1 119.9(7) . . ?
C1 O6 Tb1 92.9(5) . . ?
C35 N6 C36 119.4(7) . . ?
C35 N6 Co1 114.5(5) . . ?
C36 N6 Co1 126.0(5) . . ?
C5 C6 C7 119.8(8) . . ?
C5 C6 H6 120.1 . . ?
C7 C6 H6 120.1 . . ?
C21 O7 H7 109.5 . . ?
C2 C7 C6 121.8(8) . . ?
C2 C7 H7A 119.1 . . ?
C6 C7 H7A 119.1 . . ?
O2 C8 N1 127.4(8) . . ?
O2 C8 C9 122.3(8) . . ?
N1 C8 C9 110.3(7) . . ?
C22 O9 H9 109.5 . . ?
N2 C9 C10 118.7(8) . . ?
N2 C9 C8 113.0(7) . . ?
C10 C9 C8 128.3(9) . . ?
C11 C10 C9 118.4(9) . . ?
C11 C10 H10 120.8 . . ?
C9 C10 H10 120.8 . . ?
C42 O11 Tb1 177.6(6) . . ?
C10 C11 C12 121.9(9) . . ?
C10 C11 H11 119.1 . . ?
C12 C11 H11 119.1 . . ?
C13 C12 C11 117.3(9) . . ?
C13 C12 H12 121.3 . . ?
C11 C12 H12 121.3 . . ?
N2 C13 C12 120.3(9) . . ?
N2 C13 C14 112.3(7) . . ?
C12 C13 C14 127.5(9) . . ?
O1 C14 N3 127.7(8) . . ?
O1 C14 C13 122.0(8) . . ?
N3 C14 C13 110.3(8) . . ?
C16 C15 C20 118.5(8) . . ?
C16 C15 N3 119.8(7) . . ?
C20 C15 N3 121.7(8) . . ?
C15 C16 C17 121.1(8) . . ?
C15 C16 H16 119.4 . . ?
C17 C16 H16 119.4 . . ?
C18 C17 C16 119.8(9) . . ?
C18 C17 H17 120.1 . . ?
C16 C17 H17 120.1 . . ?
C19 C18 C17 119.4(8) . . ?
C19 C18 C21 119.4(8) . . ?
C17 C18 C21 121.1(9) . . ?
C18 C19 C20 121.1(8) . . ?
C18 C19 H19 119.5 . . ?
C20 C19 H19 119.5 . . ?
C19 C20 C15 120.0(9) . . ?
C19 C20 H20 120.0 . . ?
C15 C20 H20 120.0 . . ?
O8 C21 O7 123.3(9) . . ?
O8 C21 C18 124.3(9) . . ?
O7 C21 C18 112.4(8) . . ?
O10 C22 O9 125.8(9) . . ?
O10 C22 C23 121.8(9) . . ?
O9 C22 C23 112.4(9) . . ?
C24 C23 C28 120.8(9) . . ?
C24 C23 C22 120.2(9) . . ?
C28 C23 C22 119.0(9) . . ?
C23 C24 C25 119.6(9) . . ?
C23 C24 H24 120.2 . . ?
C25 C24 H24 120.2 . . ?
C26 C25 C24 120.7(9) . . ?
C26 C25 H25 119.7 . . ?
C24 C25 H25 119.7 . . ?
C25 C26 C27 118.0(9) . . ?
C25 C26 N4 121.6(9) . . ?
C27 C26 N4 119.9(9) . . ?
C28 C27 C26 121.2(9) . . ?
C28 C27 H27 119.4 . . ?
C26 C27 H27 119.4 . . ?
C23 C28 C27 119.7(9) . . ?
C23 C28 H28 120.2 . . ?
C27 C28 H28 120.2 . . ?
O4 C29 N4 127.1(8) . . ?
O4 C29 C30 120.8(7) . . ?
N4 C29 C30 112.0(7) . . ?
N5 C30 C31 119.9(8) . . ?
N5 C30 C29 111.4(6) . . ?
C31 C30 C29 128.6(7) . . ?
C32 C31 C30 118.4(8) . . ?
C32 C31 H31 120.8 . . ?
C30 C31 H31 120.8 . . ?
C31 C32 C33 121.9(8) . . ?
C31 C32 H32 119.1 . . ?
C33 C32 H32 119.1 . . ?
C32 C33 C34 116.7(8) . . ?
C32 C33 H33 121.6 . . ?
C34 C33 H33 121.6 . . ?
N5 C34 C33 120.6(7) . . ?
N5 C34 C35 112.3(7) . . ?
C33 C34 C35 127.1(8) . . ?
O3 C35 N6 126.5(7) . . ?
O3 C35 C34 121.2(8) . . ?
N6 C35 C34 112.3(8) . . ?
C41 C36 C37 120.0(7) . . ?
C41 C36 N6 119.9(7) . . ?
C37 C36 N6 120.0(8) . . ?
C36 C37 C38 119.6(8) . . ?
C36 C37 H37 120.2 . . ?
C38 C37 H37 120.2 . . ?
C39 C38 C37 120.1(8) 2_576 . ?
C38 C39 C40 120.4(7) 2_576 2_576 ?
C38 C39 C42 121.1(8) 2_576 . ?
C40 C39 C42 118.5(8) 2_576 . ?
C41 C40 C39 118.0(9) . 2_576 ?
C36 C41 C40 121.6(8) . . ?
C36 C41 H41 119.2 . . ?
C40 C41 H41 119.2 . . ?
O12 C42 O11 124.7(7) . . ?
O12 C42 C39 118.4(8) . . ?
O11 C42 C39 116.9(8) . . ?
H12A O12W H12B 109.5 . . ?
H17A O17W H17B 109.4 . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N5 Co1 N1 C8 -179.3(6) . . . . ?
N2 Co1 N1 C8 1.6(6) . . . . ?
N3 Co1 N1 C8 1.7(14) . . . . ?
N6 Co1 N1 C8 -96.7(6) . . . . ?
N4 Co1 N1 C8 99.0(6) . . . . ?
N5 Co1 N1 C5 -3.4(6) . . . . ?
N2 Co1 N1 C5 177.4(6) . . . . ?
N3 Co1 N1 C5 177.5(9) . . . . ?
N6 Co1 N1 C5 79.1(6) . . . . ?
N4 Co1 N1 C5 -85.2(6) . . . . ?
O11 Tb1 C1 O5 -99.7(5) . . . . ?
O1W Tb1 C1 O5 115.5(5) . . . . ?
O3W Tb1 C1 O5 131(4) . . . . ?
O5W Tb1 C1 O5 -172.7(5) . . . . ?
O2W Tb1 C1 O5 43.1(5) . . . . ?
O4W Tb1 C1 O5 -29.4(6) . . . . ?
O6 Tb1 C1 O5 172.8(9) . . . . ?
O11 Tb1 C1 O6 87.5(5) . . . . ?
O1W Tb1 C1 O6 -57.3(5) . . . . ?
O3W Tb1 C1 O6 -42(4) . . . . ?
O5W Tb1 C1 O6 14.5(5) . . . . ?
O2W Tb1 C1 O6 -129.6(5) . . . . ?
O5 Tb1 C1 O6 -172.8(9) . . . . ?
O4W Tb1 C1 O6 157.8(5) . . . . ?
O11 Tb1 C1 C2 11(6) . . . . ?
O1W Tb1 C1 C2 -134(6) . . . . ?
O3W Tb1 C1 C2 -119(5) . . . . ?
O5W Tb1 C1 C2 -62(6) . . . . ?
O2W Tb1 C1 C2 154(6) . . . . ?
O5 Tb1 C1 C2 110(6) . . . . ?
O4W Tb1 C1 C2 81(6) . . . . ?
O6 Tb1 C1 C2 -77(6) . . . . ?
N5 Co1 N2 C13 145(11) . . . . ?
N3 Co1 N2 C13 -0.7(6) . . . . ?
N1 Co1 N2 C13 179.3(7) . . . . ?
N6 Co1 N2 C13 -92.1(7) . . . . ?
N4 Co1 N2 C13 88.2(7) . . . . ?
N5 Co1 N2 C9 -36(12) . . . . ?
N3 Co1 N2 C9 178.6(7) . . . . ?
N1 Co1 N2 C9 -1.5(6) . . . . ?
N6 Co1 N2 C9 87.2(6) . . . . ?
N4 Co1 N2 C9 -92.6(6) . . . . ?
O5 C1 C2 C7 -163.8(9) . . . . ?
O6 C1 C2 C7 15.6(13) . . . . ?
Tb1 C1 C2 C7 89(6) . . . . ?
O5 C1 C2 C3 12.4(13) . . . . ?
O6 C1 C2 C3 -168.2(8) . . . . ?
Tb1 C1 C2 C3 -95(6) . . . . ?
N5 Co1 N3 C14 -172.9(6) . . . . ?
N2 Co1 N3 C14 6.3(6) . . . . ?
N1 Co1 N3 C14 6.1(14) . . . . ?
N6 Co1 N3 C14 104.1(6) . . . . ?
N4 Co1 N3 C14 -91.5(6) . . . . ?
N5 Co1 N3 C15 -2.7(7) . . . . ?
N2 Co1 N3 C15 176.5(7) . . . . ?
N1 Co1 N3 C15 176.3(8) . . . . ?
N6 Co1 N3 C15 -85.7(6) . . . . ?
N4 Co1 N3 C15 78.7(6) . . . . ?
C7 C2 C3 C4 -0.5(14) . . . . ?
C1 C2 C3 C4 -176.8(8) . . . . ?
N5 Co1 N4 C29 2.8(6) . . . . ?
N2 Co1 N4 C29 -178.4(6) . . . . ?
N3 Co1 N4 C29 -96.8(6) . . . . ?
N1 Co1 N4 C29 99.7(6) . . . . ?
N6 Co1 N4 C29 2.6(15) . . . . ?
N5 Co1 N4 C26 -173.3(8) . . . . ?
N2 Co1 N4 C26 5.5(8) . . . . ?
N3 Co1 N4 C26 87.1(7) . . . . ?
N1 Co1 N4 C26 -76.4(7) . . . . ?
N6 Co1 N4 C26 -173.5(10) . . . . ?
C2 C3 C4 C5 3.3(14) . . . . ?
O6 C1 O5 Tb1 7.2(9) . . . . ?
C2 C1 O5 Tb1 -173.3(7) . . . . ?
O11 Tb1 O5 C1 77.0(5) . . . . ?
O1W Tb1 O5 C1 -68.0(5) . . . . ?
O3W Tb1 O5 C1 -173.9(5) . . . . ?
O5W Tb1 O5 C1 9.2(6) . . . . ?
O2W Tb1 O5 C1 -135.5(6) . . . . ?
O4W Tb1 O5 C1 152.3(5) . . . . ?
O6 Tb1 O5 C1 -4.0(5) . . . . ?
N2 Co1 N5 C34 118(11) . . . . ?
N3 Co1 N5 C34 -96.0(7) . . . . ?
N1 Co1 N5 C34 84.3(7) . . . . ?
N6 Co1 N5 C34 -4.6(7) . . . . ?
N4 Co1 N5 C34 175.5(7) . . . . ?
N2 Co1 N5 C30 -57(11) . . . . ?
N3 Co1 N5 C30 88.3(7) . . . . ?
N1 Co1 N5 C30 -91.5(7) . . . . ?
N6 Co1 N5 C30 179.6(7) . . . . ?
N4 Co1 N5 C30 -0.3(7) . . . . ?
C3 C4 C5 C6 -4.9(13) . . . . ?
C3 C4 C5 N1 169.2(7) . . . . ?
C8 N1 C5 C6 -101.8(10) . . . . ?
Co1 N1 C5 C6 82.5(9) . . . . ?
C8 N1 C5 C4 84.2(11) . . . . ?
Co1 N1 C5 C4 -91.5(8) . . . . ?
O5 C1 O6 Tb1 -7.2(9) . . . . ?
C2 C1 O6 Tb1 173.3(7) . . . . ?
O11 Tb1 O6 C1 -87.8(5) . . . . ?
O1W Tb1 O6 C1 120.7(5) . . . . ?
O3W Tb1 O6 C1 175.4(5) . . . . ?
O5W Tb1 O6 C1 -165.5(5) . . . . ?
O2W Tb1 O6 C1 55.7(5) . . . . ?
O5 Tb1 O6 C1 4.0(5) . . . . ?
O4W Tb1 O6 C1 -29.4(6) . . . . ?
N5 Co1 N6 C35 4.5(7) . . . . ?
N2 Co1 N6 C35 -174.3(7) . . . . ?
N3 Co1 N6 C35 103.7(7) . . . . ?
N1 Co1 N6 C35 -92.7(7) . . . . ?
N4 Co1 N6 C35 4.7(15) . . . . ?
N5 Co1 N6 C36 -172.0(7) . . . . ?
N2 Co1 N6 C36 9.2(7) . . . . ?
N3 Co1 N6 C36 -72.8(7) . . . . ?
N1 Co1 N6 C36 90.7(7) . . . . ?
N4 Co1 N6 C36 -171.8(9) . . . . ?
C4 C5 C6 C7 3.7(13) . . . . ?
N1 C5 C6 C7 -170.3(8) . . . . ?
C3 C2 C7 C6 -0.7(14) . . . . ?
C1 C2 C7 C6 175.6(8) . . . . ?
C5 C6 C7 C2 -1.0(14) . . . . ?
C5 N1 C8 O2 0.5(14) . . . . ?
Co1 N1 C8 O2 176.5(8) . . . . ?
C5 N1 C8 C9 -177.3(7) . . . . ?
Co1 N1 C8 C9 -1.3(10) . . . . ?
C13 N2 C9 C10 2.5(13) . . . . ?
Co1 N2 C9 C10 -176.7(7) . . . . ?
C13 N2 C9 C8 -179.6(8) . . . . ?
Co1 N2 C9 C8 1.1(10) . . . . ?
O2 C8 C9 N2 -177.8(8) . . . . ?
N1 C8 C9 N2 0.1(11) . . . . ?
O2 C8 C9 C10 -0.1(16) . . . . ?
N1 C8 C9 C10 177.8(9) . . . . ?
N2 C9 C10 C11 -1.1(15) . . . . ?
C8 C9 C10 C11 -178.6(9) . . . . ?
O1W Tb1 O11 C42 172(15) . . . . ?
O3W Tb1 O11 C42 -91(15) . . . . ?
O5W Tb1 O11 C42 -162(15) . . . . ?
O2W Tb1 O11 C42 6(15) . . . . ?
O5 Tb1 O11 C42 66(15) . . . . ?
O4W Tb1 O11 C42 -21(15) . . . . ?
O6 Tb1 O11 C42 119(15) . . . . ?
C1 Tb1 O11 C42 92(15) . . . . ?
C9 C10 C11 C12 -1.1(17) . . . . ?
C10 C11 C12 C13 1.9(16) . . . . ?
C9 N2 C13 C12 -1.7(13) . . . . ?
Co1 N2 C13 C12 177.6(7) . . . . ?
C9 N2 C13 C14 176.6(8) . . . . ?
Co1 N2 C13 C14 -4.2(10) . . . . ?
C11 C12 C13 N2 -0.6(14) . . . . ?
C11 C12 C13 C14 -178.5(9) . . . . ?
C15 N3 C14 O1 -0.1(14) . . . . ?
Co1 N3 C14 O1 170.3(8) . . . . ?
C15 N3 C14 C13 -180.0(7) . . . . ?
Co1 N3 C14 C13 -9.6(9) . . . . ?
N2 C13 C14 O1 -171.1(8) . . . . ?
C12 C13 C14 O1 7.0(15) . . . . ?
N2 C13 C14 N3 8.8(11) . . . . ?
C12 C13 C14 N3 -173.1(9) . . . . ?
C14 N3 C15 C16 -114.3(9) . . . . ?
Co1 N3 C15 C16 75.9(9) . . . . ?
C14 N3 C15 C20 68.7(11) . . . . ?
Co1 N3 C15 C20 -101.1(9) . . . . ?
C20 C15 C16 C17 -1.5(13) . . . . ?
N3 C15 C16 C17 -178.6(7) . . . . ?
C15 C16 C17 C18 -0.9(13) . . . . ?
C16 C17 C18 C19 2.2(13) . . . . ?
C16 C17 C18 C21 -174.8(8) . . . . ?
C17 C18 C19 C20 -1.2(14) . . . . ?
C21 C18 C19 C20 175.9(8) . . . . ?
C18 C19 C20 C15 -1.3(14) . . . . ?
C16 C15 C20 C19 2.5(13) . . . . ?
N3 C15 C20 C19 179.6(8) . . . . ?
C19 C18 C21 O8 -4.4(15) . . . . ?
C17 C18 C21 O8 172.6(9) . . . . ?
C19 C18 C21 O7 176.3(9) . . . . ?
C17 C18 C21 O7 -6.7(13) . . . . ?
O10 C22 C23 C24 18.1(13) . . . . ?
O9 C22 C23 C24 -161.4(8) . . . . ?
O10 C22 C23 C28 -163.1(8) . . . . ?
O9 C22 C23 C28 17.4(12) . . . . ?
C28 C23 C24 C25 -0.3(13) . . . . ?
C22 C23 C24 C25 178.4(7) . . . . ?
C23 C24 C25 C26 2.0(13) . . . . ?
C24 C25 C26 C27 -2.2(12) . . . . ?
C24 C25 C26 N4 170.2(7) . . . . ?
C29 N4 C26 C25 108.1(9) . . . . ?
Co1 N4 C26 C25 -76.0(10) . . . . ?
C29 N4 C26 C27 -79.6(11) . . . . ?
Co1 N4 C26 C27 96.3(8) . . . . ?
C25 C26 C27 C28 0.7(13) . . . . ?
N4 C26 C27 C28 -171.8(7) . . . . ?
C24 C23 C28 C27 -1.1(13) . . . . ?
C22 C23 C28 C27 -179.9(8) . . . . ?
C26 C27 C28 C23 0.9(13) . . . . ?
C26 N4 C29 O4 -4.1(14) . . . . ?
Co1 N4 C29 O4 179.7(7) . . . . ?
C26 N4 C29 C30 171.8(8) . . . . ?
Co1 N4 C29 C30 -4.4(9) . . . . ?
C34 N5 C30 C31 0.3(13) . . . . ?
Co1 N5 C30 C31 175.9(7) . . . . ?
C34 N5 C30 C29 -177.5(8) . . . . ?
Co1 N5 C30 C29 -1.9(10) . . . . ?
O4 C29 C30 N5 -179.7(8) . . . . ?
N4 C29 C30 N5 4.1(11) . . . . ?
O4 C29 C30 C31 2.7(15) . . . . ?
N4 C29 C30 C31 -173.4(9) . . . . ?
N5 C30 C31 C32 -0.4(14) . . . . ?
C29 C30 C31 C32 177.0(9) . . . . ?
C30 C31 C32 C33 -0.2(16) . . . . ?
C31 C32 C33 C34 0.8(16) . . . . ?
C30 N5 C34 C33 0.4(14) . . . . ?
Co1 N5 C34 C33 -175.2(7) . . . . ?
C30 N5 C34 C35 179.4(8) . . . . ?
Co1 N5 C34 C35 3.8(10) . . . . ?
C32 C33 C34 N5 -0.9(14) . . . . ?
C32 C33 C34 C35 -179.8(9) . . . . ?
C36 N6 C35 O3 -5.0(15) . . . . ?
Co1 N6 C35 O3 178.2(8) . . . . ?
C36 N6 C35 C34 173.2(7) . . . . ?
Co1 N6 C35 C34 -3.6(10) . . . . ?
N5 C34 C35 O3 178.4(9) . . . . ?
C33 C34 C35 O3 -2.7(15) . . . . ?
N5 C34 C35 N6 0.1(11) . . . . ?
C33 C34 C35 N6 179.0(9) . . . . ?
C35 N6 C36 C41 -79.3(11) . . . . ?
Co1 N6 C36 C41 97.0(9) . . . . ?
C35 N6 C36 C37 105.1(10) . . . . ?
Co1 N6 C36 C37 -78.5(10) . . . . ?
C41 C36 C37 C38 1.6(14) . . . . ?
N6 C36 C37 C38 177.1(8) . . . . ?
C36 C37 C38 C39 3.0(15) . . . 2_576 ?
C37 C36 C41 C40 -5.5(14) . . . . ?
N6 C36 C41 C40 179.0(8) . . . . ?
C39 C40 C41 C36 4.8(14) 2_576 . . . ?
Tb1 O11 C42 O12 140(15) . . . . ?
Tb1 O11 C42 C39 -39(16) . . . . ?
C38 C39 C42 O12 168.3(9) 2_576 . . . ?
C40 C39 C42 O12 -10.9(13) 2_576 . . . ?
C38 C39 C42 O11 -12.8(13) 2_576 . . . ?
C40 C39 C42 O11 168.0(8) 2_576 . . . ?

_diffrn_measured_fraction_theta_max 0.990
_diffrn_reflns_theta_full        26.00
_diffrn_measured_fraction_theta_full 0.990
_refine_diff_density_max         1.687
_refine_diff_density_min         -1.084
_refine_diff_density_rms         0.156
