# Electronic Supplementary Material (ESI) for CrystEngComm.
# This journal is © The Royal Society of Chemistry 2020

####################################################################### 
# 
# 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_c_sq_sq
_database_code_depnum_ccdc_archive 'CCDC 1904347'
_audit_update_record             
;
2020-05-20 deposited with the CCDC.	2020-07-06 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C122 H96 Eu6 N22 O42'
_chemical_formula_weight         3453.96

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'
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'
H H 0.0000 0.0000 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

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

_cell_length_a                   14.5204(11)
_cell_length_b                   18.1195(13)
_cell_length_c                   26.1720(19)
_cell_angle_alpha                90
_cell_angle_beta                 104.0710(10)
_cell_angle_gamma                90
_cell_volume                     6679.3(8)
_cell_formula_units_Z            2
_cell_measurement_temperature    296(2)
_cell_measurement_reflns_used    9980
_cell_measurement_theta_min      2.3869
_cell_measurement_theta_max      23.8922

_exptl_crystal_description       block
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.717
_exptl_crystal_F_000             3392
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_absorpt_coefficient_mu    2.864
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   none
_exptl_absorpt_correction_T_min  ?
_exptl_absorpt_correction_T_max  ?
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      296(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'Enhance (Mo) X-ray Source'
_diffrn_measurement_device_type  graphite
_diffrn_measurement_method       'Xcalibur, Eos'
_diffrn_detector_area_resol_mean 'phi and omega scans'
_diffrn_reflns_number            40257
_diffrn_reflns_av_unetI/netI     0.0415
_diffrn_reflns_av_R_equivalents  0.0433
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_theta_min         2.191
_diffrn_reflns_theta_max         23.989
_diffrn_reflns_theta_full        23.989
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 0.997
_reflns_number_total             10439
_reflns_number_gt                8042
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'CrysAlis PRO (Agilent, 2011)'
_computing_cell_refinement       'CrysAlis PRO (Agilent, 2011)'
_computing_data_reduction        'CrysAlis PRO (Agilent, 2011)'
_computing_structure_solution    'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/3 (Sheldrick, 2018)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0361P)²+9.8404P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         10439
_refine_ls_number_parameters     851
_refine_ls_number_restraints     90
_refine_ls_R_factor_all          0.0557
_refine_ls_R_factor_gt           0.0354
_refine_ls_wR_factor_ref         0.0838
_refine_ls_wR_factor_gt          0.0757
_refine_ls_goodness_of_fit_ref   1.077
_refine_ls_restrained_S_all      1.077
_refine_ls_shift/su_max          0.005
_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.68062(2) 0.63408(2) 0.46805(2) 0.02783(9) Uani 1 1 d . . . . .
Eu2 Eu 0.39696(2) 0.63598(2) 0.39075(2) 0.02970(9) Uani 1 1 d . . . . .
Eu3 Eu 0.34330(2) 0.41197(2) 0.38081(2) 0.03014(9) Uani 1 1 d . . . . .
O4 O 0.6245(3) 0.5213(2) 0.41927(15) 0.0369(10) Uani 1 1 d . . . . .
O5 O 0.4669(3) 0.5074(2) 0.39417(15) 0.0336(9) Uani 1 1 d . . . . .
O6 O 0.5583(3) 0.6597(2) 0.38781(14) 0.0339(10) Uani 1 1 d . . . . .
O7 O 0.3225(3) 0.4626(2) 0.46597(14) 0.0320(9) Uani 1 1 d . . . . .
O8 O 0.6977(3) 0.6737(2) 0.55550(14) 0.0333(9) Uani 1 1 d . . . . .
O9 O 0.4886(3) 0.3511(2) 0.52408(15) 0.0335(10) Uani 1 1 d . . . . .
O16 O 0.4825(3) 0.3552(2) 0.43799(15) 0.0396(10) Uani 1 1 d . . . . .
O2 O 0.2899(3) 0.5345(2) 0.35642(15) 0.0389(10) Uani 1 1 d . . . . .
O3 O 0.3226(3) 0.5846(2) 0.45691(15) 0.0382(10) Uani 1 1 d . . . . .
O10 O 0.2537(3) 0.6875(2) 0.34156(17) 0.0463(11) Uani 1 1 d . . . . .
O21 O 0.7628(3) 0.6721(2) 0.40484(15) 0.0425(11) Uani 1 1 d . . . . .
O20 O 0.6659(3) 0.7670(2) 0.47705(17) 0.0486(12) Uani 1 1 d . . . . .
O19 O 0.4260(3) 0.6215(2) 0.30612(15) 0.0424(11) Uani 1 1 d . . . . .
O18 O 0.1763(3) 0.4252(2) 0.36222(16) 0.0428(11) Uani 1 1 d . . . . .
O17 O 0.2924(3) 0.2977(2) 0.33852(16) 0.0454(11) Uani 1 1 d . . . . .
N1 N 0.5771(3) 0.6526(3) 0.33946(18) 0.0345(12) Uani 1 1 d . . . . .
H1B H 0.633224 0.660689 0.335353 0.041 Uiso 1 1 calc R U . . .
N2 N 0.6466(3) 0.2664(3) 0.54059(19) 0.0368(12) Uani 1 1 d . . . . .
N3 N 0.1945(3) 0.5447(3) 0.3452(2) 0.0420(13) Uani 1 1 d . . . . .
H3A H 0.170198 0.587422 0.336202 0.050 Uiso 1 1 calc R U . . .
N4 N 0.6994(4) 0.7484(3) 0.5640(2) 0.0421(13) Uani 1 1 d . . . . .
H4A H 0.709665 0.765839 0.595447 0.051 Uiso 1 1 calc R U . . .
N9 N 0.1917(3) 0.4725(3) 0.52290(19) 0.0331(12) Uani 1 1 d . . . . .
N5 N 0.4871(4) 0.3888(3) 0.33617(19) 0.0398(13) Uani 1 1 d . . . . .
C57 C 0.2121(4) 0.5336(3) 0.4992(2) 0.0316(14) Uani 1 1 d . . . . .
C56 C 0.5990(4) 0.2796(3) 0.4908(2) 0.0347(14) Uani 1 1 d . . . . .
O15 O 0.6860(3) 0.6580(3) 0.27098(18) 0.0643(15) Uani 1 1 d . . . . .
H15B H 0.723529 0.681073 0.258193 0.096 Uiso 1 1 calc R U . . .
C55 C 0.5518(4) 0.4897(3) 0.3939(2) 0.0318(14) Uani 1 1 d . . . . .
C54 C 0.5651(4) 0.4265(3) 0.3594(2) 0.0359(15) Uani 1 1 d . . . . .
C53 C 0.2923(4) 0.5269(3) 0.4721(2) 0.0296(13) Uani 1 1 d . . . . .
N7 N 0.8543(3) 0.6920(3) 0.5056(2) 0.0409(13) Uani 1 1 d . . . . .
C52 C 0.5078(4) 0.6331(3) 0.2992(2) 0.0335(14) Uani 1 1 d . . . . .
N6 N 0.4074(4) 0.7711(3) 0.3558(2) 0.0433(13) Uani 1 1 d . . . . .
O14 O 0.8849(4) 0.7199(3) 0.3788(2) 0.0775(17) Uani 1 1 d . . . . .
C51 C 0.5170(4) 0.3333(3) 0.4835(2) 0.0345(14) Uani 1 1 d . . . . .
O13 O 0.1939(3) 0.2337(3) 0.27534(19) 0.0614(14) Uani 1 1 d . . . . .
N8 N 0.2815(4) 0.4153(3) 0.2779(2) 0.0586(17) Uani 1 1 d . . . . .
C50 C 0.1398(4) 0.4876(4) 0.3484(2) 0.0412(16) Uani 1 1 d . . . . .
C49 C 0.6851(5) 0.7924(4) 0.5234(3) 0.0485(18) Uani 1 1 d . . . . .
O12 O 0.0325(4) 0.6212(3) 0.3522(3) 0.093(2) Uani 1 1 d . . . . .
H12B H -0.004216 0.650848 0.360300 0.139 Uiso 1 1 calc R U . . .
C48 C 0.5244(4) 0.6250(3) 0.2455(2) 0.0365(15) Uani 1 1 d . . . . .
C47 C 0.1661(5) 0.5995(4) 0.5003(3) 0.0502(18) Uani 1 1 d . . . . .
H47A H 0.182050 0.640797 0.483209 0.060 Uiso 1 1 calc R U . . .
C46 C 0.7229(5) 0.2232(3) 0.5477(3) 0.0490(18) Uani 1 1 d . . . . .
H46A H 0.757181 0.213842 0.581962 0.059 Uiso 1 1 calc R U . . .
C45 C 0.4967(5) 0.3318(4) 0.3053(3) 0.057(2) Uani 1 1 d . . . . .
H45A H 0.442707 0.305859 0.288260 0.068 Uiso 1 1 calc R U . . .
C44 C 0.6105(5) 0.6378(4) 0.2324(2) 0.0441(16) Uani 1 1 d . . . . .
C43 C 0.6537(4) 0.4076(4) 0.3537(3) 0.0507(18) Uani 1 1 d . . . . .
H43A H 0.707040 0.434475 0.370522 0.061 Uiso 1 1 calc R U . . .
C42 C 0.8873(4) 0.7263(4) 0.4690(3) 0.0456(17) Uani 1 1 d . . . . .
C41 C 0.8407(5) 0.7063(4) 0.4131(3) 0.0475(18) Uani 1 1 d . . . . .
C40 C 0.3258(5) 0.8002(4) 0.3283(2) 0.0473(17) Uani 1 1 d . . . . .
C39 C 0.6255(5) 0.2499(4) 0.4484(3) 0.0506(18) Uani 1 1 d . . . . .
H39A H 0.590864 0.260431 0.414355 0.061 Uiso 1 1 calc R U . . .
C38 C 0.4834(5) 0.8145(4) 0.3652(3) 0.062(2) Uani 1 1 d . . . . .
H38A H 0.540780 0.795106 0.384312 0.075 Uiso 1 1 calc R U . . .
C37 C 0.0352(4) 0.4946(4) 0.3316(3) 0.0460(17) Uani 1 1 d . . . . .
C36 C 0.2398(5) 0.2892(4) 0.2929(3) 0.0492(18) Uani 1 1 d . . . . .
C35 C 0.3184(6) 0.8726(4) 0.3107(3) 0.070(2) Uani 1 1 d . . . . .
H35A H 0.260132 0.891936 0.292744 0.084 Uiso 1 1 calc R U . . .
C34 C 0.2416(5) 0.7497(4) 0.3175(3) 0.058(2) Uani 1 1 d . . . . .
C33 C 0.8971(4) 0.7051(4) 0.5565(3) 0.0533(19) Uani 1 1 d . . . . .
H33A H 0.877098 0.678634 0.582263 0.064 Uiso 1 1 calc R U . . .
C32 C 0.5393(7) 0.6092(4) 0.1428(3) 0.069(2) Uani 1 1 d . . . . .
H32A H 0.544348 0.604306 0.108168 0.082 Uiso 1 1 calc R U . . .
C31 C 0.1244(4) 0.4777(4) 0.5494(3) 0.0424(16) Uani 1 1 d . . . . .
H31A H 0.109651 0.436023 0.566603 0.051 Uiso 1 1 calc R U . . .
C30 C 0.9606(5) 0.7779(4) 0.4818(4) 0.071(2) Uani 1 1 d . . . . .
H30A H 0.982839 0.801550 0.455624 0.086 Uiso 1 1 calc R U . . .
C29 C -0.0154(5) 0.5593(4) 0.3328(3) 0.058(2) Uani 1 1 d . . . . .
O11 O 0.1683(4) 0.7690(4) 0.2866(3) 0.132(3) Uani 1 1 d . . . . .
C28 C 0.0754(5) 0.5424(4) 0.5526(3) 0.0539(19) Uani 1 1 d . . . . .
H28A H 0.029270 0.544129 0.571778 0.065 Uiso 1 1 calc R U . . .
C27 C 0.6172(6) 0.6290(4) 0.1807(3) 0.057(2) Uani 1 1 d . . . . .
H27A H 0.674964 0.636605 0.172074 0.068 Uiso 1 1 calc R U . . .
C26 C -0.0147(5) 0.4302(4) 0.3150(3) 0.061(2) Uani 1 1 d . . . . .
H26A H 0.018360 0.386178 0.315126 0.073 Uiso 1 1 calc R U . . .
C25 C 0.4465(5) 0.6050(4) 0.2054(3) 0.0535(19) Uani 1 1 d . . . . .
H25A H 0.388148 0.597114 0.213224 0.064 Uiso 1 1 calc R U . . .
C24 C 0.2403(6) 0.3524(4) 0.2559(3) 0.064(2) Uani 1 1 d . . . . .
C23 C 0.4540(6) 0.5965(5) 0.1542(3) 0.066(2) Uani 1 1 d . . . . .
H23A H 0.401643 0.582308 0.127864 0.080 Uiso 1 1 calc R U . . .
C22 C 0.6615(6) 0.3471(4) 0.3220(3) 0.064(2) Uani 1 1 d . . . . .
H22A H 0.720586 0.332737 0.317612 0.077 Uiso 1 1 calc R U . . .
C21 C 0.5832(6) 0.3099(4) 0.2979(3) 0.065(2) Uani 1 1 d . . . . .
H21A H 0.587299 0.269816 0.276422 0.078 Uiso 1 1 calc R U . . .
C20 C 0.0961(5) 0.6032(4) 0.5272(3) 0.062(2) Uani 1 1 d . . . . .
H20A H 0.063116 0.646973 0.528048 0.074 Uiso 1 1 calc R U . . .
C19 C 0.7535(5) 0.1918(4) 0.5069(3) 0.064(2) Uani 1 1 d . . . . .
H19A H 0.807373 0.162206 0.513492 0.076 Uiso 1 1 calc R U . . .
C18 C 0.7024(6) 0.2054(4) 0.4563(3) 0.068(2) Uani 1 1 d . . . . .
H18A H 0.720490 0.184156 0.427837 0.082 Uiso 1 1 calc R U . . .
C17 C 0.4822(7) 0.8869(4) 0.3483(4) 0.076(3) Uani 1 1 d . . . . .
H17A H 0.537182 0.915278 0.356102 0.091 Uiso 1 1 calc R U . . .
C16 C 0.9991(6) 0.7931(5) 0.5342(4) 0.077(3) Uani 1 1 d . . . . .
H16A H 1.045828 0.829028 0.543795 0.092 Uiso 1 1 calc R U . . .
C15 C -0.1148(5) 0.5593(5) 0.3164(3) 0.074(2) Uani 1 1 d . . . . .
H15A H -0.149044 0.602394 0.317564 0.089 Uiso 1 1 calc R U . . .
C14 C 0.9686(5) 0.7554(5) 0.5722(3) 0.072(2) Uani 1 1 d . . . . .
H14A H 0.995653 0.763658 0.607744 0.086 Uiso 1 1 calc R U . . .
C13 C 0.3996(7) 0.9153(4) 0.3204(3) 0.077(3) Uani 1 1 d . . . . .
H13A H 0.397175 0.963441 0.307757 0.092 Uiso 1 1 calc R U . . .
C12 C 0.2857(8) 0.4710(5) 0.2468(3) 0.113(4) Uani 1 1 d . . . . .
H12A H 0.311081 0.515252 0.261890 0.136 Uiso 1 1 calc R U . . .
C11 C 0.2088(9) 0.3436(6) 0.2023(3) 0.128(5) Uani 1 1 d . . . . .
H11A H 0.181605 0.299479 0.187881 0.153 Uiso 1 1 calc R U . . .
C10 C -0.1114(6) 0.4300(5) 0.2984(4) 0.085(3) Uani 1 1 d . . . . .
H10A H -0.143715 0.386342 0.287125 0.101 Uiso 1 1 calc R U . . .
C9 C -0.1607(6) 0.4947(6) 0.2984(4) 0.087(3) Uani 1 1 d . . . . .
H9A H -0.226407 0.494733 0.286078 0.105 Uiso 1 1 calc R U . . .
C8 C 0.2190(12) 0.4032(7) 0.1701(4) 0.188(8) Uani 1 1 d . . . . .
H8A H 0.201593 0.399016 0.133600 0.226 Uiso 1 1 calc R U . . .
C7 C 0.2552(12) 0.4675(7) 0.1938(4) 0.199(9) Uani 1 1 d . . . . .
H7A H 0.258755 0.509042 0.173480 0.239 Uiso 1 1 calc R U . . .
O1 O 0.7900(14) 0.8715(8) 0.6076(7) 0.110(7) Uani 0.5 1 d D U P A 1
H1C H 0.820883 0.898991 0.630295 0.165 Uiso 0.5 1 calc R U P A 1
C6 C 0.5873(11) 0.9879(8) 0.5025(6) 0.130(9) Uani 0.5 1 d G U P A 1
H6A H 0.540787 1.013925 0.478576 0.156 Uiso 0.5 1 calc R U P A 1
C5 C 0.5991(10) 0.9128(8) 0.4955(5) 0.105(8) Uani 0.5 1 d G U P A 1
H5A H 0.560438 0.888507 0.466856 0.126 Uiso 0.5 1 calc R U P A 1
C4 C 0.6687(10) 0.8739(6) 0.5312(6) 0.041(5) Uani 0.5 1 d G U P A 1
C3 C 0.7265(10) 0.9102(8) 0.5740(6) 0.072(8) Uani 0.5 1 d DG U P A 1
C2 C 0.7147(12) 0.9853(8) 0.5810(6) 0.083(7) Uani 0.5 1 d G U P A 1
H2A H 0.753367 1.009581 0.609606 0.100 Uiso 0.5 1 calc R U P A 1
C1 C 0.6451(13) 1.0242(6) 0.5453(7) 0.119(9) Uani 0.5 1 d G U P A 1
H1A H 0.637253 1.074463 0.549952 0.142 Uiso 0.5 1 calc R U P A 1
C6' C 0.7703(15) 0.9691(10) 0.6008(6) 0.122(9) Uani 0.5 1 d G U P A 2
H6'A H 0.801396 0.985330 0.634285 0.147 Uiso 0.5 1 calc R U P A 2
C5' C 0.7635(14) 0.8940(9) 0.5898(6) 0.106(12) Uani 0.5 1 d G U P A 2
H5'A H 0.790064 0.859964 0.615800 0.127 Uiso 0.5 1 calc R U P A 2
C4' C 0.7171(12) 0.8697(7) 0.5398(7) 0.059(6) Uani 0.5 1 d G U P A 2
C3' C 0.6774(12) 0.9205(10) 0.5008(6) 0.135(11) Uani 0.5 1 d DG U P A 2
C2' C 0.6842(14) 0.9956(9) 0.5119(7) 0.172(13) Uani 0.5 1 d G U P A 2
H2'A H 0.657661 1.029591 0.485857 0.207 Uiso 0.5 1 calc R U P A 2
C1' C 0.7307(15) 1.0199(7) 0.5619(8) 0.189(16) Uani 0.5 1 d G U P A 2
H1'A H 0.735194 1.070144 0.569313 0.226 Uiso 0.5 1 calc R U P A 2
O1' O 0.644(2) 0.9036(9) 0.4513(6) 0.258(16) Uani 0.5 1 d D U P A 2
H1'B H 0.645007 0.858674 0.447703 0.387 Uiso 0.5 1 calc R U 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
Eu1 O8 2.354(4) . ?
Eu1 O21 2.366(4) . ?
Eu1 O20 2.434(4) . ?
Eu1 O4 2.443(4) . ?
Eu1 O6 2.443(4) . ?
Eu1 O7 2.468(4) 3_666 ?
Eu1 O9 2.529(4) 3_666 ?
Eu1 N9 2.647(5) 3_666 ?
Eu1 N7 2.687(5) . ?
Eu1 C49 3.207(7) . ?
Eu1 Eu2 4.1240(5) . ?
Eu1 Eu3 4.1388(5) 3_666 ?
Eu2 O10 2.356(4) . ?
Eu2 O19 2.368(4) . ?
Eu2 O6 2.401(4) . ?
Eu2 O2 2.434(4) . ?
Eu2 O3 2.437(4) . ?
Eu2 O9 2.446(4) 3_666 ?
Eu2 O5 2.534(4) . ?
Eu2 N6 2.631(5) . ?
Eu2 N2 2.704(5) 3_666 ?
Eu2 C52 3.194(6) . ?
Eu2 Eu3 4.1294(5) . ?
Eu3 O18 2.366(4) . ?
Eu3 O17 2.379(4) . ?
Eu3 O2 2.386(4) . ?
Eu3 O16 2.432(4) . ?
Eu3 O8 2.455(4) 3_666 ?
Eu3 O5 2.456(4) . ?
Eu3 O7 2.495(4) . ?
Eu3 N8 2.625(5) . ?
Eu3 N5 2.663(5) . ?
Eu3 C50 3.180(6) . ?
O4 C55 1.242(6) . ?
O5 C55 1.275(7) . ?
O6 N1 1.364(6) . ?
O7 C53 1.268(6) . ?
O8 N4 1.370(6) . ?
O9 C51 1.272(7) . ?
O16 C51 1.239(7) . ?
O2 N3 1.358(6) . ?
O3 C53 1.237(6) . ?
O10 C34 1.283(8) . ?
O21 C41 1.261(7) . ?
O20 C49 1.264(7) . ?
O19 C52 1.261(7) . ?
O18 C50 1.263(7) . ?
O17 C36 1.261(7) . ?
N1 C52 1.316(7) . ?
N2 C46 1.332(7) . ?
N2 C56 1.340(7) . ?
N3 C50 1.320(8) . ?
N4 C49 1.304(8) . ?
N9 C31 1.334(7) . ?
N9 C57 1.338(7) . ?
N5 C54 1.335(7) . ?
N5 C45 1.339(8) . ?
C57 C47 1.371(8) . ?
C57 C53 1.508(8) . ?
C56 C39 1.370(8) . ?
C56 C51 1.513(8) . ?
O15 C44 1.348(7) . ?
C55 C54 1.500(8) . ?
C54 C43 1.373(8) . ?
N7 C42 1.326(8) . ?
N7 C33 1.348(8) . ?
C52 C48 1.491(8) . ?
N6 C38 1.328(8) . ?
N6 C40 1.335(8) . ?
O14 C41 1.249(7) . ?
O13 C36 1.233(7) . ?
N8 C12 1.307(9) . ?
N8 C24 1.349(9) . ?
C50 C37 1.480(8) . ?
C49 C4' 1.504(14) . ?
C49 C4 1.518(12) . ?
O12 C29 1.351(8) . ?
C48 C25 1.392(9) . ?
C48 C44 1.393(9) . ?
C47 C20 1.371(9) . ?
C46 C19 1.374(9) . ?
C45 C21 1.374(10) . ?
C44 C27 1.390(9) . ?
C43 C22 1.396(9) . ?
C42 C30 1.395(9) . ?
C42 C41 1.501(9) . ?
C40 C35 1.387(9) . ?
C40 C34 1.498(9) . ?
C39 C18 1.353(9) . ?
C38 C17 1.382(10) . ?
C37 C26 1.388(9) . ?
C37 C29 1.389(9) . ?
C36 C24 1.502(10) . ?
C35 C13 1.382(11) . ?
C34 O11 1.220(8) . ?
C33 C14 1.366(10) . ?
C32 C27 1.359(10) . ?
C32 C23 1.363(11) . ?
C31 C28 1.383(9) . ?
C30 C16 1.378(11) . ?
C29 C15 1.402(10) . ?
C28 C20 1.358(10) . ?
C26 C10 1.365(10) . ?
C25 C23 1.378(9) . ?
C24 C11 1.375(10) . ?
C22 C21 1.340(10) . ?
C19 C18 1.375(10) . ?
C17 C13 1.346(11) . ?
C16 C14 1.365(11) . ?
C15 C9 1.372(11) . ?
C12 C7 1.350(12) . ?
C11 C8 1.398(13) . ?
C10 C9 1.374(12) . ?
C8 C7 1.365(14) . ?
O1 C3 1.312(18) . ?
C6 C5 1.3900 . ?
C6 C1 1.3900 . ?
C5 C4 1.3900 . ?
C4 C3 1.3900 . ?
C3 C2 1.3900 . ?
C2 C1 1.3900 . ?
C6' C5' 1.3900 . ?
C6' C1' 1.3900 . ?
C5' C4' 1.3900 . ?
C4' C3' 1.3900 . ?
C3' O1' 1.306(15) . ?
C3' C2' 1.3900 . ?
C2' C1' 1.3900 . ?

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
O8 Eu1 O21 129.72(14) . . ?
O8 Eu1 O20 66.10(13) . . ?
O21 Eu1 O20 81.39(15) . . ?
O8 Eu1 O4 134.97(13) . . ?
O21 Eu1 O4 92.25(14) . . ?
O20 Eu1 O4 148.49(14) . . ?
O8 Eu1 O6 131.35(13) . . ?
O21 Eu1 O6 74.26(13) . . ?
O20 Eu1 O6 80.37(14) . . ?
O4 Eu1 O6 68.23(13) . . ?
O8 Eu1 O7 63.38(12) . 3_666 ?
O21 Eu1 O7 142.59(13) . 3_666 ?
O20 Eu1 O7 128.14(13) . 3_666 ?
O4 Eu1 O7 73.22(13) . 3_666 ?
O6 Eu1 O7 127.09(12) . 3_666 ?
O8 Eu1 O9 76.32(13) . 3_666 ?
O21 Eu1 O9 133.73(13) . 3_666 ?
O20 Eu1 O9 77.13(14) . 3_666 ?
O4 Eu1 O9 85.65(12) . 3_666 ?
O6 Eu1 O9 62.09(12) . 3_666 ?
O7 Eu1 O9 80.50(12) 3_666 3_666 ?
O8 Eu1 N9 103.28(14) . 3_666 ?
O21 Eu1 N9 79.25(15) . 3_666 ?
O20 Eu1 N9 142.08(15) . 3_666 ?
O4 Eu1 N9 64.78(13) . 3_666 ?
O6 Eu1 N9 124.23(14) . 3_666 ?
O7 Eu1 N9 63.35(13) 3_666 3_666 ?
O9 Eu1 N9 138.02(13) 3_666 3_666 ?
O8 Eu1 N7 69.96(14) . . ?
O21 Eu1 N7 63.50(15) . . ?
O20 Eu1 N7 71.03(15) . . ?
O4 Eu1 N7 133.00(14) . . ?
O6 Eu1 N7 131.44(15) . . ?
O7 Eu1 N7 101.33(14) 3_666 . ?
O9 Eu1 N7 140.59(14) 3_666 . ?
N9 Eu1 N7 71.18(15) 3_666 . ?
O8 Eu1 C49 45.72(15) . . ?
O21 Eu1 C49 95.57(16) . . ?
O20 Eu1 C49 20.62(15) . . ?
O4 Eu1 C49 162.21(16) . . ?
O6 Eu1 C49 98.58(16) . . ?
O7 Eu1 C49 108.69(15) 3_666 . ?
O9 Eu1 C49 77.39(15) 3_666 . ?
N9 Eu1 C49 132.45(17) 3_666 . ?
N7 Eu1 C49 64.62(17) . . ?
O8 Eu1 Eu2 109.34(9) . . ?
O21 Eu1 Eu2 105.55(10) . . ?
O20 Eu1 Eu2 86.48(11) . . ?
O4 Eu1 Eu2 65.42(9) . . ?
O6 Eu1 Eu2 31.33(9) . . ?
O7 Eu1 Eu2 99.39(8) 3_666 . ?
O9 Eu1 Eu2 33.38(8) 3_666 . ?
N9 Eu1 Eu2 130.11(10) 3_666 . ?
N7 Eu1 Eu2 155.88(11) . . ?
C49 Eu1 Eu2 97.03(13) . . ?
O8 Eu1 Eu3 31.33(9) . 3_666 ?
O21 Eu1 Eu3 154.27(10) . 3_666 ?
O20 Eu1 Eu3 94.44(10) . 3_666 ?
O4 Eu1 Eu3 103.65(10) . 3_666 ?
O6 Eu1 Eu3 130.35(9) . 3_666 ?
O7 Eu1 Eu3 33.70(9) 3_666 3_666 ?
O9 Eu1 Eu3 68.58(8) 3_666 3_666 ?
N9 Eu1 Eu3 89.27(10) 3_666 3_666 ?
N7 Eu1 Eu3 91.06(11) . 3_666 ?
C49 Eu1 Eu3 75.27(13) . 3_666 ?
Eu2 Eu1 Eu3 99.482(9) . 3_666 ?
O10 Eu2 O19 82.36(15) . . ?
O10 Eu2 O6 130.54(14) . . ?
O19 Eu2 O6 65.97(13) . . ?
O10 Eu2 O2 72.44(14) . . ?
O19 Eu2 O2 79.29(14) . . ?
O6 Eu2 O2 131.58(13) . . ?
O10 Eu2 O3 93.15(14) . . ?
O19 Eu2 O3 146.38(14) . . ?
O6 Eu2 O3 134.04(13) . . ?
O2 Eu2 O3 67.68(13) . . ?
O10 Eu2 O9 140.68(14) . 3_666 ?
O19 Eu2 O9 128.82(13) . 3_666 ?
O6 Eu2 O9 63.91(12) . 3_666 ?
O2 Eu2 O9 129.79(13) . 3_666 ?
O3 Eu2 O9 73.10(13) . 3_666 ?
O10 Eu2 O5 132.57(13) . . ?
O19 Eu2 O5 76.73(13) . . ?
O6 Eu2 O5 77.28(12) . . ?
O2 Eu2 O5 62.16(12) . . ?
O3 Eu2 O5 82.33(13) . . ?
O9 Eu2 O5 83.00(12) 3_666 . ?
O10 Eu2 N6 63.85(15) . . ?
O19 Eu2 N6 74.91(15) . . ?
O6 Eu2 N6 71.53(15) . . ?
O2 Eu2 N6 131.35(14) . . ?
O3 Eu2 N6 132.48(15) . . ?
O9 Eu2 N6 98.25(14) 3_666 . ?
O5 Eu2 N6 144.24(15) . . ?
O10 Eu2 N2 77.64(15) . 3_666 ?
O19 Eu2 N2 144.86(14) . 3_666 ?
O6 Eu2 N2 106.97(14) . 3_666 ?
O2 Eu2 N2 120.54(14) . 3_666 ?
O3 Eu2 N2 64.04(14) . 3_666 ?
O9 Eu2 N2 63.16(14) 3_666 3_666 ?
O5 Eu2 N2 137.25(13) . 3_666 ?
N6 Eu2 N2 70.39(15) . 3_666 ?
O10 Eu2 C52 97.78(15) . . ?
O19 Eu2 C52 19.95(14) . . ?
O6 Eu2 C52 46.02(14) . . ?
O2 Eu2 C52 95.96(14) . . ?
O3 Eu2 C52 156.56(14) . . ?
O9 Eu2 C52 109.29(14) 3_666 . ?
O5 Eu2 C52 74.99(13) . . ?
N6 Eu2 C52 70.89(15) . . ?
N2 Eu2 C52 138.66(15) 3_666 . ?
O10 Eu2 Eu1 156.19(10) . . ?
O19 Eu2 Eu1 94.26(10) . . ?
O6 Eu2 Eu1 31.95(9) . . ?
O2 Eu2 Eu1 130.28(9) . . ?
O3 Eu2 Eu1 102.14(9) . . ?
O9 Eu2 Eu1 34.67(9) 3_666 . ?
O5 Eu2 Eu1 68.35(8) . . ?
N6 Eu2 Eu1 92.47(11) . . ?
N2 Eu2 Eu1 92.66(10) 3_666 . ?
C52 Eu2 Eu1 75.09(11) . . ?
O10 Eu2 Eu3 103.13(10) . . ?
O19 Eu2 Eu3 84.62(10) . . ?
O6 Eu2 Eu3 110.15(9) . . ?
O2 Eu2 Eu3 30.72(9) . . ?
O3 Eu2 Eu3 63.88(9) . . ?
O9 Eu2 Eu3 103.15(9) 3_666 . ?
O5 Eu2 Eu3 33.55(8) . . ?
N6 Eu2 Eu3 156.78(11) . . ?
N2 Eu2 Eu3 127.87(10) 3_666 . ?
C52 Eu2 Eu3 93.36(11) . . ?
Eu1 Eu2 Eu3 99.981(8) . . ?
O18 Eu3 O17 78.83(15) . . ?
O18 Eu3 O2 66.47(13) . . ?
O17 Eu3 O2 129.89(14) . . ?
O18 Eu3 O16 145.74(14) . . ?
O17 Eu3 O16 92.04(14) . . ?
O2 Eu3 O16 136.50(13) . . ?
O18 Eu3 O8 78.36(13) . 3_666 ?
O17 Eu3 O8 70.51(13) . 3_666 ?
O2 Eu3 O8 130.80(13) . 3_666 ?
O16 Eu3 O8 67.50(13) . 3_666 ?
O18 Eu3 O5 129.39(13) . . ?
O17 Eu3 O5 144.36(14) . . ?
O2 Eu3 O5 63.98(12) . . ?
O16 Eu3 O5 74.98(13) . . ?
O8 Eu3 O5 129.67(12) 3_666 . ?
O18 Eu3 O7 78.81(13) . . ?
O17 Eu3 O7 130.10(13) . . ?
O2 Eu3 O7 78.18(13) . . ?
O16 Eu3 O7 82.46(12) . . ?
O8 Eu3 O7 61.58(12) 3_666 . ?
O5 Eu3 O7 81.77(12) . . ?
O18 Eu3 N8 73.10(17) . . ?
O17 Eu3 N8 63.43(17) . . ?
O2 Eu3 N8 72.32(17) . . ?
O16 Eu3 N8 131.82(17) . . ?
O8 Eu3 N8 129.24(15) 3_666 . ?
O5 Eu3 N8 100.68(15) . . ?
O7 Eu3 N8 145.37(17) . . ?
O18 Eu3 N5 143.09(15) . . ?
O17 Eu3 N5 81.16(15) . . ?
O2 Eu3 N5 105.53(15) . . ?
O16 Eu3 N5 65.16(14) . . ?
O8 Eu3 N5 122.94(14) 3_666 . ?
O5 Eu3 N5 63.23(14) . . ?
O7 Eu3 N5 136.72(13) . . ?
N8 Eu3 N5 70.25(18) . . ?
O18 Eu3 C50 20.28(15) . . ?
O17 Eu3 C50 95.03(16) . . ?
O2 Eu3 C50 46.19(15) . . ?
O16 Eu3 C50 157.82(14) . . ?
O8 Eu3 C50 95.18(15) 3_666 . ?
O5 Eu3 C50 109.53(15) . . ?
O7 Eu3 C50 76.90(14) . . ?
N8 Eu3 C50 69.69(18) . . ?
N5 Eu3 C50 136.75(16) . . ?
O18 Eu3 Eu2 94.66(10) . . ?
O17 Eu3 Eu2 156.53(10) . . ?
O2 Eu3 Eu2 31.41(9) . . ?
O16 Eu3 Eu2 105.14(10) . . ?
O8 Eu3 Eu2 130.71(8) 3_666 . ?
O5 Eu3 Eu2 34.76(9) . . ?
O7 Eu3 Eu2 69.17(9) . . ?
N8 Eu3 Eu2 93.10(13) . . ?
N5 Eu3 Eu2 91.53(11) . . ?
C50 Eu3 Eu2 75.07(12) . . ?
O18 Eu3 Eu1 84.10(10) . 3_666 ?
O17 Eu3 Eu1 100.40(10) . 3_666 ?
O2 Eu3 Eu1 110.24(10) . 3_666 ?
O16 Eu3 Eu1 64.97(9) . 3_666 ?
O8 Eu3 Eu1 29.89(8) 3_666 3_666 ?
O5 Eu3 Eu1 103.54(9) . 3_666 ?
O7 Eu3 Eu1 33.28(9) . 3_666 ?
N8 Eu3 Eu1 153.94(13) . 3_666 ?
N5 Eu3 Eu1 130.13(11) . 3_666 ?
C50 Eu3 Eu1 93.04(11) . 3_666 ?
Eu2 Eu3 Eu1 101.327(9) . 3_666 ?
C55 O4 Eu1 142.9(4) . . ?
C55 O5 Eu3 119.7(3) . . ?
C55 O5 Eu2 127.7(3) . . ?
Eu3 O5 Eu2 111.69(14) . . ?
N1 O6 Eu2 115.5(3) . . ?
N1 O6 Eu1 120.8(3) . . ?
Eu2 O6 Eu1 116.72(14) . . ?
C53 O7 Eu1 119.8(3) . 3_666 ?
C53 O7 Eu3 124.8(3) . . ?
Eu1 O7 Eu3 113.01(15) 3_666 . ?
N4 O8 Eu1 116.9(3) . . ?
N4 O8 Eu3 120.8(3) . 3_666 ?
Eu1 O8 Eu3 118.77(15) . 3_666 ?
C51 O9 Eu2 120.0(3) . 3_666 ?
C51 O9 Eu1 127.9(3) . 3_666 ?
Eu2 O9 Eu1 111.95(15) 3_666 3_666 ?
C51 O16 Eu3 143.9(4) . . ?
N3 O2 Eu3 115.6(3) . . ?
N3 O2 Eu2 120.2(3) . . ?
Eu3 O2 Eu2 117.87(15) . . ?
C53 O3 Eu2 143.6(4) . . ?
C34 O10 Eu2 127.9(4) . . ?
C41 O21 Eu1 127.4(4) . . ?
C49 O20 Eu1 116.7(4) . . ?
C52 O19 Eu2 120.2(4) . . ?
C50 O18 Eu3 119.2(4) . . ?
C36 O17 Eu3 126.5(4) . . ?
C52 N1 O6 118.7(5) . . ?
C46 N2 C56 117.1(5) . . ?
C46 N2 Eu2 127.8(4) . 3_666 ?
C56 N2 Eu2 112.4(4) . 3_666 ?
C50 N3 O2 118.6(5) . . ?
C49 N4 O8 118.6(5) . . ?
C31 N9 C57 117.1(5) . . ?
C31 N9 Eu1 126.3(4) . 3_666 ?
C57 N9 Eu1 114.6(4) . 3_666 ?
C54 N5 C45 117.9(6) . . ?
C54 N5 Eu3 112.9(4) . . ?
C45 N5 Eu3 126.4(4) . . ?
N9 C57 C47 123.1(6) . . ?
N9 C57 C53 115.7(5) . . ?
C47 C57 C53 121.1(5) . . ?
N2 C56 C39 122.5(6) . . ?
N2 C56 C51 116.2(5) . . ?
C39 C56 C51 121.1(6) . . ?
O4 C55 O5 125.3(5) . . ?
O4 C55 C54 117.2(5) . . ?
O5 C55 C54 117.5(5) . . ?
N5 C54 C43 122.5(6) . . ?
N5 C54 C55 116.4(5) . . ?
C43 C54 C55 121.1(5) . . ?
O3 C53 O7 125.1(5) . . ?
O3 C53 C57 117.2(5) . . ?
O7 C53 C57 117.7(5) . . ?
C42 N7 C33 118.0(6) . . ?
C42 N7 Eu1 113.1(4) . . ?
C33 N7 Eu1 126.7(4) . . ?
O19 C52 N1 119.6(5) . . ?
O19 C52 C48 119.5(5) . . ?
N1 C52 C48 120.9(5) . . ?
O19 C52 Eu2 39.8(3) . . ?
N1 C52 Eu2 79.8(3) . . ?
C48 C52 Eu2 159.3(4) . . ?
C38 N6 C40 117.0(6) . . ?
C38 N6 Eu2 127.0(4) . . ?
C40 N6 Eu2 115.8(4) . . ?
O16 C51 O9 125.8(6) . . ?
O16 C51 C56 116.7(5) . . ?
O9 C51 C56 117.5(5) . . ?
C12 N8 C24 117.9(6) . . ?
C12 N8 Eu3 127.0(5) . . ?
C24 N8 Eu3 115.1(5) . . ?
O18 C50 N3 120.1(5) . . ?
O18 C50 C37 119.4(6) . . ?
N3 C50 C37 120.3(6) . . ?
O18 C50 Eu3 40.5(3) . . ?
N3 C50 Eu3 79.6(3) . . ?
C37 C50 Eu3 159.4(5) . . ?
O20 C49 N4 120.9(6) . . ?
O20 C49 C4' 126.4(9) . . ?
N4 C49 C4' 111.1(9) . . ?
O20 C49 C4 118.6(8) . . ?
N4 C49 C4 119.0(8) . . ?
O20 C49 Eu1 42.7(3) . . ?
N4 C49 Eu1 78.6(4) . . ?
C4' C49 Eu1 158.8(8) . . ?
C4 C49 Eu1 160.8(7) . . ?
C25 C48 C44 118.1(6) . . ?
C25 C48 C52 116.7(6) . . ?
C44 C48 C52 125.1(6) . . ?
C20 C47 C57 118.6(6) . . ?
N2 C46 C19 123.4(6) . . ?
N5 C45 C21 122.7(6) . . ?
O15 C44 C27 121.5(6) . . ?
O15 C44 C48 118.5(6) . . ?
C27 C44 C48 120.0(6) . . ?
C54 C43 C22 118.2(6) . . ?
N7 C42 C30 122.0(7) . . ?
N7 C42 C41 115.8(6) . . ?
C30 C42 C41 122.2(7) . . ?
O14 C41 O21 124.8(7) . . ?
O14 C41 C42 117.7(6) . . ?
O21 C41 C42 117.3(6) . . ?
N6 C40 C35 122.7(7) . . ?
N6 C40 C34 116.0(6) . . ?
C35 C40 C34 121.3(7) . . ?
C18 C39 C56 119.7(7) . . ?
N6 C38 C17 123.8(7) . . ?
C26 C37 C29 118.6(6) . . ?
C26 C37 C50 116.2(6) . . ?
C29 C37 C50 125.2(6) . . ?
O13 C36 O17 126.9(7) . . ?
O13 C36 C24 118.0(6) . . ?
O17 C36 C24 115.0(6) . . ?
C13 C35 C40 118.3(8) . . ?
O11 C34 O10 124.8(7) . . ?
O11 C34 C40 119.5(7) . . ?
O10 C34 C40 115.8(6) . . ?
N7 C33 C14 123.3(7) . . ?
C27 C32 C23 121.6(7) . . ?
N9 C31 C28 123.0(6) . . ?
C16 C30 C42 118.3(8) . . ?
O12 C29 C37 118.8(6) . . ?
O12 C29 C15 120.8(7) . . ?
C37 C29 C15 120.3(7) . . ?
C20 C28 C31 118.7(6) . . ?
C32 C27 C44 119.9(7) . . ?
C10 C26 C37 121.4(8) . . ?
C23 C25 C48 121.3(7) . . ?
N8 C24 C11 122.5(7) . . ?
N8 C24 C36 116.1(6) . . ?
C11 C24 C36 121.1(7) . . ?
C32 C23 C25 119.1(7) . . ?
C21 C22 C43 119.5(7) . . ?
C22 C21 C45 119.3(7) . . ?
C28 C20 C47 119.4(7) . . ?
C46 C19 C18 118.3(7) . . ?
C39 C18 C19 119.0(7) . . ?
C13 C17 C38 118.5(8) . . ?
C14 C16 C30 120.0(7) . . ?
C9 C15 C29 118.9(8) . . ?
C16 C14 C33 118.2(8) . . ?
C17 C13 C35 119.6(7) . . ?
N8 C12 C7 123.4(9) . . ?
C24 C11 C8 117.8(9) . . ?
C26 C10 C9 119.6(8) . . ?
C15 C9 C10 121.3(8) . . ?
C7 C8 C11 118.1(9) . . ?
C12 C7 C8 120.0(10) . . ?
C5 C6 C1 120.0 . . ?
C6 C5 C4 120.0 . . ?
C3 C4 C5 120.0 . . ?
C3 C4 C49 119.0(10) . . ?
C5 C4 C49 121.0(10) . . ?
O1 C3 C4 118.4(14) . . ?
O1 C3 C2 121.6(14) . . ?
C4 C3 C2 120.0 . . ?
C1 C2 C3 120.0 . . ?
C2 C1 C6 120.0 . . ?
C5' C6' C1' 120.0 . . ?
C6' C5' C4' 120.0 . . ?
C3' C4' C5' 120.0 . . ?
C3' C4' C49 111.4(12) . . ?
C5' C4' C49 127.4(12) . . ?
O1' C3' C4' 124.1(15) . . ?
O1' C3' C2' 115.3(15) . . ?
C4' C3' C2' 120.0 . . ?
C3' C2' C1' 120.0 . . ?
C2' C1' C6' 120.0 . . ?

_refine_diff_density_max         1.096
_refine_diff_density_min         -0.536
_refine_diff_density_rms         0.103




