# Supplementary Information (SI) for Physical Chemistry Chemical Physics.
# This journal is © the Owner Societies 2025

####################################################################### 
# 
# 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 
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# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
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data_km794-8
_database_code_depnum_ccdc_archive 'CCDC 2382966'
loop_
_audit_author_name
_audit_author_address
'Taisiya Sukhikh'
;NIIC SB RAS
Russia
;
_audit_update_record             
;
2024-09-10 deposited with the CCDC.	2025-05-13 downloaded from the CCDC.
;
_audit_creation_date             2024-09-09
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'2(Dy0.72 Er0.28 H16 O8), C36 H36 N24 O12, 8(N O3), 11(H2 O)'
_chemical_formula_sum            'C36 H90 Dy1.44 Er0.56 N32 O63'
_chemical_formula_weight         2306.98
_chemical_melting_point          ?
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'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Er Er -0.2586 4.9576 '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'

_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.
;
_space_group_crystal_system      trigonal
_space_group_IT_number           148
_space_group_name_H-M_alt        'R -3'
_space_group_name_Hall           '-R 3'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'

_cell_length_a                   25.8207(7)
_cell_length_b                   25.8207(7)
_cell_length_c                   31.7971(7)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     18359.2(11)
_cell_formula_units_Z            9
_cell_measurement_reflns_used    9881
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.70
_cell_measurement_theta_min      2.49
_shelx_estimated_absorpt_T_max   0.823
_shelx_estimated_absorpt_T_min   0.725
_exptl_absorpt_coefficient_mu    2.021
_exptl_absorpt_correction_T_max  0.7458
_exptl_absorpt_correction_T_min  0.6547
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0854 before and 0.0772 after correction.
The Ratio of minimum to maximum transmission is 0.8778.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.870
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             10414
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0691
_diffrn_reflns_av_unetI/netI     0.0563
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       34
_diffrn_reflns_limit_h_min       -34
_diffrn_reflns_limit_k_max       34
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_l_max       42
_diffrn_reflns_limit_l_min       -42
_diffrn_reflns_number            10539
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.708
_diffrn_reflns_theta_min         1.577
_diffrn_ambient_temperature      150(2)
_diffrn_detector                 PIXEL
_diffrn_detector_area_resol_mean 7.41
_diffrn_detector_type            'Bruker PHOTON III area detector'
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device       'three-circle diffractometer'
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  'Incoatec HELIOS multilayer mirrors'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Incoatec IuS3.0 microfocus X-ray tube'
_diffrn_source_current           1.4
_diffrn_source_power             0.07
_diffrn_source_voltage           50.0
_diffrn_special_details          ?
_diffrn_standards_interval_count .
_diffrn_standards_interval_time  .
_diffrn_standards_number         .
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                8882
_reflns_number_total             10539
_reflns_special_details          
;
 _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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX3'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2014/7 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         1.546
_refine_diff_density_min         -0.990
_refine_diff_density_rms         0.219
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.183
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     780
_refine_ls_number_reflns         10539
_refine_ls_number_restraints     403
_refine_ls_R_factor_all          0.0528
_refine_ls_R_factor_gt           0.0418
_refine_ls_restrained_S_all      1.178
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0538P)²+70.3310P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1200
_refine_ls_wR_factor_ref         0.1303
_refine_special_details          
;
 Refined as a 2-component twin.
;
_olex2_refinement_description    
;
1. Twinned data refinement
 Scales: 0.5376(11)
 0.4624(11)
2. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All O(H,H) groups, All O(H,H,H,H) groups
3. Shared sites
{Er1, Dy1}
4. Restrained distances
 H3WB-H2WA
 -2.12 with sigma of 0.04
 Er1-H1MA \\sim Er1-H1MB
 with sigma of 0.02
 N4-O41N \\sim N4-O42N \\sim N4-O43N \\sim N4-O41' \\sim N5-O51N \\sim N5-O52N
\\sim N5-O53N \\sim N6-O61N
 \\sim N6-O62N \\sim N6-O63N \\sim N7-O71N \\sim N7-O72N \\sim N7-O73N
 with sigma of 0.01
 O41N-O42N \\sim O42N-O43N \\sim O42N-O41N \\sim O41'-O42N \\sim O41'-O43N
\\sim O51N-O52N \\sim O52N-
 O53N \\sim O52N-O51N \\sim O61N-O62N \\sim O62N-O63N \\sim O63N-O61N \\sim
O71N-O72N \\sim O72N-O73N ~
 O73N-O71N
 with sigma of 0.01
 Dy1-H1MC \\sim Dy1-H1MD
 with sigma of 0.02
 Er1-H2MA \\sim Er1-H2MB
 with sigma of 0.02
 Dy1-H2MC \\sim Dy1-H2MD
 with sigma of 0.02
 Er1-H3MA \\sim Er1-H3MB
 with sigma of 0.02
 Dy1-H3MC \\sim Dy1-H3MD
 with sigma of 0.02
 Er1-H6MA \\sim Er1-H6MB
 with sigma of 0.02
 Dy1-H6MC \\sim Dy1-H6MD
 with sigma of 0.02
5. Restrained planarity
 N5, O51N, O52N, O53N
 with sigma of 0.03
 N6, O61N, O62N, O63N
 with sigma of 0.03
 N7, O71N, O72N, O73N
 with sigma of 0.03
6. Uiso/Uaniso restraints and constraints
O7W \\sim O8W \\sim O9W: within 3A with sigma of 0.003 and sigma for terminal
atoms of 0.005 within 3A
N4 \\sim O41N \\sim O41' \\sim O42N \\sim O43N \\sim N5 \\sim O51N \\sim O52N
\\sim O53N: within 2A with sigma of 0.01 and sigma for terminal atoms of 0.01
within 2A
N6 \\sim O61N \\sim O62N \\sim O63N: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.01 within 2A
N7 \\sim O71N \\sim O72N \\sim O73N: within 2A with sigma of 0.001 and sigma
for terminal atoms of 0.003 within 2A
Uanis(O10W) \\sim Ueq, Uanis(O7W) \\sim Ueq, Uanis(O8W) \\sim Ueq, Uanis(O11W)
\\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.01
Uanis(N7) \\sim Ueq, Uanis(O71N) \\sim Ueq, Uanis(O72N) \\sim Ueq, Uanis(O73N)
\\sim Ueq, Uanis(O63N) \\sim Ueq: with sigma of 0.005 and sigma for terminal
atoms of 0.007
Uanis(Er1) = Uanis(Dy1)
7. Others
 1*[Sof(O7W)]+1*[Sof(O8W)]+1*[Sof(O9W)]=1 with esd of 0.000001
 Sof(N5)=Sof(O51N)=Sof(O52N)=Sof(O53N)=0.8*(1-FVAR(5))
 Sof(O41N)=Sof(O41')=0.4*FVAR(5)
 Sof(N4)=Sof(O42N)=Sof(O43N)=0.8*FVAR(5)
 Fixed Sof: Er1(0.28) H1MA(0.5) H1MB(0.5) H1MC(0.5) H1MD(0.5) H2MA(0.5)
 H2MB(0.5) H2MC(0.5) H2MD(0.5) H3MA(0.5) H3MB(0.5) H3MC(0.5) H3MD(0.5)
 H4MA(0.5) H4MB(0.5) H4MC(0.5) H4MD(0.5) H5MA(0.5) H5MB(0.5) H5MC(0.5)
 H5MD(0.5) H6MA(0.5) H6MB(0.5) H6MC(0.5) H6MD(0.5) H7MA(0.5) H7MB(0.5)
 H7MC(0.5) H7MD(0.5) H8MA(0.5) H8MB(0.5) H8MC(0.5) H8MD(0.5) O4W(0.333333)
 O5W(0.333333) O6W(0.333333) O10W(0.333333) O11W(0.166667) N6(0.12) O61N(0.12)
 O62N(0.12) O63N(0.12) N7(0.08) O71N(0.08) O72N(0.08) O73N(0.08) Dy1(0.72)
8.a Riding coordinates:
 O1M(H1MA,H1MB), O1M(H1MC,H1MD), O2M(H2MA,H2MB), O2M(H2MC,H2MD), O3M(H3MA,
 H3MB), O3M(H3MC,H3MD), O4M(H4MA,H4MB), O4M(H4MC,H4MD), O5M(H5MA,H5MB),
 O5M(H5MC,H5MD), O6M(H6MA,H6MB), O6M(H6MC,H6MD), O7M(H7MA,H7MB), O7M(H7MC,H7MD),
  O8M(H8MA,H8MB), O8M(H8MC,H8MD)
8.b Free rotating group:
 O1W(H1WA,H1WB), O2W(H2WA,H2WB), O3W(H3WA,H3WB)
8.c Ternary CH refined with riding coordinates:
 C13(H13), C14(H14), C23(H23), C24(H24), C33(H33), C34(H34)
8.d Secondary CH2 refined with riding coordinates:
 C15(H15A,H15B), C16(H16A,H16B), C25(H25A,H25B), C26(H26A,H26B), C35(H35A,
 H35B), C36(H36A,H36B)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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
Er1 Er 0.38168(2) 0.36636(2) 0.66368(2) 0.02012(8) Uani 0.28 1 d D . P A 4
O1M O 0.4303(2) 0.4711(2) 0.67018(14) 0.0452(11) Uani 1 1 d . . . . .
H1MA H 0.4102 0.4898 0.6683 0.068 Uiso 0.5 1 d DR U P A 4
H1MB H 0.4671 0.4993 0.6744 0.068 Uiso 0.5 1 d DR U P A 4
H1MC H 0.4102 0.4898 0.6683 0.068 Uiso 0.5 1 d DR U P A 5
H1MD H 0.4671 0.4993 0.6744 0.068 Uiso 0.5 1 d DR U P A 5
O2M O 0.41151(19) 0.40061(19) 0.59544(12) 0.0351(9) Uani 1 1 d . . . . .
H2MA H 0.4391 0.4352 0.5860 0.053 Uiso 0.5 1 d DR U P A 4
H2MB H 0.3956 0.3793 0.5729 0.053 Uiso 0.5 1 d DR U P A 4
H2MC H 0.4391 0.4352 0.5860 0.053 Uiso 0.5 1 d DR U P A 5
H2MD H 0.3956 0.3793 0.5729 0.053 Uiso 0.5 1 d DR U P A 5
O3M O 0.3085(2) 0.3932(2) 0.65919(16) 0.0492(12) Uani 1 1 d . . . . .
H3MA H 0.3130 0.4288 0.6618 0.074 Uiso 0.5 1 d DR U P A 4
H3MB H 0.2705 0.3700 0.6546 0.074 Uiso 0.5 1 d DR U P A 4
H3MC H 0.3130 0.4288 0.6618 0.074 Uiso 0.5 1 d DR U P A 5
H3MD H 0.2705 0.3700 0.6546 0.074 Uiso 0.5 1 d DR U P A 5
O4M O 0.31243(19) 0.2970(2) 0.61429(14) 0.0405(10) Uani 1 1 d . . . . .
H4MA H 0.2951 0.3135 0.6009 0.061 Uiso 0.5 1 d R U P A 4
H4MB H 0.2835 0.2672 0.6277 0.061 Uiso 0.5 1 d R U P A 4
H4MC H 0.2951 0.3135 0.6009 0.061 Uiso 0.5 1 d R U P A 5
H4MD H 0.2835 0.2672 0.6277 0.061 Uiso 0.5 1 d R U P A 5
O5M O 0.48602(18) 0.4043(2) 0.66359(14) 0.0360(10) Uani 1 1 d . . . . .
H5MA H 0.4930 0.3746 0.6648 0.054 Uiso 0.5 1 d R U P A 4
H5MB H 0.5008 0.4212 0.6395 0.054 Uiso 0.5 1 d R U P A 4
H5MC H 0.4930 0.3746 0.6648 0.054 Uiso 0.5 1 d R U P A 5
H5MD H 0.5008 0.4212 0.6395 0.054 Uiso 0.5 1 d R U P A 5
O6M O 0.40341(19) 0.3879(2) 0.73533(12) 0.0351(9) Uani 1 1 d . . . . .
H6MA H 0.4313 0.4208 0.7466 0.053 Uiso 0.5 1 d DR U P A 4
H6MB H 0.3852 0.3647 0.7566 0.053 Uiso 0.5 1 d DR U P A 4
H6MC H 0.4313 0.4208 0.7466 0.053 Uiso 0.5 1 d DR U P A 5
H6MD H 0.3852 0.3647 0.7566 0.053 Uiso 0.5 1 d DR U P A 5
O7M O 0.30283(19) 0.2928(2) 0.70472(13) 0.0407(11) Uani 1 1 d . . . . .
H7MA H 0.2886 0.3099 0.7209 0.061 Uiso 0.5 1 d R U P A 4
H7MB H 0.2731 0.2697 0.6884 0.061 Uiso 0.5 1 d R U P A 4
H7MC H 0.2886 0.3099 0.7209 0.061 Uiso 0.5 1 d R U P A 5
H7MD H 0.2731 0.2697 0.6884 0.061 Uiso 0.5 1 d R U P A 5
O8M O 0.3978(2) 0.2862(2) 0.66742(19) 0.0510(13) Uani 1 1 d . . . . .
H8MA H 0.4360 0.2993 0.6674 0.076 Uiso 0.5 1 d R U P A 4
H8MB H 0.3847 0.2653 0.6444 0.076 Uiso 0.5 1 d R U P A 4
H8MC H 0.4360 0.2993 0.6674 0.076 Uiso 0.5 1 d R U P A 5
H8MD H 0.3847 0.2653 0.6444 0.076 Uiso 0.5 1 d R U P A 5
O11 O 0.4904(2) 0.74882(19) 0.59590(12) 0.0341(9) Uani 1 1 d . . . . .
O12 O 0.47860(19) 0.74455(17) 0.40634(11) 0.0287(8) Uani 1 1 d . . . . .
C11 C 0.5134(2) 0.7618(2) 0.56067(15) 0.0223(10) Uani 1 1 d . . . . .
C12 C 0.5062(2) 0.7588(2) 0.43998(16) 0.0219(10) Uani 1 1 d . . . . .
C13 C 0.5606(2) 0.7579(2) 0.49868(15) 0.0201(10) Uani 1 1 d . . . . .
H13 H 0.6030 0.7670 0.4971 0.024 Uiso 1 1 calc R U . . .
C14 C 0.5560(2) 0.8155(2) 0.49931(14) 0.0181(9) Uani 1 1 d . . . . .
H14 H 0.5965 0.8523 0.4983 0.022 Uiso 1 1 calc R U . . .
N11 N 0.5324(2) 0.7294(2) 0.53781(13) 0.0235(9) Uani 1 1 d . . . . .
N12 N 0.5260(2) 0.81161(19) 0.53813(12) 0.0217(8) Uani 1 1 d . . . . .
N13 N 0.5218(2) 0.80972(19) 0.46180(13) 0.0218(8) Uani 1 1 d . . . . .
N14 N 0.52638(19) 0.72646(19) 0.46158(13) 0.0205(8) Uani 1 1 d . . . . .
C15 C 0.5168(3) 0.8587(3) 0.55393(16) 0.0250(11) Uani 1 1 d . . . . .
H15A H 0.5530 0.8977 0.5481 0.030 Uiso 1 1 calc R U . . .
H15B H 0.5116 0.8545 0.5848 0.030 Uiso 1 1 calc R U . . .
C16 C 0.5182(2) 0.8599(2) 0.44377(15) 0.0208(10) Uani 1 1 d . . . . .
H16A H 0.5559 0.8974 0.4500 0.025 Uiso 1 1 calc R U . . .
H16B H 0.5147 0.8552 0.4128 0.025 Uiso 1 1 calc R U . . .
O21 O 0.40127(19) 0.8168(2) 0.59233(12) 0.0375(10) Uani 1 1 d . . . . .
O22 O 0.40454(17) 0.82262(17) 0.40250(11) 0.0250(8) Uani 1 1 d . . . . .
C21 C 0.4141(2) 0.8424(2) 0.55815(15) 0.0241(10) Uani 1 1 d . . . . .
C22 C 0.4172(2) 0.8469(2) 0.43714(14) 0.0191(9) Uani 1 1 d . . . . .
C23 C 0.4694(2) 0.8941(2) 0.49873(15) 0.0203(10) Uani 1 1 d . . . . .
H23 H 0.5039 0.9359 0.5004 0.024 Uiso 1 1 calc R U . . .
C24 C 0.4085(2) 0.8924(2) 0.49833(14) 0.0188(9) Uani 1 1 d . . . . .
H24 H 0.4140 0.9335 0.4992 0.023 Uiso 1 1 calc R U . . .
N21 N 0.4654(2) 0.8592(2) 0.53584(13) 0.0220(9) Uani 1 1 d . . . . .
N22 N 0.37926(19) 0.8588(2) 0.53586(13) 0.0237(9) Uani 1 1 d . . . . .
N23 N 0.38132(19) 0.86227(19) 0.45927(12) 0.0195(8) Uani 1 1 d . . . . .
N24 N 0.46850(19) 0.86540(19) 0.45939(12) 0.0202(8) Uani 1 1 d . . . . .
C25 C 0.3253(2) 0.8550(3) 0.55326(16) 0.0269(11) Uani 1 1 d . . . . .
H25A H 0.3244 0.8918 0.5459 0.032 Uiso 1 1 calc R U . . .
H25B H 0.3265 0.8529 0.5843 0.032 Uiso 1 1 calc R U . . .
C26 C 0.3246(2) 0.8517(2) 0.44416(15) 0.0212(10) Uani 1 1 d . . . . .
H26A H 0.3238 0.8473 0.4132 0.025 Uiso 1 1 calc R U . . .
H26B H 0.3210 0.8873 0.4504 0.025 Uiso 1 1 calc R U . . .
O31 O 0.40749(19) 0.82580(19) 0.26438(11) 0.0300(8) Uani 1 1 d . . . . .
O32 O 0.40124(17) 0.81085(19) 0.07508(11) 0.0292(8) Uani 1 1 d . . . . .
C31 C 0.4194(2) 0.8489(2) 0.22956(15) 0.0220(10) Uani 1 1 d . . . . .
C32 C 0.4147(2) 0.8380(2) 0.10855(15) 0.0198(9) Uani 1 1 d . . . . .
C33 C 0.4702(2) 0.8932(2) 0.16650(16) 0.0217(10) Uani 1 1 d . . . . .
H33 H 0.5044 0.9351 0.1644 0.026 Uiso 1 1 calc R U . . .
C34 C 0.4096(2) 0.8909(2) 0.16676(15) 0.0199(9) Uani 1 1 d . . . . .
H34 H 0.4146 0.9318 0.1642 0.024 Uiso 1 1 calc R U . . .
N31 N 0.47017(19) 0.8654(2) 0.20698(13) 0.0213(8) Uani 1 1 d . . . . .
N32 N 0.38363(19) 0.8636(2) 0.20679(13) 0.0218(9) Uani 1 1 d . . . . .
N33 N 0.37932(19) 0.8542(2) 0.13046(12) 0.0215(8) Uani 1 1 d . . . . .
N34 N 0.46689(19) 0.8580(2) 0.13042(12) 0.0213(9) Uani 1 1 d . . . . .
C35 C 0.3260(2) 0.8524(2) 0.22157(15) 0.0210(10) Uani 1 1 d . . . . .
H35A H 0.3221 0.8880 0.2154 0.025 Uiso 1 1 calc R U . . .
H35B H 0.3243 0.8473 0.2525 0.025 Uiso 1 1 calc R U . . .
C36 C 0.3273(2) 0.8522(2) 0.11199(15) 0.0229(10) Uani 1 1 d . . . . .
H36A H 0.3283 0.8903 0.1183 0.027 Uiso 1 1 calc R U . . .
H36B H 0.3295 0.8494 0.0811 0.027 Uiso 1 1 calc R U . . .
N1 N 0.5425(2) 0.5360(2) 0.58783(14) 0.0259(9) Uani 1 1 d . . . . .
O11N O 0.5537(2) 0.5125(2) 0.61869(13) 0.0383(10) Uani 1 1 d . . . . .
O12N O 0.4957(2) 0.5061(2) 0.56662(14) 0.0432(11) Uani 1 1 d . . . . .
O13N O 0.5796(2) 0.58691(18) 0.57620(14) 0.0372(10) Uani 1 1 d . . . . .
N2 N 0.5367(2) 0.5345(2) 0.75151(14) 0.0264(9) Uani 1 1 d . . . . .
O21N O 0.5375(3) 0.5314(3) 0.71248(14) 0.074(2) Uani 1 1 d . . . . .
O22N O 0.57826(18) 0.57787(17) 0.77010(12) 0.0296(8) Uani 1 1 d . . . . .
O23N O 0.49321(18) 0.49371(19) 0.77160(12) 0.0321(9) Uani 1 1 d . . . . .
N3 N 0.3368(2) 0.33488(19) 0.49507(14) 0.0241(9) Uani 1 1 d . . . . .
O31N O 0.36569(19) 0.38215(17) 0.51660(12) 0.0339(9) Uani 1 1 d . . . . .
O32N O 0.30479(19) 0.33287(19) 0.46562(12) 0.0333(9) Uani 1 1 d . . . . .
O33N O 0.3413(2) 0.2902(2) 0.50395(19) 0.0565(14) Uani 1 1 d . . . . .
N4 N 0.3277(5) 0.1668(4) 0.5938(2) 0.047(2) Uani 0.609(8) 1 d D U P B 1
O41N O 0.2861(7) 0.1452(7) 0.6196(5) 0.057(3) Uani 0.305(4) 1 d D U P B 1
O41' O 0.3317(8) 0.1707(6) 0.6332(3) 0.042(2) Uani 0.305(4) 1 d D U P B 1
O42N O 0.3426(5) 0.1325(5) 0.5767(3) 0.062(2) Uani 0.609(8) 1 d D U P B 1
O43N O 0.3297(5) 0.2086(5) 0.5733(3) 0.050(2) Uani 0.609(8) 1 d D U P B 1
N5 N 0.3403(9) 0.1694(9) 0.5928(6) 0.053(3) Uani 0.191(8) 1 d D U P B 2
O51N O 0.3867(11) 0.1950(10) 0.6145(7) 0.050(4) Uani 0.191(8) 1 d D U P B 2
O52N O 0.3182(14) 0.1989(13) 0.5787(12) 0.051(4) Uani 0.191(8) 1 d D U P B 2
O53N O 0.3156(14) 0.1149(10) 0.5853(9) 0.053(4) Uani 0.191(8) 1 d D U P B 2
O1W O 0.5110(2) 0.3093(2) 0.66700(12) 0.0362(10) Uani 1 1 d G . . . .
H1WA H 0.5122 0.2992 0.6929 0.054 Uiso 1 1 d G U . . .
H1WB H 0.5483 0.3332 0.6604 0.054 Uiso 1 1 d G U . . .
O2W O 0.4460(2) 0.7973(2) 0.33330(12) 0.0355(10) Uani 1 1 d G . . . .
H2WA H 0.4382 0.8146 0.3127 0.053 Uiso 1 1 d DG U . . .
H2WB H 0.4369 0.8103 0.3558 0.053 Uiso 1 1 d G U . . .
O3W O 0.5627(3) 0.8515(3) 0.33262(19) 0.0629(15) Uani 1 1 d G . . . .
H3WA H 0.5699 0.8351 0.3540 0.094 Uiso 1 1 d G U . . .
H3WB H 0.5249 0.8401 0.3348 0.094 Uiso 1 1 d DG U . . .
O4W O 0.3713(5) 0.6859(5) 0.3327(4) 0.032(3) Uani 0.3333 1 d . . P C -1
O5W O 0.3091(6) 0.6557(11) 0.4022(4) 0.043(3) Uani 0.3333 1 d . . P D -1
O6W O 0.3067(6) 0.6552(9) 0.2659(4) 0.048(4) Uani 0.3333 1 d . . P E -1
O7W O 0.3213(6) 0.4982(5) 0.6672(3) 0.037(2) Uani 0.404(3) 1 d . U P F 1
O8W O 0.3694(6) 0.5291(5) 0.6647(3) 0.0361(18) Uani 0.429(3) 1 d . U P G 2
O9W O 0.4611(12) 0.5800(11) 0.6612(7) 0.031(3) Uani 0.167(3) 1 d . U P H 3
O10W O 0.3261(11) 0.6342(9) 0.5899(6) 0.078(5) Uani 0.3333 1 d . U P I -1
O11W O 0.3284(16) 0.7128(15) 0.6369(10) 0.058(8) Uani 0.1667 1 d . U P J -1
N6 N 0.3111(13) 0.6858(13) 0.1690(7) 0.051(8) Uani 0.12 1 d D U P K -1
O61N O 0.311(2) 0.689(3) 0.1300(7) 0.055(9) Uani 0.12 1 d D U P K -1
O62N O 0.271(2) 0.641(2) 0.1873(17) 0.050(9) Uani 0.12 1 d D U P K -1
O63N O 0.351(2) 0.727(2) 0.1896(18) 0.053(9) Uani 0.12 1 d D U P K -1
N7 N 0.3693(14) 0.6796(12) 0.5008(9) 0.038(6) Uani 0.08 1 d D U P L -1
O71N O 0.346(2) 0.7115(18) 0.4982(13) 0.037(6) Uani 0.08 1 d D U P L -1
O72N O 0.360(2) 0.6423(19) 0.4729(12) 0.038(7) Uani 0.08 1 d D U P L -1
O73N O 0.401(2) 0.685(2) 0.5313(11) 0.039(7) Uani 0.08 1 d D U P L -1
Dy1 Dy 0.38168(2) 0.36636(2) 0.66368(2) 0.02012(8) Uani 0.72 1 d D . P A 5


_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
Er1 O1M 2.354(5) . ?
Er1 O2M 2.324(4) . ?
Er1 O3M 2.319(4) . ?
Er1 O4M 2.381(4) . ?
Er1 O5M 2.362(4) . ?
Er1 O6M 2.346(4) . ?
Er1 O7M 2.364(4) . ?
Er1 O8M 2.308(4) . ?
O1M H1MA 0.8698 . ?
O1M H1MB 0.8703 . ?
O1M H1MC 0.8698 . ?
O1M H1MD 0.8703 . ?
O1M Dy1 2.354(5) . ?
O2M H2MA 0.8703 . ?
O2M H2MB 0.8699 . ?
O2M H2MC 0.8703 . ?
O2M H2MD 0.8699 . ?
O2M Dy1 2.324(4) . ?
O3M H3MA 0.8701 . ?
O3M H3MB 0.8702 . ?
O3M H3MC 0.8701 . ?
O3M H3MD 0.8702 . ?
O3M Dy1 2.319(4) . ?
O4M H4MA 0.8696 . ?
O4M H4MB 0.8699 . ?
O4M H4MC 0.8696 . ?
O4M H4MD 0.8699 . ?
O4M Dy1 2.381(4) . ?
O5M H5MA 0.8699 . ?
O5M H5MB 0.8701 . ?
O5M H5MC 0.8699 . ?
O5M H5MD 0.8701 . ?
O5M Dy1 2.362(4) . ?
O6M H6MA 0.8697 . ?
O6M H6MB 0.8703 . ?
O6M H6MC 0.8697 . ?
O6M H6MD 0.8703 . ?
O6M Dy1 2.346(4) . ?
O7M H7MA 0.8700 . ?
O7M H7MB 0.8698 . ?
O7M H7MC 0.8700 . ?
O7M H7MD 0.8698 . ?
O7M Dy1 2.364(4) . ?
O8M H8MA 0.8695 . ?
O8M H8MB 0.8700 . ?
O8M H8MC 0.8695 . ?
O8M H8MD 0.8700 . ?
O8M Dy1 2.308(4) . ?
O11 C11 1.233(6) . ?
O12 C12 1.234(6) . ?
C11 N11 1.371(7) . ?
C11 N12 1.362(6) . ?
C12 N13 1.358(6) . ?
C12 N14 1.370(6) . ?
C13 H13 1.0000 . ?
C13 C14 1.550(7) . ?
C13 N11 1.444(6) . ?
C13 N14 1.454(6) . ?
C14 H14 1.0000 . ?
C14 N12 1.434(6) . ?
C14 N13 1.448(6) . ?
N11 C25 1.464(7) 3_565 ?
N12 C15 1.442(7) . ?
N13 C16 1.462(6) . ?
N14 C26 1.439(6) 3_565 ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C15 N21 1.452(7) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 N24 1.448(6) . ?
O21 C21 1.228(6) . ?
O22 C22 1.229(6) . ?
C21 N21 1.367(7) . ?
C21 N22 1.369(7) . ?
C22 N23 1.369(6) . ?
C22 N24 1.361(6) . ?
C23 H23 1.0000 . ?
C23 C24 1.551(7) . ?
C23 N21 1.456(6) . ?
C23 N24 1.448(6) . ?
C24 H24 1.0000 . ?
C24 N22 1.446(6) . ?
C24 N23 1.447(6) . ?
N22 C25 1.457(7) . ?
N23 C26 1.431(6) . ?
C25 N11 1.464(7) 2_665 ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 N14 1.439(6) 2_665 ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
O31 C31 1.222(6) . ?
O32 C32 1.225(6) . ?
C31 N31 1.362(7) . ?
C31 N32 1.368(7) . ?
C32 N33 1.370(6) . ?
C32 N34 1.367(6) . ?
C33 H33 1.0000 . ?
C33 C34 1.537(7) . ?
C33 N31 1.472(6) . ?
C33 N34 1.438(6) . ?
C34 H34 1.0000 . ?
C34 N32 1.448(6) . ?
C34 N33 1.450(6) . ?
N31 C36 1.436(7) 14_455 ?
N32 C35 1.447(7) . ?
N33 C36 1.442(6) . ?
N34 C35 1.452(6) 14_455 ?
C35 N34 1.452(6) 15 ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 N31 1.436(7) 15 ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
N1 O11N 1.261(6) . ?
N1 O12N 1.257(6) . ?
N1 O13N 1.233(6) . ?
N2 O21N 1.245(6) . ?
N2 O22N 1.246(6) . ?
N2 O23N 1.263(6) . ?
N3 O31N 1.266(6) . ?
N3 O32N 1.233(6) . ?
N3 O33N 1.248(6) . ?
N4 O41N 1.241(8) . ?
N4 O41' 1.257(8) . ?
N4 O42N 1.253(7) . ?
N4 O43N 1.239(7) . ?
N5 O51N 1.247(9) . ?
N5 O52N 1.243(8) . ?
N5 O53N 1.243(8) . ?
O1W H1WA 0.8702 . ?
O1W H1WB 0.8702 . ?
O2W H2WA 0.8716 . ?
O2W H2WB 0.8718 . ?
O3W H3WA 0.8700 . ?
O3W H3WB 0.8701 . ?
N6 O61N 1.242(8) . ?
N6 O62N 1.241(8) . ?
N6 O63N 1.242(8) . ?
N7 O71N 1.239(8) . ?
N7 O72N 1.242(8) . ?
N7 O73N 1.239(8) . ?

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
O1M Er1 O4M 133.73(16) . . ?
O1M Er1 O5M 71.40(17) . . ?
O1M Er1 O7M 128.68(16) . . ?
O2M Er1 O1M 76.10(16) . . ?
O2M Er1 O4M 69.63(15) . . ?
O2M Er1 O5M 75.46(15) . . ?
O2M Er1 O6M 145.28(15) . . ?
O2M Er1 O7M 144.05(15) . . ?
O3M Er1 O1M 73.05(19) . . ?
O3M Er1 O2M 89.61(17) . . ?
O3M Er1 O4M 76.53(17) . . ?
O3M Er1 O5M 143.78(18) . . ?
O3M Er1 O6M 97.04(16) . . ?
O3M Er1 O7M 76.75(18) . . ?
O5M Er1 O4M 125.65(16) . . ?
O5M Er1 O7M 132.79(16) . . ?
O6M Er1 O1M 73.44(16) . . ?
O6M Er1 O4M 145.04(15) . . ?
O6M Er1 O5M 79.34(15) . . ?
O6M Er1 O7M 70.25(15) . . ?
O7M Er1 O4M 74.85(15) . . ?
O8M Er1 O1M 142.54(18) . . ?
O8M Er1 O2M 102.43(19) . . ?
O8M Er1 O3M 144.07(18) . . ?
O8M Er1 O4M 76.32(18) . . ?
O8M Er1 O5M 72.07(16) . . ?
O8M Er1 O6M 91.94(19) . . ?
O8M Er1 O7M 73.77(18) . . ?
Er1 O1M H1MA 120.5 . . ?
Er1 O1M H1MB 135.0 . . ?
H1MA O1M H1MB 104.5 . . ?
H1MC O1M H1MD 104.5 . . ?
Dy1 O1M H1MC 120.5 . . ?
Dy1 O1M H1MD 135.0 . . ?
Er1 O2M H2MA 131.0 . . ?
Er1 O2M H2MB 124.5 . . ?
H2MA O2M H2MB 104.5 . . ?
H2MC O2M H2MD 104.5 . . ?
Dy1 O2M H2MC 131.0 . . ?
Dy1 O2M H2MD 124.5 . . ?
Er1 O3M H3MA 127.7 . . ?
Er1 O3M H3MB 127.8 . . ?
H3MA O3M H3MB 104.5 . . ?
H3MC O3M H3MD 104.5 . . ?
Dy1 O3M H3MC 127.7 . . ?
Dy1 O3M H3MD 127.8 . . ?
Er1 O4M H4MA 109.3 . . ?
Er1 O4M H4MB 109.4 . . ?
H4MA O4M H4MB 104.5 . . ?
H4MC O4M H4MD 104.5 . . ?
Dy1 O4M H4MC 109.3 . . ?
Dy1 O4M H4MD 109.4 . . ?
Er1 O5M H5MA 109.2 . . ?
Er1 O5M H5MB 109.3 . . ?
H5MA O5M H5MB 104.5 . . ?
H5MC O5M H5MD 104.5 . . ?
Dy1 O5M H5MC 109.2 . . ?
Dy1 O5M H5MD 109.3 . . ?
Er1 O6M H6MA 128.0 . . ?
Er1 O6M H6MB 127.5 . . ?
H6MA O6M H6MB 104.5 . . ?
H6MC O6M H6MD 104.5 . . ?
Dy1 O6M H6MC 128.0 . . ?
Dy1 O6M H6MD 127.5 . . ?
Er1 O7M H7MA 109.4 . . ?
Er1 O7M H7MB 109.3 . . ?
H7MA O7M H7MB 104.5 . . ?
H7MC O7M H7MD 104.5 . . ?
Dy1 O7M H7MC 109.4 . . ?
Dy1 O7M H7MD 109.3 . . ?
Er1 O8M H8MA 109.3 . . ?
Er1 O8M H8MB 109.0 . . ?
H8MA O8M H8MB 104.5 . . ?
H8MC O8M H8MD 104.5 . . ?
Dy1 O8M H8MC 109.3 . . ?
Dy1 O8M H8MD 109.0 . . ?
O11 C11 N11 125.9(5) . . ?
O11 C11 N12 126.2(5) . . ?
N12 C11 N11 107.9(4) . . ?
O12 C12 N13 125.3(5) . . ?
O12 C12 N14 126.3(5) . . ?
N13 C12 N14 108.4(4) . . ?
C14 C13 H13 112.1 . . ?
N11 C13 H13 112.1 . . ?
N11 C13 C14 102.6(4) . . ?
N11 C13 N14 113.8(4) . . ?
N14 C13 H13 112.1 . . ?
N14 C13 C14 103.3(4) . . ?
C13 C14 H14 111.5 . . ?
N12 C14 C13 103.9(4) . . ?
N12 C14 H14 111.5 . . ?
N12 C14 N13 114.9(4) . . ?
N13 C14 C13 103.0(4) . . ?
N13 C14 H14 111.5 . . ?
C11 N11 C13 112.9(4) . . ?
C11 N11 C25 123.5(4) . 3_565 ?
C13 N11 C25 123.4(4) . 3_565 ?
C11 N12 C14 112.7(4) . . ?
C11 N12 C15 123.4(4) . . ?
C14 N12 C15 123.5(4) . . ?
C12 N13 C14 113.0(4) . . ?
C12 N13 C16 122.6(4) . . ?
C14 N13 C16 122.5(4) . . ?
C12 N14 C13 112.1(4) . . ?
C12 N14 C26 123.3(4) . 3_565 ?
C26 N14 C13 122.8(4) 3_565 . ?
N12 C15 H15A 108.7 . . ?
N12 C15 H15B 108.7 . . ?
N12 C15 N21 114.0(4) . . ?
H15A C15 H15B 107.6 . . ?
N21 C15 H15A 108.7 . . ?
N21 C15 H15B 108.7 . . ?
N13 C16 H16A 108.8 . . ?
N13 C16 H16B 108.8 . . ?
H16A C16 H16B 107.7 . . ?
N24 C16 N13 113.8(4) . . ?
N24 C16 H16A 108.8 . . ?
N24 C16 H16B 108.8 . . ?
O21 C21 N21 126.0(5) . . ?
O21 C21 N22 125.6(5) . . ?
N21 C21 N22 108.4(4) . . ?
O22 C22 N23 124.3(5) . . ?
O22 C22 N24 127.4(5) . . ?
N24 C22 N23 108.2(4) . . ?
C24 C23 H23 112.0 . . ?
N21 C23 H23 112.0 . . ?
N21 C23 C24 103.4(4) . . ?
N24 C23 H23 112.0 . . ?
N24 C23 C24 102.8(4) . . ?
N24 C23 N21 114.0(4) . . ?
C23 C24 H24 111.6 . . ?
N22 C24 C23 103.2(4) . . ?
N22 C24 H24 111.6 . . ?
N22 C24 N23 114.7(4) . . ?
N23 C24 C23 103.6(4) . . ?
N23 C24 H24 111.6 . . ?
C15 N21 C23 122.9(4) . . ?
C21 N21 C15 122.4(4) . . ?
C21 N21 C23 112.1(4) . . ?
C21 N22 C24 112.7(4) . . ?
C21 N22 C25 122.5(4) . . ?
C24 N22 C25 123.3(4) . . ?
C22 N23 C24 112.3(4) . . ?
C22 N23 C26 123.2(4) . . ?
C26 N23 C24 124.5(4) . . ?
C22 N24 C16 122.9(4) . . ?
C22 N24 C23 113.1(4) . . ?
C23 N24 C16 123.9(4) . . ?
N11 C25 H25A 109.0 2_665 . ?
N11 C25 H25B 109.0 2_665 . ?
N22 C25 N11 112.7(4) . 2_665 ?
N22 C25 H25A 109.0 . . ?
N22 C25 H25B 109.0 . . ?
H25A C25 H25B 107.8 . . ?
N14 C26 H26A 108.5 2_665 . ?
N14 C26 H26B 108.5 2_665 . ?
N23 C26 N14 115.0(4) . 2_665 ?
N23 C26 H26A 108.5 . . ?
N23 C26 H26B 108.5 . . ?
H26A C26 H26B 107.5 . . ?
O31 C31 N31 126.8(5) . . ?
O31 C31 N32 125.1(5) . . ?
N31 C31 N32 108.1(4) . . ?
O32 C32 N33 125.1(5) . . ?
O32 C32 N34 127.0(5) . . ?
N34 C32 N33 107.9(4) . . ?
C34 C33 H33 111.8 . . ?
N31 C33 H33 111.8 . . ?
N31 C33 C34 102.9(4) . . ?
N34 C33 H33 111.8 . . ?
N34 C33 C34 104.0(4) . . ?
N34 C33 N31 113.9(4) . . ?
C33 C34 H34 111.6 . . ?
N32 C34 C33 103.8(4) . . ?
N32 C34 H34 111.6 . . ?
N32 C34 N33 114.5(4) . . ?
N33 C34 C33 103.1(4) . . ?
N33 C34 H34 111.6 . . ?
C31 N31 C33 112.4(4) . . ?
C31 N31 C36 124.1(4) . 14_455 ?
C36 N31 C33 123.6(4) 14_455 . ?
C31 N32 C34 112.8(4) . . ?
C31 N32 C35 122.9(4) . . ?
C35 N32 C34 124.2(4) . . ?
C32 N33 C34 112.3(4) . . ?
C32 N33 C36 122.2(4) . . ?
C36 N33 C34 122.4(4) . . ?
C32 N34 C33 112.4(4) . . ?
C32 N34 C35 121.9(4) . 14_455 ?
C33 N34 C35 122.9(4) . 14_455 ?
N32 C35 N34 114.1(4) . 15 ?
N32 C35 H35A 108.7 . . ?
N32 C35 H35B 108.7 . . ?
N34 C35 H35A 108.7 15 . ?
N34 C35 H35B 108.7 15 . ?
H35A C35 H35B 107.6 . . ?
N31 C36 N33 114.3(4) 15 . ?
N31 C36 H36A 108.7 15 . ?
N31 C36 H36B 108.7 15 . ?
N33 C36 H36A 108.7 . . ?
N33 C36 H36B 108.7 . . ?
H36A C36 H36B 107.6 . . ?
O12N N1 O11N 120.1(5) . . ?
O13N N1 O11N 120.2(5) . . ?
O13N N1 O12N 119.4(5) . . ?
O21N N2 O22N 119.8(5) . . ?
O21N N2 O23N 119.2(5) . . ?
O22N N2 O23N 121.1(4) . . ?
O32N N3 O31N 120.7(5) . . ?
O32N N3 O33N 120.2(5) . . ?
O33N N3 O31N 119.1(5) . . ?
O41N N4 O41' 52.8(11) . . ?
O41N N4 O42N 118.2(8) . . ?
O42N N4 O41' 116.5(7) . . ?
O43N N4 O41N 112.9(12) . . ?
O43N N4 O41' 119.3(6) . . ?
O43N N4 O42N 119.6(6) . . ?
O52N N5 O51N 119.2(10) . . ?
O52N N5 O53N 119.5(10) . . ?
O53N N5 O51N 121.3(16) . . ?
H1WA O1W H1WB 104.5 . . ?
H2WA O2W H2WB 104.3 . . ?
H3WA O3W H3WB 104.4 . . ?
O62N N6 O61N 120.1(7) . . ?
O62N N6 O63N 120.0(7) . . ?
O63N N6 O61N 119.9(7) . . ?
O71N N7 O72N 120.2(7) . . ?
O73N N7 O71N 120.0(7) . . ?
O73N N7 O72N 119.7(7) . . ?
O1M Dy1 O4M 133.73(16) . . ?
O1M Dy1 O5M 71.40(17) . . ?
O1M Dy1 O7M 128.68(16) . . ?
O2M Dy1 O1M 76.10(16) . . ?
O2M Dy1 O4M 69.63(15) . . ?
O2M Dy1 O5M 75.46(15) . . ?
O2M Dy1 O6M 145.28(15) . . ?
O2M Dy1 O7M 144.05(15) . . ?
O3M Dy1 O1M 73.05(19) . . ?
O3M Dy1 O2M 89.61(17) . . ?
O3M Dy1 O4M 76.53(17) . . ?
O3M Dy1 O5M 143.78(18) . . ?
O3M Dy1 O6M 97.04(16) . . ?
O3M Dy1 O7M 76.75(18) . . ?
O5M Dy1 O4M 125.65(16) . . ?
O5M Dy1 O7M 132.79(16) . . ?
O6M Dy1 O1M 73.44(16) . . ?
O6M Dy1 O4M 145.04(15) . . ?
O6M Dy1 O5M 79.34(15) . . ?
O6M Dy1 O7M 70.25(15) . . ?
O7M Dy1 O4M 74.85(15) . . ?
O8M Dy1 O1M 142.54(18) . . ?
O8M Dy1 O2M 102.43(19) . . ?
O8M Dy1 O3M 144.07(18) . . ?
O8M Dy1 O4M 76.32(18) . . ?
O8M Dy1 O5M 72.07(16) . . ?
O8M Dy1 O6M 91.94(19) . . ?
O8M Dy1 O7M 73.77(18) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
1 0.5376(11)
2 0.4624(11)

_vrf_PLAT430_km794-8             
;
PROBLEM: Short Inter D...A Contact O11 ..O8W . 2.73 Ang.
and related alerts
RESPONSE: The OWx (x = 4-11) atoms belong to disordered
water molecules; the corresponding hydrogens were not 
located.
;
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# 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_km794-2
_database_code_depnum_ccdc_archive 'CCDC 2382967'
loop_
_audit_author_name
_audit_author_address
'Taisiya Sukhikh'
;NIIC SB RAS
Russia
;
_audit_update_record             
;
2024-09-10 deposited with the CCDC.	2025-05-13 downloaded from the CCDC.
;
_audit_creation_date             2024-09-09
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'2(C18 H28 Dy0.333 N13 Nd0.667 O14), 5(N O3), 6(H2 O)'
_chemical_formula_sum            'C36 H68 Dy0.66 N31 Nd1.33 O49'
_chemical_formula_weight         2019.83
_chemical_melting_point          ?
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'
Dy Dy -0.1892 4.4098 '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'
Nd Nd -0.1943 3.0179 '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'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   13.4485(3)
_cell_length_b                   14.4739(4)
_cell_length_c                   18.2996(5)
_cell_angle_alpha                73.7510(10)
_cell_angle_beta                 87.3320(10)
_cell_angle_gamma                87.8130(10)
_cell_volume                     3414.89(15)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9843
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      28.70
_cell_measurement_theta_min      2.72
_shelx_estimated_absorpt_T_max   0.913
_shelx_estimated_absorpt_T_min   0.742
_exptl_absorpt_coefficient_mu    1.865
_exptl_absorpt_correction_T_max  0.7458
_exptl_absorpt_correction_T_min  0.6374
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0903 before and 0.0482 after correction.
The Ratio of minimum to maximum transmission is 0.8547.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.964
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             2034
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.05
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0406
_diffrn_reflns_av_unetI/netI     0.0506
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.987
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            51389
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.987
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.725
_diffrn_reflns_theta_min         1.466
_diffrn_ambient_temperature      150(2)
_diffrn_detector                 PIXEL
_diffrn_detector_area_resol_mean 7.41
_diffrn_detector_type            'Bruker PHOTON III area detector'
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device       'three-circle diffractometer'
_diffrn_measurement_device_type  'Bruker D8 Venture diffractometer'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_monochromator  'Incoatec HELIOS multilayer mirrors'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Incoatec IuS3.0 microfocus X-ray tube'
_diffrn_source_current           1.4
_diffrn_source_power             0.07
_diffrn_source_voltage           50.0
_diffrn_standards_interval_count .
_diffrn_standards_interval_time  .
_diffrn_standards_number         .
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                13902
_reflns_number_total             17453
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX3'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2014/7 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         1.178
_refine_diff_density_min         -1.304
_refine_diff_density_rms         0.119
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1209
_refine_ls_number_reflns         17453
_refine_ls_number_restraints     229
_refine_ls_R_factor_all          0.0542
_refine_ls_R_factor_gt           0.0371
_refine_ls_restrained_S_all      1.038
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0182P)²+8.7089P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0713
_refine_ls_wR_factor_ref         0.0762
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All O(H,H) groups
2. Shared sites
{Nd2, Dy2}
{Nd1, Dy1}
3. Restrained distances
 H3WA-H2WA
 -2.12 with sigma of 0.04
 H3WB-O12_$1
 2.1 with sigma of 0.02
 H11A-H2WB
 -2.12 with sigma of 0.04
 N7-O71N \\sim N7-O72N \\sim N7-O73N \\sim N7A-O71A \\sim N7A-O72A \\sim
N7A-O73A \\sim N8-O81N \\sim N8-
 O82N \\sim N8-O83N \\sim N8A-O81A \\sim N8A-O82A \\sim N8A-O83A
 with sigma of 0.01
 O71N-O72N \\sim O72N-O73N \\sim O73N-O71N \\sim O81N-O82N \\sim O82N-O83N
\\sim O83N-O81N
 with sigma of 0.01
4. Restrained planarity
 N7A, O71A, O72A, O73A
 with sigma of 0.03
5. Uiso/Uaniso restraints and constraints
N8 \\sim O81N \\sim O82N \\sim O83N \\sim N8A \\sim O81A \\sim O82A \\sim O83A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.01 within 2A
N7 \\sim O71N \\sim O72N \\sim O73N \\sim N7A \\sim O71A \\sim O72A \\sim O73A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.01 within 2A
N4 \\sim O41N \\sim O42N \\sim O43N: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.01 within 2A
Uanis(O83A) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(Nd2) = Uanis(Dy2)
Uanis(Nd1) = Uanis(Dy1)
6. Others
 Fixed Sof: Nd1(0.66666) Nd2(0.66666) N7(0.25) O71N(0.25) O72N(0.25)
 O73N(0.25) N7A(0.25) O71A(0.25) O72A(0.25) O73A(0.25) N8(0.25) O81N(0.25)
 O82N(0.25) O83N(0.25) N8A(0.25) O81A(0.25) O82A(0.25) O83A(0.25) Dy2(0.333333)
 Dy1(0.333333)
7.a Free rotating group:
 O11M(H11A,H11B), O13M(H13A,H13B), O14M(H14A,H14B), O21M(H21A,H21B), O25M(H25C,
 H25D), O1W(H1WA,H1WB), O2W(H2WA,H2WB), O3W(H3WA,H3WB), O4W(H4WA,H4WB),
 O5W(H5WA,H5WB), O6W(H6WA,H6WB)
7.b Rotating group:
 O12M(H12A,H12B), O15M(H15A,H15B), O22M(H22A,H22B), O23M(H23A,H23B), O24M(H24A,
 H24B)
7.c Ternary CH refined with riding coordinates:
 C13(H13), C14(H14), C23(H23), C24(H24), C33(H33), C34(H34), C43(H43),
 C44(H44), C53(H53), C54(H54), C63(H63), C64(H64)
7.d Secondary CH2 refined with riding coordinates:
 C15(H15C,H15D), C16(H16A,H16B), C25(H25A,H25B), C26(H26A,H26B), C35(H35A,
 H35B), C36(H36A,H36B), C45(H45A,H45B), C46(H46A,H46B), C55(H55A,H55B),
 C56(H56A,H56B), C65(H65A,H65B), C66(H66A,H66B)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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
Nd1 Nd 0.95190(2) 0.91799(2) 0.22432(2) 0.01410(4) Uani 0.6667 1 d . . P A 1
O11M O 0.78564(18) 0.83911(19) 0.24416(15) 0.0250(6) Uani 1 1 d G . . . .
H11A H 0.7277 0.8649 0.2514 0.038 Uiso 1 1 d DG U . A .
H11B H 0.7800 0.7785 0.2681 0.038 Uiso 1 1 d G U . A .
O12M O 0.99045(18) 0.75745(17) 0.21086(14) 0.0200(5) Uani 1 1 d . . . . .
H12A H 0.9374 0.7223 0.2233 0.030 Uiso 1 1 d R U . A .
H12B H 1.0028 0.7607 0.1626 0.030 Uiso 1 1 d R U . . .
O13M O 1.08799(19) 0.9258(2) 0.12885(15) 0.0281(6) Uani 1 1 d G . . . .
H13A H 1.0870 0.9065 0.0877 0.042 Uiso 1 1 d G U . A .
H13B H 1.1503 0.9383 0.1323 0.042 Uiso 1 1 d G U . A .
O14M O 1.00560(19) 1.08571(18) 0.18763(15) 0.0230(6) Uani 1 1 d G . . . .
H14A H 1.0443 1.1121 0.2126 0.035 Uiso 1 1 d G U . A .
H14B H 1.0055 1.1249 0.1418 0.035 Uiso 1 1 d G U . A .
O15M O 0.8723(2) 0.9982(2) 0.31166(16) 0.0332(7) Uani 1 1 d . . . . .
H15A H 0.8513 1.0555 0.2867 0.050 Uiso 1 1 d R U . A .
H15B H 0.8183 0.9684 0.3321 0.050 Uiso 1 1 d R U . . .
N1 N 0.8183(2) 0.9743(2) 0.09545(17) 0.0201(6) Uani 1 1 d . . . . .
O11N O 0.82054(18) 1.02041(18) 0.14509(14) 0.0212(5) Uani 1 1 d . . . . .
O12N O 0.88505(19) 0.91066(19) 0.09723(15) 0.0243(6) Uani 1 1 d . . . . .
O13N O 0.7515(2) 0.9901(2) 0.04938(17) 0.0323(7) Uani 1 1 d . . . . .
O11 O 1.10575(17) 0.91608(17) 0.28614(13) 0.0177(5) Uani 1 1 d . . . . .
O12 O 1.28982(18) 0.83116(18) 0.59548(13) 0.0206(5) Uani 1 1 d . . . . .
C11 C 1.1726(2) 0.8848(2) 0.33162(18) 0.0144(7) Uani 1 1 d . . . . .
C12 C 1.2872(2) 0.8312(2) 0.52864(19) 0.0152(7) Uani 1 1 d . . . . .
C13 C 1.3178(2) 0.8780(2) 0.39705(18) 0.0139(6) Uani 1 1 d . . . . .
H13 H 1.3841 0.8770 0.3700 0.017 Uiso 1 1 calc R U . . .
C14 C 1.2711(2) 0.7778(2) 0.42069(19) 0.0141(7) Uani 1 1 d . . . . .
H14 H 1.3185 0.7269 0.4116 0.017 Uiso 1 1 calc R U . . .
N11 N 1.2447(2) 0.9387(2) 0.34707(16) 0.0146(6) Uani 1 1 d . . . . .
N12 N 1.18585(19) 0.7919(2) 0.37236(15) 0.0136(6) Uani 1 1 d . . . . .
N13 N 1.2464(2) 0.7628(2) 0.50143(16) 0.0159(6) Uani 1 1 d . . . . .
N14 N 1.3268(2) 0.9002(2) 0.46796(16) 0.0149(6) Uani 1 1 d . . . . .
C15 C 1.1203(2) 0.7149(2) 0.37094(19) 0.0148(7) Uani 1 1 d . . . . .
H15C H 1.0914 0.7294 0.3200 0.018 Uiso 1 1 calc R U . . .
H15D H 1.1599 0.6540 0.3790 0.018 Uiso 1 1 calc R U . . .
C16 C 1.2099(2) 0.6739(2) 0.55188(19) 0.0161(7) Uani 1 1 d . . . . .
H16A H 1.2344 0.6661 0.6035 0.019 Uiso 1 1 calc R U . . .
H16B H 1.2373 0.6194 0.5339 0.019 Uiso 1 1 calc R U . . .
O21 O 0.92714(17) 0.80475(18) 0.35392(13) 0.0187(5) Uani 1 1 d . . . . .
O22 O 1.07646(17) 0.68566(18) 0.67844(13) 0.0194(5) Uani 1 1 d . . . . .
C21 C 0.9508(2) 0.7475(2) 0.41452(19) 0.0139(6) Uani 1 1 d . . . . .
C22 C 1.0456(2) 0.6733(2) 0.62013(19) 0.0147(7) Uani 1 1 d . . . . .
C23 C 1.0455(2) 0.6366(2) 0.50402(18) 0.0141(7) Uani 1 1 d . . . . .
H23 H 1.0671 0.5701 0.5030 0.017 Uiso 1 1 calc R U . . .
C24 C 0.9366(2) 0.6397(2) 0.53596(18) 0.0144(7) Uani 1 1 d . . . . .
H24 H 0.9029 0.5775 0.5422 0.017 Uiso 1 1 calc R U . . .
N21 N 1.0407(2) 0.7017(2) 0.42794(15) 0.0145(6) Uani 1 1 d . . . . .
N22 N 0.8901(2) 0.7190(2) 0.47768(15) 0.0149(6) Uani 1 1 d . . . . .
N23 N 0.9490(2) 0.6585(2) 0.60807(16) 0.0148(6) Uani 1 1 d . . . . .
N24 N 1.1018(2) 0.6700(2) 0.55647(16) 0.0162(6) Uani 1 1 d . . . . .
C25 C 0.7830(2) 0.7371(3) 0.47478(19) 0.0158(7) Uani 1 1 d . . . . .
H25A H 0.7652 0.7641 0.4209 0.019 Uiso 1 1 calc R U . . .
H25B H 0.7491 0.6750 0.4948 0.019 Uiso 1 1 calc R U . . .
C26 C 0.8675(2) 0.6634(2) 0.66126(19) 0.0155(7) Uani 1 1 d . . . . .
H26A H 0.8935 0.6499 0.7130 0.019 Uiso 1 1 calc R U . . .
H26B H 0.8196 0.6128 0.6619 0.019 Uiso 1 1 calc R U . . .
O31 O 0.71478(18) 0.93455(18) 0.41555(13) 0.0201(5) Uani 1 1 d . . . . .
O32 O 0.89090(18) 0.82077(18) 0.72713(14) 0.0211(5) Uani 1 1 d . . . . .
C31 C 0.7111(2) 0.8932(3) 0.48418(19) 0.0161(7) Uani 1 1 d . . . . .
C32 C 0.8263(2) 0.8233(3) 0.68161(19) 0.0169(7) Uani 1 1 d . . . . .
C33 C 0.7265(2) 0.7732(2) 0.59918(18) 0.0145(7) Uani 1 1 d . . . . .
H33 H 0.6810 0.7175 0.6152 0.017 Uiso 1 1 calc R U . . .
C34 C 0.6787(2) 0.8649(2) 0.61521(19) 0.0146(7) Uani 1 1 d . . . . .
H34 H 0.6126 0.8518 0.6429 0.018 Uiso 1 1 calc R U . . .
N31 N 0.7460(2) 0.8023(2) 0.51742(16) 0.0160(6) Uani 1 1 d . . . . .
N32 N 0.6692(2) 0.9302(2) 0.53959(16) 0.0159(6) Uani 1 1 d . . . . .
N33 N 0.7515(2) 0.8917(2) 0.66129(16) 0.0159(6) Uani 1 1 d . . . . .
N34 N 0.8156(2) 0.7561(2) 0.64269(16) 0.0151(6) Uani 1 1 d . . . . .
C35 C 0.6158(2) 1.0218(2) 0.5245(2) 0.0170(7) Uani 1 1 d . . . . .
H35A H 0.5914 1.0384 0.4721 0.020 Uiso 1 1 calc R U . . .
H35B H 0.5569 1.0149 0.5600 0.020 Uiso 1 1 calc R U . . .
C36 C 0.7333(3) 0.9649(2) 0.70018(18) 0.0159(7) Uani 1 1 d . . . . .
H36A H 0.7745 0.9498 0.7457 0.019 Uiso 1 1 calc R U . . .
H36B H 0.6625 0.9635 0.7179 0.019 Uiso 1 1 calc R U . . .
Nd2 Nd 0.46512(2) 0.57240(2) 0.28465(2) 0.01344(4) Uani 0.6667 1 d . . P B 1
O21M O 0.59655(19) 0.5665(2) 0.37369(15) 0.0290(6) Uani 1 1 d G . . . .
H21A H 0.5882 0.5858 0.4148 0.044 Uiso 1 1 d G U . B .
H21B H 0.6610 0.5599 0.3681 0.044 Uiso 1 1 d G U . B .
O22M O 0.49142(18) 0.73312(18) 0.29559(14) 0.0224(5) Uani 1 1 d . . . . .
H22A H 0.4933 0.7311 0.3438 0.034 Uiso 1 1 d R U . B .
H22B H 0.4397 0.7702 0.2791 0.034 Uiso 1 1 d R U . . .
O23M O 0.29718(17) 0.65726(18) 0.27226(14) 0.0197(5) Uani 1 1 d . . . . .
H23A H 0.2567 0.6267 0.2516 0.029 Uiso 1 1 d R U . B .
H23B H 0.3018 0.7139 0.2396 0.029 Uiso 1 1 d R U . . .
O24M O 0.39376(19) 0.50470(18) 0.19329(15) 0.0246(6) Uani 1 1 d . . . . .
H24A H 0.3661 0.4504 0.2170 0.037 Uiso 1 1 d R U . B .
H24B H 0.3445 0.5415 0.1714 0.037 Uiso 1 1 d R U . . .
O25M O 0.5181(2) 0.40363(19) 0.31950(15) 0.0265(6) Uani 1 1 d G . . . .
H25C H 0.5500 0.3728 0.2906 0.040 Uiso 1 1 d G U . B .
H25D H 0.5075 0.3601 0.3628 0.040 Uiso 1 1 d G U . B .
N2 N 0.3226(2) 0.5143(2) 0.41386(17) 0.0171(6) Uani 1 1 d . . . . .
O21N O 0.32691(18) 0.47165(17) 0.36201(14) 0.0195(5) Uani 1 1 d . . . . .
O22N O 0.39203(17) 0.57110(18) 0.41373(14) 0.0195(5) Uani 1 1 d . . . . .
O23N O 0.25337(19) 0.50318(19) 0.46098(16) 0.0271(6) Uani 1 1 d . . . . .
O41 O 0.44799(17) 0.69229(17) 0.15920(13) 0.0175(5) Uani 1 1 d . . . . .
O42 O 0.61050(18) 0.81415(18) -0.17092(14) 0.0217(5) Uani 1 1 d . . . . .
C41 C 0.4757(2) 0.7508(2) 0.09920(19) 0.0143(7) Uani 1 1 d . . . . .
C42 C 0.5792(2) 0.8238(2) -0.1096(2) 0.0173(7) Uani 1 1 d . . . . .
C43 C 0.4694(2) 0.8634(2) -0.02010(19) 0.0152(7) Uani 1 1 d . . . . .
H43 H 0.4400 0.9298 -0.0274 0.018 Uiso 1 1 calc R U . . .
C44 C 0.5775(2) 0.8556(2) 0.00832(19) 0.0156(7) Uani 1 1 d . . . . .
H44 H 0.6007 0.9188 0.0120 0.019 Uiso 1 1 calc R U . . .
N41 N 0.4163(2) 0.7928(2) 0.04083(16) 0.0153(6) Uani 1 1 d . . . . .
N42 N 0.5688(2) 0.7857(2) 0.08232(16) 0.0160(6) Uani 1 1 d . . . . .
N43 N 0.6343(2) 0.8227(2) -0.04899(16) 0.0170(6) Uani 1 1 d . . . . .
N44 N 0.4814(2) 0.8392(2) -0.09099(16) 0.0159(6) Uani 1 1 d . . . . .
C45 C 0.6477(2) 0.7618(3) 0.1360(2) 0.0170(7) Uani 1 1 d . . . . .
H45A H 0.6909 0.8180 0.1276 0.020 Uiso 1 1 calc R U . . .
H45B H 0.6182 0.7481 0.1883 0.020 Uiso 1 1 calc R U . . .
C46 C 0.7413(2) 0.8062(3) -0.0479(2) 0.0201(7) Uani 1 1 d . . . . .
H46A H 0.7717 0.8539 -0.0267 0.024 Uiso 1 1 calc R U . . .
H46B H 0.7681 0.8161 -0.1007 0.024 Uiso 1 1 calc R U . . .
O51 O 0.61734(17) 0.56376(17) 0.21564(14) 0.0185(5) Uani 1 1 d . . . . .
O52 O 0.80619(18) 0.64697(19) -0.10433(14) 0.0211(5) Uani 1 1 d . . . . .
C51 C 0.6855(2) 0.5877(3) 0.16716(18) 0.0150(7) Uani 1 1 d . . . . .
C52 C 0.8038(2) 0.6404(3) -0.0360(2) 0.0173(7) Uani 1 1 d . . . . .
C53 C 0.7934(2) 0.6848(3) 0.07699(19) 0.0162(7) Uani 1 1 d . . . . .
H53 H 0.8458 0.7270 0.0863 0.019 Uiso 1 1 calc R U . . .
C54 C 0.8301(2) 0.5781(3) 0.09427(19) 0.0154(7) Uani 1 1 d . . . . .
H54 H 0.8959 0.5677 0.1191 0.018 Uiso 1 1 calc R U . . .
N51 N 0.7080(2) 0.6797(2) 0.12936(16) 0.0156(6) Uani 1 1 d . . . . .
N52 N 0.7511(2) 0.5261(2) 0.14532(16) 0.0154(6) Uani 1 1 d . . . . .
N53 N 0.8374(2) 0.5625(2) 0.01939(16) 0.0165(6) Uani 1 1 d . . . . .
N54 N 0.7693(2) 0.7096(2) -0.00280(16) 0.0168(6) Uani 1 1 d . . . . .
C55 C 0.7583(2) 0.4256(2) 0.18914(19) 0.0166(7) Uani 1 1 d . . . . .
H55A H 0.8280 0.4097 0.2044 0.020 Uiso 1 1 calc R U . . .
H55B H 0.7159 0.4160 0.2362 0.020 Uiso 1 1 calc R U . . .
C56 C 0.8769(2) 0.4751(3) 0.0041(2) 0.0165(7) Uani 1 1 d . . . . .
H56A H 0.8985 0.4899 -0.0503 0.020 Uiso 1 1 calc R U . . .
H56B H 0.9366 0.4531 0.0347 0.020 Uiso 1 1 calc R U . . .
O61 O 0.59110(18) 0.29713(19) 0.22409(14) 0.0238(6) Uani 1 1 d . . . . .
O62 O 0.76392(17) 0.41050(17) -0.10195(13) 0.0179(5) Uani 1 1 d . . . . .
C61 C 0.6533(2) 0.2962(3) 0.1728(2) 0.0181(7) Uani 1 1 d . . . . .
C62 C 0.7642(2) 0.3673(2) -0.03383(19) 0.0152(7) Uani 1 1 d . . . . .
C63 C 0.7980(2) 0.3291(2) 0.09558(18) 0.0145(7) Uani 1 1 d . . . . .
H63 H 0.8642 0.3091 0.1185 0.017 Uiso 1 1 calc R U . . .
C64 C 0.7449(2) 0.2439(3) 0.08023(18) 0.0151(7) Uani 1 1 d . . . . .
H64 H 0.7886 0.1846 0.0903 0.018 Uiso 1 1 calc R U . . .
N61 N 0.7285(2) 0.3604(2) 0.14767(16) 0.0161(6) Uani 1 1 d . . . . .
N62 N 0.6593(2) 0.2314(2) 0.13171(16) 0.0167(6) Uani 1 1 d . . . . .
N63 N 0.7223(2) 0.2803(2) -0.00011(16) 0.0156(6) Uani 1 1 d . . . . .
N64 N 0.8075(2) 0.3976(2) 0.02091(16) 0.0152(6) Uani 1 1 d . . . . .
C65 C 0.5963(3) 0.1488(3) 0.1455(2) 0.0187(7) Uani 1 1 d . . . . .
H65A H 0.5651 0.1363 0.1973 0.022 Uiso 1 1 calc R U . . .
H65B H 0.6383 0.0916 0.1440 0.022 Uiso 1 1 calc R U . . .
C66 C 0.6907(2) 0.2189(3) -0.04427(19) 0.0162(7) Uani 1 1 d . . . . .
H66A H 0.7236 0.1547 -0.0256 0.019 Uiso 1 1 calc R U . . .
H66B H 0.7130 0.2463 -0.0981 0.019 Uiso 1 1 calc R U . . .
N3 N 1.0323(2) 0.7850(2) 0.00788(17) 0.0195(6) Uani 1 1 d . . . . .
O31N O 1.0719(2) 0.8641(2) -0.00015(15) 0.0302(6) Uani 1 1 d . . . . .
O32N O 1.02994(19) 0.7225(2) 0.07190(15) 0.0268(6) Uani 1 1 d . . . . .
O33N O 0.9968(2) 0.7662(2) -0.04795(15) 0.0308(6) Uani 1 1 d . . . . .
N4 N 0.8705(2) 0.5781(2) 0.33028(19) 0.0276(7) Uani 1 1 d . U . . .
O41N O 0.8099(2) 0.5483(3) 0.3833(2) 0.0650(12) Uani 1 1 d . U . . .
O42N O 0.8432(2) 0.6326(2) 0.26829(17) 0.0385(7) Uani 1 1 d . U . . .
O43N O 0.9602(2) 0.5558(2) 0.34111(18) 0.0404(8) Uani 1 1 d . U . . .
N5 N 0.5303(2) 0.7233(2) 0.49158(17) 0.0200(6) Uani 1 1 d . . . . .
O51N O 0.5585(2) 0.63852(19) 0.49977(15) 0.0282(6) Uani 1 1 d . . . . .
O52N O 0.5301(2) 0.7824(2) 0.42669(15) 0.0295(6) Uani 1 1 d . . . . .
O53N O 0.5042(2) 0.7514(2) 0.54870(15) 0.0306(6) Uani 1 1 d . . . . .
N6 N 1.3635(2) 0.9249(2) 0.16083(17) 0.0205(6) Uani 1 1 d . . . . .
O61N O 1.3454(2) 0.8617(2) 0.22215(16) 0.0307(6) Uani 1 1 d . . . . .
O62N O 1.4520(2) 0.9478(2) 0.14019(19) 0.0409(8) Uani 1 1 d . . . . .
O63N O 1.2956(2) 0.9651(2) 0.11995(18) 0.0394(8) Uani 1 1 d . . . . .
N7 N 1.0211(16) 1.0166(17) 0.4665(14) 0.098(4) Uani 0.25 1 d D U P C -1
O71N O 1.011(2) 0.9536(17) 0.4333(16) 0.093(4) Uani 0.25 1 d D U P C -1
O72N O 1.0942(14) 1.012(2) 0.5059(14) 0.091(4) Uani 0.25 1 d D U P C -1
O73N O 0.9704(17) 1.0923(15) 0.4472(13) 0.106(5) Uani 0.25 1 d D U P C -1
N7A N 0.9948(14) 0.9667(13) 0.5326(10) 0.095(4) Uani 0.25 1 d D U P D -2
O71A O 0.9378(17) 0.952(2) 0.4866(14) 0.092(4) Uani 0.25 1 d D U P D -2
O72A O 0.9753(18) 1.0106(18) 0.5812(13) 0.083(5) Uani 0.25 1 d D U P D -2
O73A O 1.0806(15) 0.934(2) 0.5289(14) 0.097(4) Uani 0.25 1 d D U P D -2
N8 N 0.5328(18) 0.4956(14) 0.0285(11) 0.082(5) Uani 0.25 1 d D U P E -1
O81N O 0.5247(13) 0.5526(13) 0.0679(10) 0.061(4) Uani 0.25 1 d D U P E -1
O82N O 0.4829(19) 0.4216(13) 0.0462(12) 0.094(6) Uani 0.25 1 d D U P E -1
O83N O 0.5940(13) 0.5088(17) -0.0255(10) 0.074(5) Uani 0.25 1 d D U P E -1
N8A N 0.5026(14) 0.534(2) 0.9714(13) 0.075(4) Uani 0.25 1 d D U P F -2
O81A O 0.5840(17) 0.5734(19) 0.9583(12) 0.078(5) Uani 0.25 1 d D U P F -2
O82A O 0.4478(15) 0.5554(18) 1.0203(10) 0.082(5) Uani 0.25 1 d D U P F -2
O83A O 0.4699(14) 0.4986(15) 0.9231(9) 0.059(4) Uani 0.25 1 d D U P F -2
O1W O 0.8216(2) 1.1825(2) 0.27156(16) 0.0274(6) Uani 1 1 d G . . . .
H1WA H 0.7815 1.1849 0.3099 0.041 Uiso 1 1 d G U . . .
H1WB H 0.8732 1.2147 0.2766 0.041 Uiso 1 1 d G U . . .
O2W O 0.6032(3) 0.9207(2) 0.2542(2) 0.0551(10) Uani 1 1 d G . . . .
H2WA H 0.5797 0.9719 0.2658 0.083 Uiso 1 1 d DG U . . .
H2WB H 0.5937 0.9323 0.2055 0.083 Uiso 1 1 d DG U . . .
O3W O 0.5712(3) 1.0717(3) 0.33075(19) 0.0599(11) Uani 1 1 d G . . . .
H3WA H 0.5987 1.0216 0.3623 0.090 Uiso 1 1 d DG U . . .
H3WB H 0.5918 1.1204 0.3444 0.090 Uiso 1 1 d DG U . . .
O4W O 1.13877(19) 0.5660(2) 0.24469(16) 0.0281(6) Uani 1 1 d G . . . .
H4WA H 1.1364 0.5615 0.1981 0.042 Uiso 1 1 d G U . . .
H4WB H 1.0767 0.5735 0.2584 0.042 Uiso 1 1 d G U . . .
O5W O 0.6776(2) 0.6664(2) 0.77607(15) 0.0265(6) Uani 1 1 d G . . . .
H5WA H 0.6359 0.7095 0.7853 0.040 Uiso 1 1 d G U . . .
H5WB H 0.7259 0.6639 0.8069 0.040 Uiso 1 1 d G U . . .
O6W O 0.9954(2) 0.6081(3) 0.83323(16) 0.0430(9) Uani 1 1 d G . . . .
H6WA H 0.9415 0.6349 0.8472 0.064 Uiso 1 1 d G U . . .
H6WB H 1.0070 0.6410 0.7859 0.064 Uiso 1 1 d G U . . .
Dy2 Dy 0.46512(2) 0.57240(2) 0.28465(2) 0.01344(4) Uani 0.3333 1 d . . P B 2
Dy1 Dy 0.95190(2) 0.91799(2) 0.22432(2) 0.01410(4) Uani 0.3333 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
Nd1 O11M 2.514(2) . ?
Nd1 O12M 2.438(2) . ?
Nd1 O13M 2.454(3) . ?
Nd1 O14M 2.458(2) . ?
Nd1 O15M 2.415(3) . ?
Nd1 N1 2.943(3) . ?
Nd1 O11N 2.501(2) . ?
Nd1 O12N 2.563(2) . ?
Nd1 O11 2.400(2) . ?
Nd1 O21 2.493(2) . ?
O11M H11A 0.8714 . ?
O11M H11B 0.8691 . ?
O11M Dy1 2.514(2) . ?
O12M H12A 0.8770 . ?
O12M H12B 0.8787 . ?
O12M Dy1 2.438(2) . ?
O13M H13A 0.8737 . ?
O13M H13B 0.8726 . ?
O13M Dy1 2.454(3) . ?
O14M H14A 0.8731 . ?
O14M H14B 0.8713 . ?
O14M Dy1 2.458(2) . ?
O15M H15A 0.8708 . ?
O15M H15B 0.8732 . ?
O15M Dy1 2.415(3) . ?
N1 O11N 1.271(4) . ?
N1 O12N 1.256(4) . ?
N1 O13N 1.232(4) . ?
N1 Dy1 2.943(3) . ?
O11N Dy1 2.501(2) . ?
O12N Dy1 2.563(2) . ?
O11 C11 1.238(4) . ?
O11 Dy1 2.400(2) . ?
O12 C12 1.225(4) . ?
C11 N11 1.354(4) . ?
C11 N12 1.353(4) . ?
C12 N13 1.368(4) . ?
C12 N14 1.370(4) . ?
C13 H13 1.0000 . ?
C13 C14 1.543(5) . ?
C13 N11 1.464(4) . ?
C13 N14 1.432(4) . ?
C14 H14 1.0000 . ?
C14 N12 1.454(4) . ?
C14 N13 1.456(4) . ?
N11 C36 1.454(4) 2_776 ?
N12 C15 1.454(4) . ?
N13 C16 1.446(4) . ?
N14 C35 1.433(4) 2_776 ?
C15 H15C 0.9900 . ?
C15 H15D 0.9900 . ?
C15 N21 1.438(4) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 N24 1.454(4) . ?
O21 C21 1.231(4) . ?
O21 Dy1 2.493(2) . ?
O22 C22 1.223(4) . ?
C21 N21 1.356(4) . ?
C21 N22 1.358(4) . ?
C22 N23 1.363(4) . ?
C22 N24 1.370(4) . ?
C23 H23 1.0000 . ?
C23 C24 1.554(4) . ?
C23 N21 1.449(4) . ?
C23 N24 1.444(4) . ?
C24 H24 1.0000 . ?
C24 N22 1.472(4) . ?
C24 N23 1.438(4) . ?
N22 C25 1.455(4) . ?
N23 C26 1.445(4) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C25 N31 1.444(4) . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C26 N34 1.449(4) . ?
O31 C31 1.230(4) . ?
O32 C32 1.223(4) . ?
C31 N31 1.361(4) . ?
C31 N32 1.364(4) . ?
C32 N33 1.373(4) . ?
C32 N34 1.372(4) . ?
C33 H33 1.0000 . ?
C33 C34 1.548(5) . ?
C33 N31 1.450(4) . ?
C33 N34 1.444(4) . ?
C34 H34 1.0000 . ?
C34 N32 1.449(4) . ?
C34 N33 1.453(4) . ?
N32 C35 1.447(4) . ?
N33 C36 1.440(4) . ?
C35 N14 1.433(4) 2_776 ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 N11 1.454(4) 2_776 ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
Nd2 O21M 2.442(3) . ?
Nd2 O22M 2.430(2) . ?
Nd2 O23M 2.518(2) . ?
Nd2 O24M 2.411(3) . ?
Nd2 O25M 2.433(3) . ?
Nd2 N2 2.926(3) . ?
Nd2 O21N 2.528(2) . ?
Nd2 O22N 2.511(2) . ?
Nd2 O41 2.475(2) . ?
Nd2 O51 2.373(2) . ?
O21M H21A 0.8739 . ?
O21M H21B 0.8723 . ?
O21M Dy2 2.442(3) . ?
O22M H22A 0.8771 . ?
O22M H22B 0.8739 . ?
O22M Dy2 2.430(2) . ?
O23M H23A 0.8752 . ?
O23M H23B 0.8715 . ?
O23M Dy2 2.518(2) . ?
O24M H24A 0.8715 . ?
O24M H24B 0.8732 . ?
O24M Dy2 2.411(3) . ?
O25M H25C 0.8719 . ?
O25M H25D 0.8736 . ?
O25M Dy2 2.433(3) . ?
N2 O21N 1.266(4) . ?
N2 O22N 1.267(4) . ?
N2 O23N 1.223(4) . ?
N2 Dy2 2.926(3) . ?
O21N Dy2 2.528(2) . ?
O22N Dy2 2.511(2) . ?
O41 C41 1.236(4) . ?
O41 Dy2 2.475(2) . ?
O42 C42 1.222(4) . ?
C41 N41 1.352(4) . ?
C41 N42 1.358(4) . ?
C42 N43 1.358(4) . ?
C42 N44 1.370(4) . ?
C43 H43 1.0000 . ?
C43 C44 1.556(5) . ?
C43 N41 1.463(4) . ?
C43 N44 1.436(4) . ?
C44 H44 1.0000 . ?
C44 N42 1.448(4) . ?
C44 N43 1.445(4) . ?
N41 C66 1.451(4) 2_665 ?
N42 C45 1.445(4) . ?
N43 C46 1.450(4) . ?
N44 C65 1.451(4) 2_665 ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C45 N51 1.442(4) . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 N54 1.456(5) . ?
O51 C51 1.235(4) . ?
O51 Dy2 2.373(2) . ?
O52 C52 1.226(4) . ?
C51 N51 1.356(4) . ?
C51 N52 1.355(4) . ?
C52 N53 1.367(5) . ?
C52 N54 1.367(4) . ?
C53 H53 1.0000 . ?
C53 C54 1.553(5) . ?
C53 N51 1.452(4) . ?
C53 N54 1.452(4) . ?
C54 H54 1.0000 . ?
C54 N52 1.465(4) . ?
C54 N53 1.449(4) . ?
N52 C55 1.454(4) . ?
N53 C56 1.446(4) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C55 N61 1.444(4) . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C56 N64 1.444(4) . ?
O61 C61 1.230(4) . ?
O62 C62 1.229(4) . ?
C61 N61 1.374(4) . ?
C61 N62 1.355(4) . ?
C62 N63 1.367(4) . ?
C62 N64 1.362(4) . ?
C63 H63 1.0000 . ?
C63 C64 1.546(5) . ?
C63 N61 1.454(4) . ?
C63 N64 1.449(4) . ?
C64 H64 1.0000 . ?
C64 N62 1.438(4) . ?
C64 N63 1.459(4) . ?
N62 C65 1.448(4) . ?
N63 C66 1.445(4) . ?
C65 N44 1.451(4) 2_665 ?
C65 H65A 0.9900 . ?
C65 H65B 0.9900 . ?
C66 N41 1.451(4) 2_665 ?
C66 H66A 0.9900 . ?
C66 H66B 0.9900 . ?
N3 O31N 1.249(4) . ?
N3 O32N 1.264(4) . ?
N3 O33N 1.248(4) . ?
N4 O41N 1.230(4) . ?
N4 O42N 1.249(4) . ?
N4 O43N 1.247(4) . ?
N5 O51N 1.241(4) . ?
N5 O52N 1.254(4) . ?
N5 O53N 1.254(4) . ?
N6 O61N 1.254(4) . ?
N6 O62N 1.259(4) . ?
N6 O63N 1.230(4) . ?
N7 O71N 1.244(8) . ?
N7 O72N 1.235(8) . ?
N7 O73N 1.241(8) . ?
N7A O71A 1.232(8) . ?
N7A O72A 1.243(8) . ?
N7A O73A 1.236(8) . ?
N8 O81N 1.238(8) . ?
N8 O82N 1.241(8) . ?
N8 O83N 1.233(8) . ?
N8A O81A 1.237(8) . ?
N8A O82A 1.233(8) . ?
N8A O83A 1.242(8) . ?
O1W H1WA 0.8727 . ?
O1W H1WB 0.8728 . ?
O2W H2WA 0.8717 . ?
O2W H2WB 0.8742 . ?
O3W H3WA 0.8735 . ?
O3W H3WB 0.8695 . ?
O4W H4WA 0.8750 . ?
O4W H4WB 0.8715 . ?
O5W H5WA 0.8693 . ?
O5W H5WB 0.8730 . ?
O6W H6WA 0.8698 . ?
O6W H6WB 0.8734 . ?

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
O11M Nd1 N1 63.60(8) . . ?
O11M Nd1 O12N 69.14(9) . . ?
O12M Nd1 O11M 76.25(9) . . ?
O12M Nd1 O13M 70.25(9) . . ?
O12M Nd1 O14M 144.38(9) . . ?
O12M Nd1 N1 95.02(8) . . ?
O12M Nd1 O11N 119.37(8) . . ?
O12M Nd1 O12N 72.25(8) . . ?
O12M Nd1 O21 73.95(8) . . ?
O13M Nd1 O11M 132.42(9) . . ?
O13M Nd1 O14M 74.45(9) . . ?
O13M Nd1 N1 86.46(9) . . ?
O13M Nd1 O11N 101.15(9) . . ?
O13M Nd1 O12N 69.06(8) . . ?
O13M Nd1 O21 130.20(9) . . ?
O14M Nd1 O11M 134.42(9) . . ?
O14M Nd1 N1 87.29(8) . . ?
O14M Nd1 O11N 71.83(8) . . ?
O14M Nd1 O12N 99.52(8) . . ?
O14M Nd1 O21 129.27(8) . . ?
O15M Nd1 O11M 80.35(10) . . ?
O15M Nd1 O12M 141.31(9) . . ?
O15M Nd1 O13M 144.72(9) . . ?
O15M Nd1 O14M 71.75(9) . . ?
O15M Nd1 N1 101.62(10) . . ?
O15M Nd1 O11N 77.69(9) . . ?
O15M Nd1 O12N 126.34(9) . . ?
O15M Nd1 O21 68.65(9) . . ?
O11N Nd1 O11M 67.40(8) . . ?
O11N Nd1 N1 25.37(8) . . ?
O11N Nd1 O12N 50.36(8) . . ?
O12N Nd1 N1 25.18(8) . . ?
O11 Nd1 O11M 141.46(8) . . ?
O11 Nd1 O12M 90.55(8) . . ?
O11 Nd1 O13M 72.29(8) . . ?
O11 Nd1 O14M 74.21(8) . . ?
O11 Nd1 O15M 88.94(9) . . ?
O11 Nd1 N1 154.75(8) . . ?
O11 Nd1 O11N 145.90(8) . . ?
O11 Nd1 O12N 141.05(8) . . ?
O11 Nd1 O21 74.65(8) . . ?
O21 Nd1 O11M 66.95(8) . . ?
O21 Nd1 N1 130.53(8) . . ?
O21 Nd1 O11N 126.54(8) . . ?
O21 Nd1 O12N 129.36(8) . . ?
Nd1 O11M H11A 127.5 . . ?
Nd1 O11M H11B 121.3 . . ?
H11A O11M H11B 104.4 . . ?
Dy1 O11M H11A 127.5 . . ?
Dy1 O11M H11B 121.3 . . ?
Nd1 O12M H12A 109.4 . . ?
Nd1 O12M H12B 109.9 . . ?
H12A O12M H12B 104.2 . . ?
Dy1 O12M H12A 109.4 . . ?
Dy1 O12M H12B 109.9 . . ?
Nd1 O13M H13A 127.0 . . ?
Nd1 O13M H13B 127.7 . . ?
H13A O13M H13B 104.5 . . ?
Dy1 O13M H13A 127.0 . . ?
Dy1 O13M H13B 127.7 . . ?
Nd1 O14M H14A 127.1 . . ?
Nd1 O14M H14B 125.8 . . ?
H14A O14M H14B 104.7 . . ?
Dy1 O14M H14A 127.1 . . ?
Dy1 O14M H14B 125.8 . . ?
Nd1 O15M H15A 109.8 . . ?
Nd1 O15M H15B 109.8 . . ?
H15A O15M H15B 104.4 . . ?
Dy1 O15M H15A 109.8 . . ?
Dy1 O15M H15B 109.8 . . ?
O11N N1 Nd1 57.50(16) . . ?
O11N N1 Dy1 57.50(16) . . ?
O12N N1 Nd1 60.24(16) . . ?
O12N N1 O11N 117.1(3) . . ?
O12N N1 Dy1 60.24(16) . . ?
O13N N1 Nd1 170.1(2) . . ?
O13N N1 O11N 120.8(3) . . ?
O13N N1 O12N 122.1(3) . . ?
O13N N1 Dy1 170.1(2) . . ?
N1 O11N Nd1 97.13(19) . . ?
N1 O11N Dy1 97.13(19) . . ?
N1 O12N Nd1 94.58(19) . . ?
N1 O12N Dy1 94.58(19) . . ?
C11 O11 Nd1 158.0(2) . . ?
C11 O11 Dy1 158.0(2) . . ?
O11 C11 N11 124.9(3) . . ?
O11 C11 N12 125.4(3) . . ?
N12 C11 N11 109.7(3) . . ?
O12 C12 N13 126.6(3) . . ?
O12 C12 N14 125.2(3) . . ?
N13 C12 N14 108.1(3) . . ?
C14 C13 H13 111.6 . . ?
N11 C13 H13 111.6 . . ?
N11 C13 C14 103.7(2) . . ?
N14 C13 H13 111.6 . . ?
N14 C13 C14 103.5(3) . . ?
N14 C13 N11 114.2(3) . . ?
C13 C14 H14 111.9 . . ?
N12 C14 C13 102.6(3) . . ?
N12 C14 H14 111.9 . . ?
N12 C14 N13 114.9(3) . . ?
N13 C14 C13 103.1(3) . . ?
N13 C14 H14 111.9 . . ?
C11 N11 C13 110.9(3) . . ?
C11 N11 C36 123.2(3) . 2_776 ?
C36 N11 C13 122.3(3) 2_776 . ?
C11 N12 C14 112.4(3) . . ?
C11 N12 C15 124.3(3) . . ?
C14 N12 C15 123.3(3) . . ?
C12 N13 C14 111.6(3) . . ?
C12 N13 C16 121.7(3) . . ?
C16 N13 C14 124.4(3) . . ?
C12 N14 C13 112.7(3) . . ?
C12 N14 C35 123.7(3) . 2_776 ?
C13 N14 C35 123.0(3) . 2_776 ?
N12 C15 H15C 109.0 . . ?
N12 C15 H15D 109.0 . . ?
H15C C15 H15D 107.8 . . ?
N21 C15 N12 112.9(3) . . ?
N21 C15 H15C 109.0 . . ?
N21 C15 H15D 109.0 . . ?
N13 C16 H16A 108.9 . . ?
N13 C16 H16B 108.9 . . ?
N13 C16 N24 113.2(3) . . ?
H16A C16 H16B 107.8 . . ?
N24 C16 H16A 108.9 . . ?
N24 C16 H16B 108.9 . . ?
C21 O21 Nd1 157.3(2) . . ?
C21 O21 Dy1 157.3(2) . . ?
O21 C21 N21 125.3(3) . . ?
O21 C21 N22 125.2(3) . . ?
N21 C21 N22 109.5(3) . . ?
O22 C22 N23 125.5(3) . . ?
O22 C22 N24 126.3(3) . . ?
N23 C22 N24 108.2(3) . . ?
C24 C23 H23 111.7 . . ?
N21 C23 H23 111.7 . . ?
N21 C23 C24 102.9(3) . . ?
N24 C23 H23 111.7 . . ?
N24 C23 C24 103.0(3) . . ?
N24 C23 N21 115.2(3) . . ?
C23 C24 H24 111.7 . . ?
N22 C24 C23 102.9(3) . . ?
N22 C24 H24 111.7 . . ?
N23 C24 C23 102.9(3) . . ?
N23 C24 H24 111.7 . . ?
N23 C24 N22 115.3(3) . . ?
C15 N21 C23 124.7(3) . . ?
C21 N21 C15 122.7(3) . . ?
C21 N21 C23 112.6(3) . . ?
C21 N22 C24 111.1(3) . . ?
C21 N22 C25 121.7(3) . . ?
C25 N22 C24 123.1(3) . . ?
C22 N23 C24 112.8(3) . . ?
C22 N23 C26 123.6(3) . . ?
C24 N23 C26 123.6(3) . . ?
C22 N24 C16 123.3(3) . . ?
C22 N24 C23 111.8(3) . . ?
C23 N24 C16 122.9(3) . . ?
N22 C25 H25A 108.7 . . ?
N22 C25 H25B 108.7 . . ?
H25A C25 H25B 107.6 . . ?
N31 C25 N22 114.1(3) . . ?
N31 C25 H25A 108.7 . . ?
N31 C25 H25B 108.7 . . ?
N23 C26 H26A 109.0 . . ?
N23 C26 H26B 109.0 . . ?
N23 C26 N34 112.9(3) . . ?
H26A C26 H26B 107.8 . . ?
N34 C26 H26A 109.0 . . ?
N34 C26 H26B 109.0 . . ?
O31 C31 N31 125.9(3) . . ?
O31 C31 N32 125.5(3) . . ?
N31 C31 N32 108.5(3) . . ?
O32 C32 N33 126.7(3) . . ?
O32 C32 N34 125.3(3) . . ?
N34 C32 N33 108.0(3) . . ?
C34 C33 H33 111.8 . . ?
N31 C33 H33 111.8 . . ?
N31 C33 C34 103.4(3) . . ?
N34 C33 H33 111.8 . . ?
N34 C33 C34 103.7(3) . . ?
N34 C33 N31 113.7(3) . . ?
C33 C34 H34 111.7 . . ?
N32 C34 C33 103.0(3) . . ?
N32 C34 H34 111.7 . . ?
N32 C34 N33 114.9(3) . . ?
N33 C34 C33 103.0(3) . . ?
N33 C34 H34 111.7 . . ?
C25 N31 C33 123.6(3) . . ?
C31 N31 C25 123.4(3) . . ?
C31 N31 C33 112.3(3) . . ?
C31 N32 C34 112.5(3) . . ?
C31 N32 C35 123.9(3) . . ?
C35 N32 C34 123.5(3) . . ?
C32 N33 C34 112.2(3) . . ?
C32 N33 C36 121.7(3) . . ?
C36 N33 C34 123.6(3) . . ?
C32 N34 C26 123.4(3) . . ?
C32 N34 C33 112.4(3) . . ?
C33 N34 C26 121.5(3) . . ?
N14 C35 N32 114.6(3) 2_776 . ?
N14 C35 H35A 108.6 2_776 . ?
N14 C35 H35B 108.6 2_776 . ?
N32 C35 H35A 108.6 . . ?
N32 C35 H35B 108.6 . . ?
H35A C35 H35B 107.6 . . ?
N11 C36 H36A 108.9 2_776 . ?
N11 C36 H36B 108.9 2_776 . ?
N33 C36 N11 113.3(3) . 2_776 ?
N33 C36 H36A 108.9 . . ?
N33 C36 H36B 108.9 . . ?
H36A C36 H36B 107.7 . . ?
O21M Nd2 O23M 130.58(8) . . ?
O21M Nd2 N2 89.23(9) . . ?
O21M Nd2 O21N 105.68(9) . . ?
O21M Nd2 O22N 69.28(8) . . ?
O21M Nd2 O41 125.84(9) . . ?
O22M Nd2 O21M 70.23(9) . . ?
O22M Nd2 O23M 73.62(8) . . ?
O22M Nd2 O25M 147.33(9) . . ?
O22M Nd2 N2 96.70(8) . . ?
O22M Nd2 O21N 120.35(8) . . ?
O22M Nd2 O22N 75.19(8) . . ?
O22M Nd2 O41 69.96(8) . . ?
O23M Nd2 N2 62.70(8) . . ?
O23M Nd2 O21N 66.15(8) . . ?
O24M Nd2 O21M 148.42(9) . . ?
O24M Nd2 O22M 136.23(9) . . ?
O24M Nd2 O23M 79.98(8) . . ?
O24M Nd2 O25M 74.27(9) . . ?
O24M Nd2 N2 101.43(9) . . ?
O24M Nd2 O21N 77.26(8) . . ?
O24M Nd2 O22N 126.69(8) . . ?
O24M Nd2 O41 67.93(8) . . ?
O25M Nd2 O21M 77.19(10) . . ?
O25M Nd2 O23M 133.40(9) . . ?
O25M Nd2 N2 85.09(8) . . ?
O25M Nd2 O21N 70.64(8) . . ?
O25M Nd2 O22N 95.87(8) . . ?
O25M Nd2 O41 131.67(8) . . ?
O21N Nd2 N2 25.54(8) . . ?
O22N Nd2 O23M 69.72(8) . . ?
O22N Nd2 N2 25.52(8) . . ?
O22N Nd2 O21N 50.79(8) . . ?
O41 Nd2 O23M 67.78(8) . . ?
O41 Nd2 N2 130.46(8) . . ?
O41 Nd2 O21N 125.74(8) . . ?
O41 Nd2 O22N 130.73(8) . . ?
O51 Nd2 O21M 74.17(8) . . ?
O51 Nd2 O22M 94.68(8) . . ?
O51 Nd2 O23M 141.86(8) . . ?
O51 Nd2 O24M 85.00(8) . . ?
O51 Nd2 O25M 73.67(9) . . ?
O51 Nd2 N2 155.33(8) . . ?
O51 Nd2 O21N 143.24(8) . . ?
O51 Nd2 O22N 143.39(8) . . ?
O51 Nd2 O41 74.10(8) . . ?
Nd2 O21M H21A 123.7 . . ?
Nd2 O21M H21B 130.3 . . ?
H21A O21M H21B 104.4 . . ?
Dy2 O21M H21A 123.7 . . ?
Dy2 O21M H21B 130.3 . . ?
Nd2 O22M H22A 109.4 . . ?
Nd2 O22M H22B 109.5 . . ?
H22A O22M H22B 104.5 . . ?
Dy2 O22M H22A 109.4 . . ?
Dy2 O22M H22B 109.5 . . ?
Nd2 O23M H23A 109.3 . . ?
Nd2 O23M H23B 109.7 . . ?
H23A O23M H23B 104.2 . . ?
Dy2 O23M H23A 109.3 . . ?
Dy2 O23M H23B 109.7 . . ?
Nd2 O24M H24A 109.5 . . ?
Nd2 O24M H24B 110.0 . . ?
H24A O24M H24B 104.2 . . ?
Dy2 O24M H24A 109.5 . . ?
Dy2 O24M H24B 110.0 . . ?
Nd2 O25M H25C 127.3 . . ?
Nd2 O25M H25D 128.0 . . ?
H25C O25M H25D 104.7 . . ?
Dy2 O25M H25C 127.3 . . ?
Dy2 O25M H25D 128.0 . . ?
O21N N2 Nd2 59.41(15) . . ?
O21N N2 O22N 117.1(3) . . ?
O21N N2 Dy2 59.41(15) . . ?
O22N N2 Nd2 58.64(15) . . ?
O22N N2 Dy2 58.64(15) . . ?
O23N N2 Nd2 168.9(2) . . ?
O23N N2 O21N 121.7(3) . . ?
O23N N2 O22N 121.2(3) . . ?
O23N N2 Dy2 168.9(2) . . ?
N2 O21N Nd2 95.05(18) . . ?
N2 O21N Dy2 95.05(18) . . ?
N2 O22N Nd2 95.84(18) . . ?
N2 O22N Dy2 95.84(18) . . ?
C41 O41 Nd2 157.0(2) . . ?
C41 O41 Dy2 157.0(2) . . ?
O41 C41 N41 124.9(3) . . ?
O41 C41 N42 125.9(3) . . ?
N41 C41 N42 109.2(3) . . ?
O42 C42 N43 126.6(3) . . ?
O42 C42 N44 125.2(3) . . ?
N43 C42 N44 108.2(3) . . ?
C44 C43 H43 111.6 . . ?
N41 C43 H43 111.6 . . ?
N41 C43 C44 103.2(3) . . ?
N44 C43 H43 111.6 . . ?
N44 C43 C44 103.3(3) . . ?
N44 C43 N41 115.0(3) . . ?
C43 C44 H44 111.8 . . ?
N42 C44 C43 102.7(3) . . ?
N42 C44 H44 111.8 . . ?
N43 C44 C43 102.9(3) . . ?
N43 C44 H44 111.8 . . ?
N43 C44 N42 115.0(3) . . ?
C41 N41 C43 111.9(3) . . ?
C41 N41 C66 123.5(3) . 2_665 ?
C66 N41 C43 123.8(3) 2_665 . ?
C41 N42 C44 112.9(3) . . ?
C41 N42 C45 122.9(3) . . ?
C45 N42 C44 124.0(3) . . ?
C42 N43 C44 112.3(3) . . ?
C42 N43 C46 123.4(3) . . ?
C44 N43 C46 123.5(3) . . ?
C42 N44 C43 112.3(3) . . ?
C42 N44 C65 122.1(3) . 2_665 ?
C43 N44 C65 124.2(3) . 2_665 ?
N42 C45 H45A 109.0 . . ?
N42 C45 H45B 109.0 . . ?
H45A C45 H45B 107.8 . . ?
N51 C45 N42 112.9(3) . . ?
N51 C45 H45A 109.0 . . ?
N51 C45 H45B 109.0 . . ?
N43 C46 H46A 109.1 . . ?
N43 C46 H46B 109.1 . . ?
N43 C46 N54 112.4(3) . . ?
H46A C46 H46B 107.9 . . ?
N54 C46 H46A 109.1 . . ?
N54 C46 H46B 109.1 . . ?
C51 O51 Nd2 159.7(2) . . ?
C51 O51 Dy2 159.7(2) . . ?
O51 C51 N51 125.1(3) . . ?
O51 C51 N52 125.2(3) . . ?
N52 C51 N51 109.7(3) . . ?
O52 C52 N53 125.1(3) . . ?
O52 C52 N54 126.1(3) . . ?
N53 C52 N54 108.8(3) . . ?
C54 C53 H53 111.8 . . ?
N51 C53 H53 111.8 . . ?
N51 C53 C54 102.8(3) . . ?
N54 C53 H53 111.8 . . ?
N54 C53 C54 103.5(3) . . ?
N54 C53 N51 114.6(3) . . ?
C53 C54 H54 111.7 . . ?
N52 C54 C53 103.1(3) . . ?
N52 C54 H54 111.7 . . ?
N53 C54 C53 102.8(3) . . ?
N53 C54 H54 111.7 . . ?
N53 C54 N52 115.3(3) . . ?
C45 N51 C53 124.4(3) . . ?
C51 N51 C45 123.2(3) . . ?
C51 N51 C53 112.3(3) . . ?
C51 N52 C54 111.3(3) . . ?
C51 N52 C55 120.6(3) . . ?
C55 N52 C54 124.7(3) . . ?
C52 N53 C54 112.4(3) . . ?
C52 N53 C56 123.4(3) . . ?
C56 N53 C54 124.2(3) . . ?
C52 N54 C46 121.8(3) . . ?
C52 N54 C53 111.4(3) . . ?
C53 N54 C46 124.3(3) . . ?
N52 C55 H55A 109.0 . . ?
N52 C55 H55B 109.0 . . ?
H55A C55 H55B 107.8 . . ?
N61 C55 N52 113.1(3) . . ?
N61 C55 H55A 109.0 . . ?
N61 C55 H55B 109.0 . . ?
N53 C56 H56A 108.7 . . ?
N53 C56 H56B 108.7 . . ?
H56A C56 H56B 107.6 . . ?
N64 C56 N53 114.3(3) . . ?
N64 C56 H56A 108.7 . . ?
N64 C56 H56B 108.7 . . ?
O61 C61 N61 125.8(3) . . ?
O61 C61 N62 125.7(3) . . ?
N62 C61 N61 108.4(3) . . ?
O62 C62 N63 126.1(3) . . ?
O62 C62 N64 125.6(3) . . ?
N64 C62 N63 108.3(3) . . ?
C64 C63 H63 111.9 . . ?
N61 C63 H63 111.9 . . ?
N61 C63 C64 103.2(3) . . ?
N64 C63 H63 111.9 . . ?
N64 C63 C64 103.6(3) . . ?
N64 C63 N61 113.8(3) . . ?
C63 C64 H64 111.8 . . ?
N62 C64 C63 103.3(3) . . ?
N62 C64 H64 111.8 . . ?
N62 C64 N63 114.6(3) . . ?
N63 C64 C63 102.8(3) . . ?
N63 C64 H64 111.8 . . ?
C55 N61 C63 121.0(3) . . ?
C61 N61 C55 123.2(3) . . ?
C61 N61 C63 111.2(3) . . ?
C61 N62 C64 112.9(3) . . ?
C61 N62 C65 124.3(3) . . ?
C64 N62 C65 122.2(3) . . ?
C62 N63 C64 112.3(3) . . ?
C62 N63 C66 121.8(3) . . ?
C66 N63 C64 122.7(3) . . ?
C56 N64 C63 122.2(3) . . ?
C62 N64 C56 123.4(3) . . ?
C62 N64 C63 112.5(3) . . ?
N44 C65 H65A 108.9 2_665 . ?
N44 C65 H65B 108.9 2_665 . ?
N62 C65 N44 113.5(3) . 2_665 ?
N62 C65 H65A 108.9 . . ?
N62 C65 H65B 108.9 . . ?
H65A C65 H65B 107.7 . . ?
N41 C66 H66A 108.9 2_665 . ?
N41 C66 H66B 108.9 2_665 . ?
N63 C66 N41 113.6(3) . 2_665 ?
N63 C66 H66A 108.9 . . ?
N63 C66 H66B 108.9 . . ?
H66A C66 H66B 107.7 . . ?
O31N N3 O32N 120.6(3) . . ?
O33N N3 O31N 120.0(3) . . ?
O33N N3 O32N 119.4(3) . . ?
O41N N4 O42N 120.6(3) . . ?
O41N N4 O43N 118.3(3) . . ?
O43N N4 O42N 121.0(3) . . ?
O51N N5 O52N 120.6(3) . . ?
O51N N5 O53N 120.0(3) . . ?
O52N N5 O53N 119.3(3) . . ?
O61N N6 O62N 120.2(3) . . ?
O63N N6 O61N 120.7(3) . . ?
O63N N6 O62N 119.1(3) . . ?
O72N N7 O71N 119.5(8) . . ?
O72N N7 O73N 119.9(8) . . ?
O73N N7 O71N 119.0(8) . . ?
O71A N7A O72A 127(2) . . ?
O71A N7A O73A 115.2(19) . . ?
O73A N7A O72A 117.5(19) . . ?
O81N N8 O82N 119.5(7) . . ?
O83N N8 O81N 120.5(7) . . ?
O83N N8 O82N 119.8(7) . . ?
O81A N8A O83A 118.8(17) . . ?
O82A N8A O81A 116.1(19) . . ?
O82A N8A O83A 121.9(19) . . ?
H1WA O1W H1WB 104.4 . . ?
H2WA O2W H2WB 104.7 . . ?
H3WA O3W H3WB 104.3 . . ?
H4WA O4W H4WB 104.4 . . ?
H5WA O5W H5WB 104.4 . . ?
H6WA O6W H6WB 104.5 . . ?
O21M Dy2 O23M 130.58(8) . . ?
O21M Dy2 N2 89.23(9) . . ?
O21M Dy2 O21N 105.68(9) . . ?
O21M Dy2 O22N 69.28(8) . . ?
O21M Dy2 O41 125.84(9) . . ?
O22M Dy2 O21M 70.23(9) . . ?
O22M Dy2 O23M 73.62(8) . . ?
O22M Dy2 O25M 147.33(9) . . ?
O22M Dy2 N2 96.70(8) . . ?
O22M Dy2 O21N 120.35(8) . . ?
O22M Dy2 O22N 75.19(8) . . ?
O22M Dy2 O41 69.96(8) . . ?
O23M Dy2 N2 62.70(8) . . ?
O23M Dy2 O21N 66.15(8) . . ?
O24M Dy2 O21M 148.42(9) . . ?
O24M Dy2 O22M 136.23(9) . . ?
O24M Dy2 O23M 79.98(8) . . ?
O24M Dy2 O25M 74.27(9) . . ?
O24M Dy2 N2 101.43(9) . . ?
O24M Dy2 O21N 77.26(8) . . ?
O24M Dy2 O22N 126.69(8) . . ?
O24M Dy2 O41 67.93(8) . . ?
O25M Dy2 O21M 77.19(10) . . ?
O25M Dy2 O23M 133.40(9) . . ?
O25M Dy2 N2 85.09(8) . . ?
O25M Dy2 O21N 70.64(8) . . ?
O25M Dy2 O22N 95.87(8) . . ?
O25M Dy2 O41 131.67(8) . . ?
O21N Dy2 N2 25.54(8) . . ?
O22N Dy2 O23M 69.72(8) . . ?
O22N Dy2 N2 25.52(8) . . ?
O22N Dy2 O21N 50.79(8) . . ?
O41 Dy2 O23M 67.78(8) . . ?
O41 Dy2 N2 130.46(8) . . ?
O41 Dy2 O21N 125.74(8) . . ?
O41 Dy2 O22N 130.73(8) . . ?
O51 Dy2 O21M 74.17(8) . . ?
O51 Dy2 O22M 94.68(8) . . ?
O51 Dy2 O23M 141.86(8) . . ?
O51 Dy2 O24M 85.00(8) . . ?
O51 Dy2 O25M 73.67(9) . . ?
O51 Dy2 N2 155.33(8) . . ?
O51 Dy2 O21N 143.24(8) . . ?
O51 Dy2 O22N 143.39(8) . . ?
O51 Dy2 O41 74.10(8) . . ?
O11M Dy1 N1 63.60(8) . . ?
O11M Dy1 O12N 69.14(9) . . ?
O12M Dy1 O11M 76.25(9) . . ?
O12M Dy1 O13M 70.25(9) . . ?
O12M Dy1 O14M 144.38(9) . . ?
O12M Dy1 N1 95.02(8) . . ?
O12M Dy1 O11N 119.37(8) . . ?
O12M Dy1 O12N 72.25(8) . . ?
O12M Dy1 O21 73.95(8) . . ?
O13M Dy1 O11M 132.42(9) . . ?
O13M Dy1 O14M 74.45(9) . . ?
O13M Dy1 N1 86.46(9) . . ?
O13M Dy1 O11N 101.15(9) . . ?
O13M Dy1 O12N 69.06(8) . . ?
O13M Dy1 O21 130.20(9) . . ?
O14M Dy1 O11M 134.42(9) . . ?
O14M Dy1 N1 87.29(8) . . ?
O14M Dy1 O11N 71.83(8) . . ?
O14M Dy1 O12N 99.52(8) . . ?
O14M Dy1 O21 129.27(8) . . ?
O15M Dy1 O11M 80.35(10) . . ?
O15M Dy1 O12M 141.31(9) . . ?
O15M Dy1 O13M 144.72(9) . . ?
O15M Dy1 O14M 71.75(9) . . ?
O15M Dy1 N1 101.62(10) . . ?
O15M Dy1 O11N 77.69(9) . . ?
O15M Dy1 O12N 126.34(9) . . ?
O15M Dy1 O21 68.65(9) . . ?
O11N Dy1 O11M 67.40(8) . . ?
O11N Dy1 N1 25.37(8) . . ?
O11N Dy1 O12N 50.36(8) . . ?
O12N Dy1 N1 25.18(8) . . ?
O11 Dy1 O11M 141.46(8) . . ?
O11 Dy1 O12M 90.55(8) . . ?
O11 Dy1 O13M 72.29(8) . . ?
O11 Dy1 O14M 74.21(8) . . ?
O11 Dy1 O15M 88.94(9) . . ?
O11 Dy1 N1 154.75(8) . . ?
O11 Dy1 O11N 145.90(8) . . ?
O11 Dy1 O12N 141.05(8) . . ?
O11 Dy1 O21 74.65(8) . . ?
O21 Dy1 O11M 66.95(8) . . ?
O21 Dy1 N1 130.53(8) . . ?
O21 Dy1 O11N 126.54(8) . . ?
O21 Dy1 O12N 129.36(8) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_vrf_PLAT430_km794-2             
;
PROBLEM: Short Inter D...A Contact O23N ..O41N . 2.84 Ang.
1-x,1-y,1-z = 2_666 Check
RESPONSE: O41N atom of one of the nitrates shows unresolved
disorder which reduces the observed distance.
;
_exptl_crystal_preparation       Luminescent
####################################################################### 
# 
# 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_km808-9
_database_code_depnum_ccdc_archive 'CCDC 2382968'
loop_
_audit_author_name
_audit_author_address
'Taisiya Sukhikh'
;NIIC SB RAS
Russia
;
_audit_update_record             
;
2024-09-10 deposited with the CCDC.	2025-05-13 downloaded from the CCDC.
;
_audit_creation_date             2024-09-09
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'2(C18 H28 Dy0.19 Eu0.53 N13 O14 Tb0.28), 5(N O3), 6(H2 O)'
_chemical_formula_sum            'C36 H68 Dy0.38 Eu1.06 N31 O49 Tb0.56'
_chemical_formula_weight         2031.03
_chemical_melting_point          ?
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'
Dy Dy -0.1892 4.4098 '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'
Tb Tb -0.1723 4.1537 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   13.4119(3)
_cell_length_b                   14.4765(2)
_cell_length_c                   18.2272(4)
_cell_angle_alpha                73.8275(6)
_cell_angle_beta                 87.2830(7)
_cell_angle_gamma                87.7342(6)
_cell_volume                     3393.80(12)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9901
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      30.23
_cell_measurement_theta_min      2.73
_shelx_estimated_absorpt_T_max   0.850
_shelx_estimated_absorpt_T_min   0.757
_exptl_absorpt_coefficient_mu    2.105
_exptl_absorpt_correction_T_max  0.7461
_exptl_absorpt_correction_T_min  0.6931
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0694 before and 0.0563 after correction.
The Ratio of minimum to maximum transmission is 0.9290.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.988
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             2043
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.08
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0618
_diffrn_reflns_av_unetI/netI     0.0812
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.978
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            53733
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.978
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.573
_diffrn_reflns_theta_min         1.465
_diffrn_ambient_temperature      150(2)
_diffrn_detector                 PIXEL
_diffrn_detector_area_resol_mean 7.41
_diffrn_detector_type            'Bruker PHOTON III area detector'
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.978
_diffrn_measurement_device       'three-circle diffractometer'
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  'Incoatec HELIOS multilayer mirrors'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Incoatec IuS3.0 microfocus X-ray tube'
_diffrn_source_current           1.4
_diffrn_source_power             0.07
_diffrn_source_voltage           50.0
_diffrn_standards_interval_count .
_diffrn_standards_interval_time  .
_diffrn_standards_number         .
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                13397
_reflns_number_total             18606
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX3'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2014/7 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT  (Sheldrick, 2015)'
_refine_diff_density_max         1.251
_refine_diff_density_min         -0.821
_refine_diff_density_rms         0.144
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.991
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1209
_refine_ls_number_reflns         18606
_refine_ls_number_restraints     231
_refine_ls_R_factor_all          0.0697
_refine_ls_R_factor_gt           0.0402
_refine_ls_restrained_S_all      0.993
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0255P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0692
_refine_ls_wR_factor_ref         0.0767
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All O(H,H) groups
2. Shared sites
{Eu2, Tb2, Dy2}
{Eu1, Tb1, Dy1}
3. Restrained distances
 H3WA-H2WA
 -2.12 with sigma of 0.04
 H3WB-O12_$1
 2.1 with sigma of 0.02
 H11A-H2WB
 -2.12 with sigma of 0.04
 H15A-H1WA = H2WA-H3WA
 -2.12 with sigma of 0.02
 N7-O71N \\sim N7-O72N \\sim N7-O73N \\sim N7A-O71A \\sim N7A-O72A \\sim
N7A-O73A \\sim N8-O81N \\sim N8-
 O82N \\sim N8-O83N \\sim N8A-O81A \\sim N8A-O82A \\sim N8A-O83A
 with sigma of 0.01
 O71N-O72N \\sim O72N-O73N \\sim O73N-O71N \\sim O81N-O82N \\sim O82N-O83N
\\sim O83N-O81N
 with sigma of 0.01
4. Restrained planarity
 N7A, O71A, O72A, O73A
 with sigma of 0.03
5. Uiso/Uaniso restraints and constraints
N8 \\sim O81N \\sim O82N \\sim O83N \\sim N8A \\sim O81A \\sim O82A \\sim O83A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.01 within 2A
N7 \\sim O71N \\sim O72N \\sim O73N \\sim N7A \\sim O71A \\sim O72A \\sim O73A:
within 2A with sigma of 0.01 and sigma for terminal atoms of 0.01 within 2A
N4 \\sim O41N \\sim O42N \\sim O43N: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.01 within 2A
Uanis(O83A) \\sim Ueq: with sigma of 0.005 and sigma for terminal atoms of 0.01
Uanis(Eu1) = Uanis(Dy1) = Uanis(Tb1)
Uanis(Eu2) = Uanis(Dy2) = Uanis(Tb2)
6. Others
 Fixed Sof: Eu1(0.53) Eu2(0.53) N7(0.25) O71N(0.25) O72N(0.25) O73N(0.25)
 N7A(0.25) O71A(0.25) O72A(0.25) O73A(0.25) N8(0.25) O81N(0.25) O82N(0.25)
 O83N(0.25) N8A(0.25) O81A(0.25) O82A(0.25) O83A(0.25) Dy2(0.19) Dy1(0.19)
 Tb2(0.28) Tb1(0.28)
7.a Free rotating group:
 O11M(H11A,H11B), O13M(H13A,H13B), O14M(H14A,H14B), O21M(H21A,H21B), O25M(H25C,
 H25D), O1W(H1WA,H1WB), O2W(H2WA,H2WB), O3W(H3WA,H3WB), O4W(H4WA,H4WB),
 O5W(H5WA,H5WB), O6W(H6WA,H6WB)
7.b Rotating group:
 O12M(H12A,H12B), O15M(H15A,H15B), O22M(H22A,H22B), O23M(H23A,H23B), O24M(H24A,
 H24B)
7.c Ternary CH refined with riding coordinates:
 C13(H13), C14(H14), C23(H23), C24(H24), C33(H33), C34(H34), C43(H43),
 C44(H44), C53(H53), C54(H54), C63(H63), C64(H64)
7.d Secondary CH2 refined with riding coordinates:
 C15(H15C,H15D), C16(H16A,H16B), C25(H25A,H25B), C26(H26A,H26B), C35(H35A,
 H35B), C36(H36A,H36B), C45(H45A,H45B), C46(H46A,H46B), C55(H55A,H55B),
 C56(H56A,H56B), C65(H65A,H65B), C66(H66A,H66B)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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 0.95194(2) 0.91769(2) 0.22475(2) 0.01292(5) Uani 0.53 1 d . . P A 5
O11M O 0.78732(19) 0.84089(17) 0.24448(15) 0.0228(6) Uani 1 1 d G . . . .
H11A H 0.7284 0.8658 0.2503 0.034 Uiso 1 1 d DG U . A .
H11B H 0.7811 0.7796 0.2657 0.034 Uiso 1 1 d G U . A .
O12M O 0.99014(19) 0.76010(15) 0.21152(14) 0.0195(6) Uani 1 1 d . . . . .
H12A H 0.9378 0.7241 0.2258 0.029 Uiso 1 1 d R U . A .
H12B H 1.0001 0.7630 0.1631 0.029 Uiso 1 1 d R U . . .
O13M O 1.0857(2) 0.9262(2) 0.12993(15) 0.0262(6) Uani 1 1 d G . . . .
H13A H 1.0896 0.9113 0.0868 0.039 Uiso 1 1 d G U . A .
H13B H 1.1473 0.9324 0.1402 0.039 Uiso 1 1 d G U . A .
O14M O 1.0048(2) 1.08268(16) 0.18834(15) 0.0224(6) Uani 1 1 d G . . . .
H14A H 1.0412 1.1099 0.2143 0.034 Uiso 1 1 d G U . A .
H14B H 1.0020 1.1240 0.1434 0.034 Uiso 1 1 d G U . A .
O15M O 0.8745(2) 0.99614(17) 0.31173(16) 0.0296(7) Uani 1 1 d . . . . .
H15A H 0.8544 1.0557 0.2871 0.044 Uiso 1 1 d DR U . A .
H15B H 0.8179 0.9677 0.3321 0.044 Uiso 1 1 d R U . . .
N1 N 0.8191(2) 0.9743(2) 0.09721(17) 0.0194(7) Uani 1 1 d . . . . .
O11N O 0.82182(19) 1.01993(15) 0.14731(14) 0.0200(6) Uani 1 1 d . . . . .
O12N O 0.8861(2) 0.91035(17) 0.09869(14) 0.0227(6) Uani 1 1 d . . . . .
O13N O 0.7522(2) 0.99025(17) 0.05120(16) 0.0303(7) Uani 1 1 d . . . . .
O11 O 1.10410(18) 0.91584(15) 0.28581(14) 0.0176(5) Uani 1 1 d . . . . .
O12 O 1.28973(19) 0.83140(16) 0.59518(14) 0.0206(6) Uani 1 1 d . . . . .
C11 C 1.1716(3) 0.8851(2) 0.33087(19) 0.0129(7) Uani 1 1 d . . . . .
C12 C 1.2871(3) 0.8317(2) 0.5286(2) 0.0151(7) Uani 1 1 d . . . . .
C13 C 1.3181(3) 0.8783(2) 0.39574(19) 0.0138(7) Uani 1 1 d . . . . .
H13 H 1.3844 0.8775 0.3683 0.017 Uiso 1 1 calc R U . . .
C14 C 1.2710(2) 0.7776(2) 0.4199(2) 0.0132(7) Uani 1 1 d . . . . .
H14 H 1.3186 0.7267 0.4106 0.016 Uiso 1 1 calc R U . . .
N11 N 1.2438(2) 0.93831(18) 0.34627(16) 0.0138(6) Uani 1 1 d . . . . .
N12 N 1.1860(2) 0.79144(18) 0.37176(16) 0.0137(6) Uani 1 1 d . . . . .
N13 N 1.2467(2) 0.76264(19) 0.50114(16) 0.0144(6) Uani 1 1 d . . . . .
N14 N 1.3269(2) 0.90034(18) 0.46734(16) 0.0126(6) Uani 1 1 d . . . . .
C15 C 1.1200(3) 0.7146(2) 0.37033(19) 0.0137(7) Uani 1 1 d . . . . .
H15C H 1.0911 0.7293 0.3192 0.016 Uiso 1 1 calc R U . . .
H15D H 1.1598 0.6538 0.3781 0.016 Uiso 1 1 calc R U . . .
C16 C 1.2098(3) 0.6738(2) 0.5515(2) 0.0152(7) Uani 1 1 d . . . . .
H16A H 1.2346 0.6657 0.6033 0.018 Uiso 1 1 calc R U . . .
H16B H 1.2373 0.6194 0.5331 0.018 Uiso 1 1 calc R U . . .
O21 O 0.92741(18) 0.80511(16) 0.35336(13) 0.0173(5) Uani 1 1 d . . . . .
O22 O 1.07663(19) 0.68584(16) 0.67848(14) 0.0194(6) Uani 1 1 d . . . . .
C21 C 0.9503(3) 0.7473(2) 0.4143(2) 0.0139(7) Uani 1 1 d . . . . .
C22 C 1.0457(3) 0.6730(2) 0.6196(2) 0.0154(8) Uani 1 1 d . . . . .
C23 C 1.0454(3) 0.6362(2) 0.50386(19) 0.0137(7) Uani 1 1 d . . . . .
H23 H 1.0672 0.5696 0.5030 0.016 Uiso 1 1 calc R U . . .
C24 C 0.9364(3) 0.6395(2) 0.53567(19) 0.0138(7) Uani 1 1 d . . . . .
H24 H 0.9025 0.5774 0.5417 0.017 Uiso 1 1 calc R U . . .
N21 N 1.0404(2) 0.70106(18) 0.42722(16) 0.0128(6) Uani 1 1 d . . . . .
N22 N 0.8896(2) 0.71876(18) 0.47759(16) 0.0126(6) Uani 1 1 d . . . . .
N23 N 0.9485(2) 0.65784(19) 0.60816(16) 0.0146(6) Uani 1 1 d . . . . .
N24 N 1.1019(2) 0.66978(19) 0.55651(16) 0.0142(6) Uani 1 1 d . . . . .
C25 C 0.7827(3) 0.7373(2) 0.4744(2) 0.0153(7) Uani 1 1 d . . . . .
H25A H 0.7653 0.7647 0.4203 0.018 Uiso 1 1 calc R U . . .
H25B H 0.7485 0.6754 0.4940 0.018 Uiso 1 1 calc R U . . .
C26 C 0.8674(3) 0.6631(2) 0.6618(2) 0.0143(7) Uani 1 1 d . . . . .
H26A H 0.8940 0.6497 0.7136 0.017 Uiso 1 1 calc R U . . .
H26B H 0.8192 0.6126 0.6628 0.017 Uiso 1 1 calc R U . . .
O31 O 0.71452(19) 0.93448(16) 0.41528(14) 0.0196(6) Uani 1 1 d . . . . .
O32 O 0.89208(19) 0.82094(16) 0.72752(14) 0.0202(6) Uani 1 1 d . . . . .
C31 C 0.7103(3) 0.8939(2) 0.4844(2) 0.0152(7) Uani 1 1 d . . . . .
C32 C 0.8272(3) 0.8229(2) 0.6820(2) 0.0149(7) Uani 1 1 d . . . . .
C33 C 0.7257(3) 0.7736(2) 0.59977(19) 0.0131(7) Uani 1 1 d . . . . .
H33 H 0.6798 0.7182 0.6159 0.016 Uiso 1 1 calc R U . . .
C34 C 0.6784(3) 0.8655(2) 0.6160(2) 0.0148(7) Uani 1 1 d . . . . .
H34 H 0.6123 0.8527 0.6442 0.018 Uiso 1 1 calc R U . . .
N31 N 0.7456(2) 0.80228(19) 0.51771(16) 0.0141(6) Uani 1 1 d . . . . .
N32 N 0.6684(2) 0.93038(18) 0.54026(16) 0.0148(6) Uani 1 1 d . . . . .
N33 N 0.7522(2) 0.89202(18) 0.66202(16) 0.0153(6) Uani 1 1 d . . . . .
N34 N 0.8154(2) 0.75592(18) 0.64344(16) 0.0142(6) Uani 1 1 d . . . . .
C35 C 0.6152(3) 1.0223(2) 0.5254(2) 0.0150(7) Uani 1 1 d . . . . .
H35A H 0.5904 1.0389 0.4729 0.018 Uiso 1 1 calc R U . . .
H35B H 0.5564 1.0157 0.5612 0.018 Uiso 1 1 calc R U . . .
C36 C 0.7343(3) 0.9650(2) 0.70119(19) 0.0159(8) Uani 1 1 d . . . . .
H36A H 0.7760 0.9498 0.7466 0.019 Uiso 1 1 calc R U . . .
H36B H 0.6635 0.9637 0.7193 0.019 Uiso 1 1 calc R U . . .
Eu2 Eu 0.46459(2) 0.57279(2) 0.28439(2) 0.01298(5) Uani 0.53 1 d . . P B 3
O21M O 0.5948(2) 0.5656(2) 0.37301(16) 0.0281(6) Uani 1 1 d G . . . .
H21A H 0.5835 0.5834 0.4145 0.042 Uiso 1 1 d G U . B .
H21B H 0.6595 0.5601 0.3690 0.042 Uiso 1 1 d G U . B .
O22M O 0.49141(19) 0.73112(16) 0.29581(14) 0.0218(6) Uani 1 1 d . . . . .
H22A H 0.4968 0.7286 0.3439 0.033 Uiso 1 1 d R U . B .
H22B H 0.4383 0.7673 0.2819 0.033 Uiso 1 1 d R U . . .
O23M O 0.29775(18) 0.65603(16) 0.27216(14) 0.0198(6) Uani 1 1 d . . . . .
H23A H 0.2573 0.6264 0.2502 0.030 Uiso 1 1 d R U . B .
H23B H 0.3025 0.7137 0.2403 0.030 Uiso 1 1 d R U . . .
O24M O 0.39462(19) 0.50604(16) 0.19373(15) 0.0229(6) Uani 1 1 d . . . . .
H24A H 0.3637 0.4513 0.2172 0.034 Uiso 1 1 d R U . B .
H24B H 0.3453 0.5442 0.1690 0.034 Uiso 1 1 d R U . . .
O25M O 0.5177(2) 0.40600(16) 0.31914(16) 0.0249(6) Uani 1 1 d G . . . .
H25C H 0.5429 0.3738 0.2886 0.037 Uiso 1 1 d G U . B .
H25D H 0.5005 0.3621 0.3608 0.037 Uiso 1 1 d G U . B .
N2 N 0.3233(2) 0.51455(19) 0.41286(18) 0.0173(7) Uani 1 1 d . . . . .
O21N O 0.32727(19) 0.47229(15) 0.36102(14) 0.0195(6) Uani 1 1 d . . . . .
O22N O 0.39269(18) 0.57122(15) 0.41270(14) 0.0177(6) Uani 1 1 d . . . . .
O23N O 0.2541(2) 0.50223(17) 0.46129(16) 0.0265(6) Uani 1 1 d . . . . .
O41 O 0.44773(18) 0.69240(16) 0.15944(14) 0.0179(5) Uani 1 1 d . . . . .
O42 O 0.61239(19) 0.81399(16) -0.17088(14) 0.0210(6) Uani 1 1 d . . . . .
C41 C 0.4756(3) 0.7515(2) 0.1000(2) 0.0138(7) Uani 1 1 d . . . . .
C42 C 0.5798(3) 0.8237(2) -0.1095(2) 0.0162(8) Uani 1 1 d . . . . .
C43 C 0.4689(3) 0.8638(2) -0.0201(2) 0.0152(7) Uani 1 1 d . . . . .
H43 H 0.4395 0.9302 -0.0274 0.018 Uiso 1 1 calc R U . . .
C44 C 0.5775(3) 0.8556(2) 0.0089(2) 0.0162(8) Uani 1 1 d . . . . .
H44 H 0.6005 0.9188 0.0129 0.019 Uiso 1 1 calc R U . . .
N41 N 0.4160(2) 0.79350(18) 0.04086(16) 0.0147(6) Uani 1 1 d . . . . .
N42 N 0.5683(2) 0.78592(19) 0.08334(16) 0.0161(6) Uani 1 1 d . . . . .
N43 N 0.6351(2) 0.82328(19) -0.04819(16) 0.0155(6) Uani 1 1 d . . . . .
N44 N 0.4815(2) 0.83945(19) -0.09097(17) 0.0161(6) Uani 1 1 d . . . . .
C45 C 0.6477(3) 0.7620(2) 0.1371(2) 0.0159(8) Uani 1 1 d . . . . .
H45A H 0.6182 0.7486 0.1897 0.019 Uiso 1 1 calc R U . . .
H45B H 0.6910 0.8182 0.1285 0.019 Uiso 1 1 calc R U . . .
C46 C 0.7422(3) 0.8061(2) -0.0471(2) 0.0173(8) Uani 1 1 d . . . . .
H46A H 0.7729 0.8535 -0.0257 0.021 Uiso 1 1 calc R U . . .
H46B H 0.7690 0.8160 -0.1002 0.021 Uiso 1 1 calc R U . . .
O51 O 0.61544(18) 0.56393(15) 0.21619(14) 0.0166(5) Uani 1 1 d . . . . .
O52 O 0.80627(19) 0.64677(17) -0.10424(14) 0.0209(6) Uani 1 1 d . . . . .
C51 C 0.6844(3) 0.5878(2) 0.16811(19) 0.0131(7) Uani 1 1 d . . . . .
C52 C 0.8044(3) 0.6402(2) -0.0358(2) 0.0166(8) Uani 1 1 d . . . . .
C53 C 0.7937(3) 0.6841(2) 0.0785(2) 0.0156(7) Uani 1 1 d . . . . .
H53 H 0.8463 0.7260 0.0881 0.019 Uiso 1 1 calc R U . . .
C54 C 0.8304(3) 0.5773(2) 0.0953(2) 0.0155(7) Uani 1 1 d . . . . .
H54 H 0.8962 0.5664 0.1205 0.019 Uiso 1 1 calc R U . . .
N51 N 0.7083(2) 0.67951(19) 0.13043(16) 0.0145(6) Uani 1 1 d . . . . .
N52 N 0.7505(2) 0.52595(19) 0.14619(16) 0.0140(6) Uani 1 1 d . . . . .
N53 N 0.8380(2) 0.56203(19) 0.02044(16) 0.0152(6) Uani 1 1 d . . . . .
N54 N 0.7700(2) 0.70937(19) -0.00197(16) 0.0162(6) Uani 1 1 d . . . . .
C55 C 0.7571(3) 0.4254(2) 0.19080(19) 0.0161(7) Uani 1 1 d . . . . .
H55A H 0.8267 0.4094 0.2067 0.019 Uiso 1 1 calc R U . . .
H55B H 0.7139 0.4165 0.2377 0.019 Uiso 1 1 calc R U . . .
C56 C 0.8771(3) 0.4751(2) 0.0043(2) 0.0162(7) Uani 1 1 d . . . . .
H56A H 0.9375 0.4528 0.0342 0.019 Uiso 1 1 calc R U . . .
H56B H 0.8976 0.4900 -0.0505 0.019 Uiso 1 1 calc R U . . .
O61 O 0.5895(2) 0.29657(17) 0.22537(15) 0.0231(6) Uani 1 1 d . . . . .
O62 O 0.76333(18) 0.40998(16) -0.10187(14) 0.0178(5) Uani 1 1 d . . . . .
C61 C 0.6519(3) 0.2959(2) 0.1743(2) 0.0151(7) Uani 1 1 d . . . . .
C62 C 0.7645(3) 0.3671(2) -0.0331(2) 0.0147(7) Uani 1 1 d . . . . .
C63 C 0.7970(3) 0.3294(2) 0.09631(19) 0.0147(7) Uani 1 1 d . . . . .
H63 H 0.8635 0.3095 0.1191 0.018 Uiso 1 1 calc R U . . .
C64 C 0.7450(3) 0.2439(2) 0.08062(19) 0.0138(7) Uani 1 1 d . . . . .
H64 H 0.7893 0.1849 0.0907 0.017 Uiso 1 1 calc R U . . .
N61 N 0.7277(2) 0.35979(19) 0.14928(16) 0.0155(6) Uani 1 1 d . . . . .
N62 N 0.6585(2) 0.23097(19) 0.13247(16) 0.0159(6) Uani 1 1 d . . . . .
N63 N 0.7225(2) 0.27992(19) 0.00034(16) 0.0151(6) Uani 1 1 d . . . . .
N64 N 0.8069(2) 0.39759(19) 0.02189(16) 0.0145(6) Uani 1 1 d . . . . .
C65 C 0.5954(3) 0.1488(2) 0.1457(2) 0.0188(8) Uani 1 1 d . . . . .
H65A H 0.6376 0.0916 0.1443 0.023 Uiso 1 1 calc R U . . .
H65B H 0.5636 0.1364 0.1975 0.023 Uiso 1 1 calc R U . . .
C66 C 0.6912(3) 0.2188(2) -0.0444(2) 0.0145(7) Uani 1 1 d . . . . .
H66A H 0.7247 0.1548 -0.0261 0.017 Uiso 1 1 calc R U . . .
H66B H 0.7134 0.2468 -0.0984 0.017 Uiso 1 1 calc R U . . .
N3 N 1.0327(2) 0.7866(2) 0.00777(18) 0.0211(7) Uani 1 1 d . . . . .
O31N O 1.0720(2) 0.86545(18) 0.00031(15) 0.0279(7) Uani 1 1 d . . . . .
O32N O 1.0298(2) 0.72428(17) 0.07171(15) 0.0254(6) Uani 1 1 d . . . . .
O33N O 0.9978(2) 0.76784(19) -0.04865(15) 0.0305(7) Uani 1 1 d . . . . .
N4 N 0.8690(3) 0.5783(2) 0.3297(2) 0.0296(8) Uani 1 1 d . U . . .
O41N O 0.8079(3) 0.5458(3) 0.3812(2) 0.0753(14) Uani 1 1 d . U . . .
O42N O 0.8436(2) 0.6344(2) 0.26885(17) 0.0432(8) Uani 1 1 d . U . . .
O43N O 0.9593(2) 0.5557(2) 0.34095(19) 0.0422(8) Uani 1 1 d . U . . .
N5 N 0.5302(2) 0.7230(2) 0.49166(18) 0.0209(7) Uani 1 1 d . . . . .
O51N O 0.5585(2) 0.63783(17) 0.49962(16) 0.0277(7) Uani 1 1 d . . . . .
O52N O 0.5290(2) 0.78210(18) 0.42609(15) 0.0289(7) Uani 1 1 d . . . . .
O53N O 0.5042(2) 0.75082(19) 0.54891(16) 0.0300(7) Uani 1 1 d . . . . .
N6 N 1.3630(3) 0.9248(2) 0.16074(19) 0.0216(7) Uani 1 1 d . . . . .
O61N O 1.3450(2) 0.86062(17) 0.22195(16) 0.0300(7) Uani 1 1 d . . . . .
O62N O 1.4514(2) 0.94807(19) 0.14105(18) 0.0373(8) Uani 1 1 d . . . . .
O63N O 1.2950(2) 0.96549(19) 0.11959(16) 0.0350(7) Uani 1 1 d . . . . .
N7 N 1.0200(14) 1.0159(15) 0.4674(13) 0.090(3) Uani 0.25 1 d D U P C -1
O71N O 1.0074(17) 0.9530(14) 0.4346(13) 0.084(4) Uani 0.25 1 d D U P C -1
O72N O 1.0946(13) 1.0106(19) 0.5056(13) 0.082(4) Uani 0.25 1 d D U P C -1
O73N O 0.9711(16) 1.0926(12) 0.4476(12) 0.098(5) Uani 0.25 1 d D U P C -1
N7A N 0.9935(13) 0.9662(11) 0.5346(9) 0.086(3) Uani 0.25 1 d D U P D -2
O71A O 0.9388(16) 0.9507(16) 0.4876(13) 0.085(4) Uani 0.25 1 d D U P D -2
O72A O 0.9711(14) 1.0104(15) 0.5824(11) 0.072(5) Uani 0.25 1 d D U P D -2
O73A O 1.0790(14) 0.9326(18) 0.5312(13) 0.088(4) Uani 0.25 1 d D U P D -2
N8 N 0.5257(16) 0.4976(15) 0.0246(11) 0.077(5) Uani 0.25 1 d D U P E -1
O81N O 0.5239(13) 0.5518(12) 0.0670(9) 0.053(4) Uani 0.25 1 d D U P E -1
O82N O 0.475(2) 0.4242(13) 0.0438(12) 0.087(5) Uani 0.25 1 d D U P E -1
O83N O 0.5937(14) 0.5039(18) -0.0243(9) 0.076(5) Uani 0.25 1 d D U P E -1
N8A N 0.4966(17) 0.543(3) 0.9641(15) 0.091(5) Uani 0.25 1 d D U P F -2
O81A O 0.5848(18) 0.567(2) 0.9608(15) 0.088(5) Uani 0.25 1 d D U P F -2
O82A O 0.4529(17) 0.5579(17) 1.0210(12) 0.090(5) Uani 0.25 1 d D U P F -2
O83A O 0.4674(19) 0.4985(17) 0.9208(13) 0.087(6) Uani 0.25 1 d D U P F -2
O1W O 0.8229(2) 1.18088(18) 0.27180(15) 0.0262(6) Uani 1 1 d G . . . .
H1WA H 0.7785 1.1762 0.3089 0.039 Uiso 1 1 d DG U . . .
H1WB H 0.8704 1.2136 0.2829 0.039 Uiso 1 1 d G U . . .
O2W O 0.6034(2) 0.9206(2) 0.2545(2) 0.0474(9) Uani 1 1 d G . . . .
H2WA H 0.5726 0.9600 0.2769 0.071 Uiso 1 1 d DG U . . .
H2WB H 0.5723 0.9285 0.2122 0.071 Uiso 1 1 d DG U . . .
O3W O 0.5721(3) 1.0703(3) 0.33122(18) 0.0501(9) Uani 1 1 d G . . . .
H3WA H 0.5985 1.0223 0.3658 0.075 Uiso 1 1 d DG U . . .
H3WB H 0.5964 1.1212 0.3392 0.075 Uiso 1 1 d DG U . . .
O4W O 1.1384(2) 0.5662(2) 0.24469(16) 0.0280(6) Uani 1 1 d G . . . .
H4WA H 1.1398 0.5604 0.1983 0.042 Uiso 1 1 d G U . . .
H4WB H 1.0752 0.5693 0.2569 0.042 Uiso 1 1 d G U . . .
O5W O 0.6764(2) 0.66507(18) 0.77646(16) 0.0264(6) Uani 1 1 d G . . . .
H5WA H 0.6309 0.7050 0.7858 0.040 Uiso 1 1 d G U . . .
H5WB H 0.7192 0.6592 0.8120 0.040 Uiso 1 1 d G U . . .
O6W O 0.9959(2) 0.6069(2) 0.83326(17) 0.0427(8) Uani 1 1 d G . . . .
H6WA H 0.9389 0.6315 0.8440 0.064 Uiso 1 1 d G U . . .
H6WB H 1.0140 0.6441 0.7886 0.064 Uiso 1 1 d G U . . .
Dy2 Dy 0.46459(2) 0.57279(2) 0.28439(2) 0.01298(5) Uani 0.19 1 d . . P B 2
Dy1 Dy 0.95194(2) 0.91769(2) 0.22475(2) 0.01292(5) Uani 0.19 1 d . . P A 2
Tb2 Tb 0.46459(2) 0.57279(2) 0.28439(2) 0.01298(5) Uani 0.28 1 d . . P B 4
Tb1 Tb 0.95194(2) 0.91769(2) 0.22475(2) 0.01292(5) Uani 0.28 1 d . . P A 6


_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 O11M 2.477(2) . ?
Eu1 O12M 2.393(2) . ?
Eu1 H12A 2.8104 . ?
Eu1 H12B 2.8126 . ?
Eu1 O13M 2.413(3) . ?
Eu1 O14M 2.420(2) . ?
Eu1 O15M 2.374(3) . ?
Eu1 H15A 2.8130 . ?
Eu1 H15B 2.8180 . ?
Eu1 N1 2.909(3) . ?
Eu1 O11N 2.469(2) . ?
Eu1 O12N 2.531(2) . ?
Eu1 O11 2.366(2) . ?
Eu1 O21 2.470(2) . ?
O11M H11A 0.8695 . ?
O11M H11B 0.8695 . ?
O11M Dy1 2.477(2) . ?
O11M Tb1 2.477(2) . ?
O12M H12A 0.8765 . ?
O12M H12B 0.8750 . ?
O12M Dy1 2.393(2) . ?
O12M Tb1 2.393(2) . ?
O13M H13A 0.8705 . ?
O13M H13B 0.8704 . ?
O13M Dy1 2.413(3) . ?
O13M Tb1 2.413(3) . ?
O14M H14A 0.8710 . ?
O14M H14B 0.8707 . ?
O14M Dy1 2.420(2) . ?
O14M Tb1 2.420(2) . ?
O15M H15A 0.8927 . ?
O15M H15B 0.8937 . ?
O15M Dy1 2.374(3) . ?
O15M Tb1 2.374(3) . ?
N1 O11N 1.270(4) . ?
N1 O12N 1.260(4) . ?
N1 O13N 1.229(4) . ?
N1 Dy1 2.909(3) . ?
N1 Tb1 2.909(3) . ?
O11N Dy1 2.469(2) . ?
O11N Tb1 2.469(2) . ?
O12N Dy1 2.531(2) . ?
O12N Tb1 2.531(2) . ?
O11 C11 1.236(4) . ?
O11 Dy1 2.366(2) . ?
O11 Tb1 2.366(2) . ?
O12 C12 1.214(4) . ?
C11 N11 1.348(4) . ?
C11 N12 1.364(4) . ?
C12 N13 1.375(4) . ?
C12 N14 1.374(4) . ?
C13 H13 1.0000 . ?
C13 C14 1.552(4) . ?
C13 N11 1.463(4) . ?
C13 N14 1.438(4) . ?
C14 H14 1.0000 . ?
C14 N12 1.445(4) . ?
C14 N13 1.459(4) . ?
N11 C36 1.458(4) 2_776 ?
N12 C15 1.455(4) . ?
N13 C16 1.446(4) . ?
N14 C35 1.426(4) 2_776 ?
C15 H15C 0.9900 . ?
C15 H15D 0.9900 . ?
C15 N21 1.432(4) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 N24 1.449(4) . ?
O21 C21 1.234(4) . ?
O21 Dy1 2.470(2) . ?
O21 Tb1 2.470(2) . ?
O22 C22 1.231(4) . ?
C21 N21 1.356(4) . ?
C21 N22 1.355(4) . ?
C22 N23 1.366(4) . ?
C22 N24 1.356(5) . ?
C23 H23 1.0000 . ?
C23 C24 1.552(5) . ?
C23 N21 1.453(4) . ?
C23 N24 1.445(4) . ?
C24 H24 1.0000 . ?
C24 N22 1.469(4) . ?
C24 N23 1.436(4) . ?
N22 C25 1.449(4) . ?
N23 C26 1.442(4) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C25 N31 1.448(4) . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C26 N34 1.450(4) . ?
O31 C31 1.233(4) . ?
O32 C32 1.224(4) . ?
C31 N31 1.372(4) . ?
C31 N32 1.361(4) . ?
C32 N33 1.378(4) . ?
C32 N34 1.365(4) . ?
C33 H33 1.0000 . ?
C33 C34 1.548(5) . ?
C33 N31 1.451(4) . ?
C33 N34 1.449(4) . ?
C34 H34 1.0000 . ?
C34 N32 1.447(4) . ?
C34 N33 1.455(4) . ?
N32 C35 1.447(4) . ?
N33 C36 1.438(4) . ?
C35 N14 1.427(4) 2_776 ?
C35 H35A 0.9900 . ?
C35 H35B 0.9900 . ?
C36 N11 1.458(4) 2_776 ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
Eu2 O21M 2.414(3) . ?
Eu2 O22M 2.401(2) . ?
Eu2 H22A 2.8173 . ?
Eu2 H22B 2.8118 . ?
Eu2 O23M 2.489(2) . ?
Eu2 O24M 2.378(2) . ?
Eu2 O25M 2.407(2) . ?
Eu2 N2 2.897(3) . ?
Eu2 O21N 2.509(2) . ?
Eu2 O22N 2.482(2) . ?
Eu2 O41 2.461(2) . ?
Eu2 O51 2.342(2) . ?
O21M H21A 0.8704 . ?
O21M H21B 0.8696 . ?
O21M Dy2 2.414(3) . ?
O21M Tb2 2.414(3) . ?
O22M H22A 0.8740 . ?
O22M H22B 0.8721 . ?
O22M Dy2 2.401(2) . ?
O22M Tb2 2.401(2) . ?
O23M H23A 0.8796 . ?
O23M H23B 0.8771 . ?
O23M Dy2 2.489(2) . ?
O23M Tb2 2.489(2) . ?
O24M H24A 0.8968 . ?
O24M H24B 0.8980 . ?
O24M Dy2 2.378(2) . ?
O24M Tb2 2.378(2) . ?
O25M H25C 0.8688 . ?
O25M H25D 0.8718 . ?
O25M Dy2 2.407(2) . ?
O25M Tb2 2.407(2) . ?
N2 O21N 1.259(4) . ?
N2 O22N 1.264(3) . ?
N2 O23N 1.233(4) . ?
N2 Dy2 2.897(3) . ?
N2 Tb2 2.897(3) . ?
O21N Dy2 2.509(2) . ?
O21N Tb2 2.509(2) . ?
O22N Dy2 2.482(2) . ?
O22N Tb2 2.482(2) . ?
O41 C41 1.232(4) . ?
O41 Dy2 2.461(2) . ?
O41 Tb2 2.461(2) . ?
O42 C42 1.225(4) . ?
C41 N41 1.360(4) . ?
C41 N42 1.347(4) . ?
C42 N43 1.368(5) . ?
C42 N44 1.372(5) . ?
C43 H43 1.0000 . ?
C43 C44 1.561(5) . ?
C43 N41 1.459(4) . ?
C43 N44 1.432(4) . ?
C44 H44 1.0000 . ?
C44 N42 1.451(4) . ?
C44 N43 1.437(5) . ?
N41 C66 1.452(4) 2_665 ?
N42 C45 1.447(4) . ?
N43 C46 1.448(4) . ?
N44 C65 1.441(4) 2_665 ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C45 N51 1.448(4) . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 N54 1.457(4) . ?
O51 C51 1.234(4) . ?
O51 Dy2 2.342(2) . ?
O51 Tb2 2.342(2) . ?
O52 C52 1.224(4) . ?
C51 N51 1.357(4) . ?
C51 N52 1.360(4) . ?
C52 N53 1.375(4) . ?
C52 N54 1.370(4) . ?
C53 H53 1.0000 . ?
C53 C54 1.555(4) . ?
C53 N51 1.442(4) . ?
C53 N54 1.456(4) . ?
C54 H54 1.0000 . ?
C54 N52 1.465(4) . ?
C54 N53 1.441(4) . ?
N52 C55 1.458(4) . ?
N53 C56 1.444(4) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C55 N61 1.446(4) . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C56 N64 1.450(4) . ?
O61 C61 1.224(4) . ?
O62 C62 1.235(4) . ?
C61 N61 1.375(4) . ?
C61 N62 1.364(4) . ?
C62 N63 1.369(4) . ?
C62 N64 1.357(4) . ?
C63 H63 1.0000 . ?
C63 C64 1.544(5) . ?
C63 N61 1.452(4) . ?
C63 N64 1.442(4) . ?
C64 H64 1.0000 . ?
C64 N62 1.445(4) . ?
C64 N63 1.452(4) . ?
N62 C65 1.446(4) . ?
N63 C66 1.445(4) . ?
C65 N44 1.441(4) 2_665 ?
C65 H65A 0.9900 . ?
C65 H65B 0.9900 . ?
C66 N41 1.452(4) 2_665 ?
C66 H66A 0.9900 . ?
C66 H66B 0.9900 . ?
N3 O31N 1.246(4) . ?
N3 O32N 1.260(4) . ?
N3 O33N 1.250(4) . ?
N4 O41N 1.220(4) . ?
N4 O42N 1.232(4) . ?
N4 O43N 1.253(4) . ?
N5 O51N 1.247(4) . ?
N5 O52N 1.261(4) . ?
N5 O53N 1.249(4) . ?
N6 O61N 1.257(4) . ?
N6 O62N 1.254(4) . ?
N6 O63N 1.232(4) . ?
N7 O71N 1.241(8) . ?
N7 O72N 1.233(8) . ?
N7 O73N 1.239(8) . ?
N7A O71A 1.227(8) . ?
N7A O72A 1.236(8) . ?
N7A O73A 1.233(8) . ?
N8 O81N 1.243(8) . ?
N8 O82N 1.240(8) . ?
N8 O83N 1.232(8) . ?
N8A O81A 1.237(9) . ?
N8A O82A 1.232(8) . ?
N8A O83A 1.240(8) . ?
O1W H1WA 0.8694 . ?
O1W H1WB 0.8717 . ?
O2W H2WA 0.8708 . ?
O2W H2WB 0.8709 . ?
O3W H3WA 0.8728 . ?
O3W H3WB 0.8692 . ?
O4W H4WA 0.8718 . ?
O4W H4WB 0.8683 . ?
O5W H5WA 0.8675 . ?
O5W H5WB 0.8705 . ?
O6W H6WA 0.8669 . ?
O6W H6WB 0.8708 . ?

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
O11M Eu1 H12A 59.8 . . ?
O11M Eu1 H12B 81.1 . . ?
O11M Eu1 H15A 84.5 . . ?
O11M Eu1 H15B 63.5 . . ?
O11M Eu1 N1 63.57(8) . . ?
O11M Eu1 O12N 69.31(9) . . ?
O12M Eu1 O11M 76.59(9) . . ?
O12M Eu1 H12A 17.1 . . ?
O12M Eu1 H12B 17.0 . . ?
O12M Eu1 O13M 70.54(9) . . ?
O12M Eu1 O14M 144.34(9) . . ?
O12M Eu1 H15A 156.2 . . ?
O12M Eu1 H15B 127.4 . . ?
O12M Eu1 N1 95.42(8) . . ?
O12M Eu1 O11N 120.07(8) . . ?
O12M Eu1 O12N 72.29(8) . . ?
O12M Eu1 O21 73.68(8) . . ?
H12A Eu1 H12B 28.4 . . ?
H12A Eu1 H15A 140.3 . . ?
H12A Eu1 H15B 112.2 . . ?
H12B Eu1 H15A 165.4 . . ?
H12B Eu1 H15B 140.2 . . ?
O13M Eu1 O11M 132.63(9) . . ?
O13M Eu1 H12A 86.2 . . ?
O13M Eu1 H12B 58.4 . . ?
O13M Eu1 O14M 74.13(10) . . ?
O13M Eu1 H15A 133.2 . . ?
O13M Eu1 H15B 161.4 . . ?
O13M Eu1 N1 86.35(9) . . ?
O13M Eu1 O11N 101.13(9) . . ?
O13M Eu1 O12N 68.76(9) . . ?
O13M Eu1 O21 130.46(9) . . ?
O14M Eu1 O11M 134.12(9) . . ?
O14M Eu1 H12A 160.2 . . ?
O14M Eu1 H12B 131.8 . . ?
O14M Eu1 H15A 59.1 . . ?
O14M Eu1 H15B 87.5 . . ?
O14M Eu1 N1 86.98(8) . . ?
O14M Eu1 O11N 71.39(8) . . ?
O14M Eu1 O12N 99.39(8) . . ?
O14M Eu1 O21 129.59(8) . . ?
O15M Eu1 O11M 80.36(9) . . ?
O15M Eu1 O12M 141.11(8) . . ?
O15M Eu1 H12A 127.9 . . ?
O15M Eu1 H12B 156.3 . . ?
O15M Eu1 O13M 144.43(9) . . ?
O15M Eu1 O14M 71.85(9) . . ?
O15M Eu1 H15A 17.3 . . ?
O15M Eu1 H15B 17.2 . . ?
O15M Eu1 N1 101.81(9) . . ?
O15M Eu1 O11N 77.58(9) . . ?
O15M Eu1 O12N 126.93(9) . . ?
O15M Eu1 O21 68.58(8) . . ?
H15A Eu1 H15B 28.9 . . ?
N1 Eu1 H12A 89.8 . . ?
N1 Eu1 H12B 82.8 . . ?
N1 Eu1 H15A 88.9 . . ?
N1 Eu1 H15B 96.0 . . ?
O11N Eu1 O11M 67.39(8) . . ?
O11N Eu1 H12A 111.5 . . ?
O11N Eu1 H12B 108.4 . . ?
O11N Eu1 H15A 63.5 . . ?
O11N Eu1 H15B 75.2 . . ?
O11N Eu1 N1 25.68(8) . . ?
O11N Eu1 O12N 51.07(8) . . ?
O11N Eu1 O21 126.40(8) . . ?
O12N Eu1 H12A 70.9 . . ?
O12N Eu1 H12B 58.1 . . ?
O12N Eu1 H15A 114.5 . . ?
O12N Eu1 H15B 118.6 . . ?
O12N Eu1 N1 25.58(8) . . ?
O11 Eu1 O11M 141.58(8) . . ?
O11 Eu1 O12M 90.48(8) . . ?
O11 Eu1 H12A 102.1 . . ?
O11 Eu1 H12B 97.0 . . ?
O11 Eu1 O13M 72.47(9) . . ?
O11 Eu1 O14M 74.25(8) . . ?
O11 Eu1 O15M 88.50(9) . . ?
O11 Eu1 H15A 95.6 . . ?
O11 Eu1 H15B 99.9 . . ?
O11 Eu1 N1 154.71(8) . . ?
O11 Eu1 O11N 145.44(7) . . ?
O11 Eu1 O12N 140.91(9) . . ?
O11 Eu1 O21 74.75(8) . . ?
O21 Eu1 O11M 66.93(8) . . ?
O21 Eu1 H12A 65.6 . . ?
O21 Eu1 H12B 90.6 . . ?
O21 Eu1 H15A 85.7 . . ?
O21 Eu1 H15B 60.2 . . ?
O21 Eu1 N1 130.49(8) . . ?
O21 Eu1 O12N 129.23(8) . . ?
Eu1 O11M H11A 129.3 . . ?
Eu1 O11M H11B 122.0 . . ?
H11A O11M H11B 104.5 . . ?
Dy1 O11M H11A 129.3 . . ?
Dy1 O11M H11B 122.0 . . ?
Tb1 O11M H11A 129.3 . . ?
Tb1 O11M H11B 122.0 . . ?
Eu1 O12M H12A 109.5 . . ?
Eu1 O12M H12B 109.8 . . ?
H12A O12M H12B 104.1 . . ?
Dy1 O12M H12A 109.5 . . ?
Dy1 O12M H12B 109.8 . . ?
Tb1 O12M H12A 109.5 . . ?
Tb1 O12M H12B 109.8 . . ?
Eu1 O13M H13A 132.5 . . ?
Eu1 O13M H13B 121.3 . . ?
H13A O13M H13B 104.6 . . ?
Dy1 O13M H13A 132.5 . . ?
Dy1 O13M H13B 121.3 . . ?
Tb1 O13M H13A 132.5 . . ?
Tb1 O13M H13B 121.3 . . ?
Eu1 O14M H14A 127.2 . . ?
Eu1 O14M H14B 127.3 . . ?
H14A O14M H14B 104.5 . . ?
Dy1 O14M H14A 127.2 . . ?
Dy1 O14M H14B 127.3 . . ?
Tb1 O14M H14A 127.2 . . ?
Tb1 O14M H14B 127.3 . . ?
Eu1 O15M H15A 110.5 . . ?
Eu1 O15M H15B 110.8 . . ?
H15A O15M H15B 103.5 . . ?
Dy1 O15M H15A 110.5 . . ?
Dy1 O15M H15B 110.8 . . ?
Tb1 O15M H15A 110.5 . . ?
Tb1 O15M H15B 110.8 . . ?
O11N N1 Eu1 57.38(16) . . ?
O11N N1 Dy1 57.38(16) . . ?
O11N N1 Tb1 57.38(16) . . ?
O12N N1 Eu1 60.16(17) . . ?
O12N N1 O11N 116.9(3) . . ?
O12N N1 Dy1 60.16(17) . . ?
O12N N1 Tb1 60.16(17) . . ?
O13N N1 Eu1 170.1(2) . . ?
O13N N1 O11N 121.0(3) . . ?
O13N N1 O12N 122.1(3) . . ?
O13N N1 Dy1 170.1(2) . . ?
O13N N1 Tb1 170.1(2) . . ?
N1 O11N Eu1 96.94(18) . . ?
N1 O11N Dy1 96.94(18) . . ?
N1 O11N Tb1 96.94(18) . . ?
N1 O12N Eu1 94.3(2) . . ?
N1 O12N Dy1 94.3(2) . . ?
N1 O12N Tb1 94.3(2) . . ?
C11 O11 Eu1 158.4(2) . . ?
C11 O11 Dy1 158.4(2) . . ?
C11 O11 Tb1 158.4(2) . . ?
O11 C11 N11 125.4(3) . . ?
O11 C11 N12 125.4(3) . . ?
N11 C11 N12 109.2(3) . . ?
O12 C12 N13 126.5(3) . . ?
O12 C12 N14 125.7(3) . . ?
N14 C12 N13 107.8(3) . . ?
C14 C13 H13 111.9 . . ?
N11 C13 H13 111.9 . . ?
N11 C13 C14 103.2(3) . . ?
N14 C13 H13 111.9 . . ?
N14 C13 C14 103.2(3) . . ?
N14 C13 N11 114.0(3) . . ?
C13 C14 H14 111.8 . . ?
N12 C14 C13 102.5(2) . . ?
N12 C14 H14 111.8 . . ?
N12 C14 N13 115.1(3) . . ?
N13 C14 C13 103.2(3) . . ?
N13 C14 H14 111.8 . . ?
C11 N11 C13 111.6(2) . . ?
C11 N11 C36 123.0(3) . 2_776 ?
C36 N11 C13 121.9(3) 2_776 . ?
C11 N12 C14 112.6(3) . . ?
C11 N12 C15 123.8(3) . . ?
C14 N12 C15 123.5(3) . . ?
C12 N13 C14 111.7(3) . . ?
C12 N13 C16 122.0(3) . . ?
C16 N13 C14 124.2(3) . . ?
C12 N14 C13 113.2(3) . . ?
C12 N14 C35 123.6(3) . 2_776 ?
C35 N14 C13 122.6(3) 2_776 . ?
N12 C15 H15C 108.9 . . ?
N12 C15 H15D 108.9 . . ?
H15C C15 H15D 107.7 . . ?
N21 C15 N12 113.4(3) . . ?
N21 C15 H15C 108.9 . . ?
N21 C15 H15D 108.9 . . ?
N13 C16 H16A 108.9 . . ?
N13 C16 H16B 108.9 . . ?
N13 C16 N24 113.5(3) . . ?
H16A C16 H16B 107.7 . . ?
N24 C16 H16A 108.9 . . ?
N24 C16 H16B 108.9 . . ?
C21 O21 Eu1 157.9(2) . . ?
C21 O21 Dy1 157.9(2) . . ?
C21 O21 Tb1 157.9(2) . . ?
O21 C21 N21 124.6(3) . . ?
O21 C21 N22 125.7(3) . . ?
N22 C21 N21 109.7(3) . . ?
O22 C22 N23 125.0(3) . . ?
O22 C22 N24 126.1(3) . . ?
N24 C22 N23 108.9(3) . . ?
C24 C23 H23 111.7 . . ?
N21 C23 H23 111.7 . . ?
N21 C23 C24 102.6(3) . . ?
N24 C23 H23 111.7 . . ?
N24 C23 C24 103.1(3) . . ?
N24 C23 N21 115.3(3) . . ?
C23 C24 H24 111.6 . . ?
N22 C24 C23 103.2(3) . . ?
N22 C24 H24 111.6 . . ?
N23 C24 C23 103.0(3) . . ?
N23 C24 H24 111.6 . . ?
N23 C24 N22 115.2(3) . . ?
C15 N21 C23 124.7(3) . . ?
C21 N21 C15 122.9(3) . . ?
C21 N21 C23 112.4(3) . . ?
C21 N22 C24 111.0(3) . . ?
C21 N22 C25 121.3(3) . . ?
C25 N22 C24 123.4(3) . . ?
C22 N23 C24 112.2(3) . . ?
C22 N23 C26 123.6(3) . . ?
C24 N23 C26 124.2(3) . . ?
C22 N24 C16 123.8(3) . . ?
C22 N24 C23 111.5(3) . . ?
C23 N24 C16 122.7(3) . . ?
N22 C25 H25A 108.8 . . ?
N22 C25 H25B 108.8 . . ?
H25A C25 H25B 107.7 . . ?
N31 C25 N22 114.0(3) . . ?
N31 C25 H25A 108.8 . . ?
N31 C25 H25B 108.8 . . ?
N23 C26 H26A 109.0 . . ?
N23 C26 H26B 109.0 . . ?
N23 C26 N34 113.0(3) . . ?
H26A C26 H26B 107.8 . . ?
N34 C26 H26A 109.0 . . ?
N34 C26 H26B 109.0 . . ?
O31 C31 N31 125.0(3) . . ?
O31 C31 N32 126.5(3) . . ?
N32 C31 N31 108.4(3) . . ?
O32 C32 N33 126.0(3) . . ?
O32 C32 N34 125.9(3) . . ?
N34 C32 N33 108.0(3) . . ?
C34 C33 H33 111.8 . . ?
N31 C33 H33 111.8 . . ?
N31 C33 C34 103.6(2) . . ?
N34 C33 H33 111.8 . . ?
N34 C33 C34 103.7(3) . . ?
N34 C33 N31 113.4(3) . . ?
C33 C34 H34 111.7 . . ?
N32 C34 C33 102.9(3) . . ?
N32 C34 H34 111.7 . . ?
N32 C34 N33 115.2(3) . . ?
N33 C34 C33 103.0(3) . . ?
N33 C34 H34 111.7 . . ?
C25 N31 C33 124.1(3) . . ?
C31 N31 C25 123.3(3) . . ?
C31 N31 C33 111.9(3) . . ?
C31 N32 C34 112.9(3) . . ?
C31 N32 C35 123.7(3) . . ?
C34 N32 C35 123.4(3) . . ?
C32 N33 C34 112.2(3) . . ?
C32 N33 C36 121.9(3) . . ?
C36 N33 C34 123.4(3) . . ?
C32 N34 C26 123.3(3) . . ?
C32 N34 C33 112.5(3) . . ?
C33 N34 C26 121.6(3) . . ?
N14 C35 N32 114.6(3) 2_776 . ?
N14 C35 H35A 108.6 2_776 . ?
N14 C35 H35B 108.6 2_776 . ?
N32 C35 H35A 108.6 . . ?
N32 C35 H35B 108.6 . . ?
H35A C35 H35B 107.6 . . ?
N11 C36 H36A 108.9 2_776 . ?
N11 C36 H36B 108.9 2_776 . ?
N33 C36 N11 113.4(3) . 2_776 ?
N33 C36 H36A 108.9 . . ?
N33 C36 H36B 108.9 . . ?
H36A C36 H36B 107.7 . . ?
O21M Eu2 H22A 58.7 . . ?
O21M Eu2 H22B 86.2 . . ?
O21M Eu2 O23M 131.01(9) . . ?
O21M Eu2 N2 89.07(9) . . ?
O21M Eu2 O21N 105.52(9) . . ?
O21M Eu2 O22N 69.07(9) . . ?
O21M Eu2 O41 126.03(9) . . ?
O22M Eu2 O21M 70.33(9) . . ?
O22M Eu2 H22A 17.0 . . ?
O22M Eu2 H22B 17.0 . . ?
O22M Eu2 O23M 74.20(8) . . ?
O22M Eu2 O25M 146.77(9) . . ?
O22M Eu2 N2 96.96(8) . . ?
O22M Eu2 O21N 120.76(8) . . ?
O22M Eu2 O22N 75.20(8) . . ?
O22M Eu2 O41 69.98(8) . . ?
H22A Eu2 H22B 28.4 . . ?
O23M Eu2 H22A 78.2 . . ?
O23M Eu2 H22B 57.6 . . ?
O23M Eu2 N2 62.78(8) . . ?
O23M Eu2 O21N 66.11(8) . . ?
O24M Eu2 O21M 147.94(9) . . ?
O24M Eu2 O22M 136.54(8) . . ?
O24M Eu2 H22A 151.6 . . ?
O24M Eu2 H22B 123.2 . . ?
O24M Eu2 O23M 79.92(8) . . ?
O24M Eu2 O25M 74.42(9) . . ?
O24M Eu2 N2 101.48(9) . . ?
O24M Eu2 O21N 77.15(8) . . ?
O24M Eu2 O22N 126.96(8) . . ?
O24M Eu2 O41 68.11(8) . . ?
O25M Eu2 O21M 76.54(10) . . ?
O25M Eu2 H22A 134.0 . . ?
O25M Eu2 H22B 162.4 . . ?
O25M Eu2 O23M 133.32(9) . . ?
O25M Eu2 N2 84.86(8) . . ?
O25M Eu2 O21N 70.50(9) . . ?
O25M Eu2 O22N 95.63(8) . . ?
O25M Eu2 O41 131.96(9) . . ?
N2 Eu2 H22A 84.3 . . ?
N2 Eu2 H22B 91.4 . . ?
O21N Eu2 H22A 109.7 . . ?
O21N Eu2 H22B 111.6 . . ?
O21N Eu2 N2 25.67(8) . . ?
O22N Eu2 H22A 60.5 . . ?
O22N Eu2 H22B 74.5 . . ?
O22N Eu2 O23M 69.98(8) . . ?
O22N Eu2 N2 25.73(7) . . ?
O22N Eu2 O21N 51.12(7) . . ?
O41 Eu2 H22A 86.9 . . ?
O41 Eu2 H22B 62.1 . . ?
O41 Eu2 O23M 67.86(8) . . ?
O41 Eu2 N2 130.63(8) . . ?
O41 Eu2 O21N 125.85(8) . . ?
O41 Eu2 O22N 130.81(8) . . ?
O51 Eu2 O21M 74.07(9) . . ?
O51 Eu2 O22M 94.55(8) . . ?
O51 Eu2 H22A 101.6 . . ?
O51 Eu2 H22B 105.4 . . ?
O51 Eu2 O23M 142.05(8) . . ?
O51 Eu2 O24M 84.88(9) . . ?
O51 Eu2 O25M 73.52(9) . . ?
O51 Eu2 N2 155.03(8) . . ?
O51 Eu2 O21N 142.90(8) . . ?
O51 Eu2 O22N 143.09(8) . . ?
O51 Eu2 O41 74.22(8) . . ?
Eu2 O21M H21A 121.4 . . ?
Eu2 O21M H21B 132.7 . . ?
H21A O21M H21B 104.3 . . ?
Dy2 O21M H21A 121.4 . . ?
Dy2 O21M H21B 132.7 . . ?
Tb2 O21M H21A 121.4 . . ?
Tb2 O21M H21B 132.7 . . ?
Eu2 O22M H22A 109.6 . . ?
Eu2 O22M H22B 109.3 . . ?
H22A O22M H22B 104.5 . . ?
Dy2 O22M H22A 109.6 . . ?
Dy2 O22M H22B 109.3 . . ?
Tb2 O22M H22A 109.6 . . ?
Tb2 O22M H22B 109.3 . . ?
Eu2 O23M H23A 109.8 . . ?
Eu2 O23M H23B 109.7 . . ?
H23A O23M H23B 104.1 . . ?
Dy2 O23M H23A 109.8 . . ?
Dy2 O23M H23B 109.7 . . ?
Tb2 O23M H23A 109.8 . . ?
Tb2 O23M H23B 109.7 . . ?
Eu2 O24M H24A 110.8 . . ?
Eu2 O24M H24B 111.3 . . ?
H24A O24M H24B 103.2 . . ?
Dy2 O24M H24A 110.8 . . ?
Dy2 O24M H24B 111.3 . . ?
Tb2 O24M H24A 110.8 . . ?
Tb2 O24M H24B 111.3 . . ?
Eu2 O25M H25C 126.8 . . ?
Eu2 O25M H25D 126.6 . . ?
H25C O25M H25D 104.5 . . ?
Dy2 O25M H25C 126.8 . . ?
Dy2 O25M H25D 126.6 . . ?
Tb2 O25M H25C 126.8 . . ?
Tb2 O25M H25D 126.6 . . ?
O21N N2 Eu2 59.69(17) . . ?
O21N N2 O22N 117.2(3) . . ?
O21N N2 Dy2 59.69(17) . . ?
O21N N2 Tb2 59.69(17) . . ?
O22N N2 Eu2 58.47(17) . . ?
O22N N2 Dy2 58.47(17) . . ?
O22N N2 Tb2 58.47(17) . . ?
O23N N2 Eu2 169.7(2) . . ?
O23N N2 O21N 121.5(3) . . ?
O23N N2 O22N 121.2(3) . . ?
O23N N2 Dy2 169.7(2) . . ?
O23N N2 Tb2 169.7(2) . . ?
N2 O21N Eu2 94.64(19) . . ?
N2 O21N Dy2 94.64(19) . . ?
N2 O21N Tb2 94.64(19) . . ?
N2 O22N Eu2 95.80(19) . . ?
N2 O22N Dy2 95.80(19) . . ?
N2 O22N Tb2 95.80(19) . . ?
C41 O41 Eu2 156.9(2) . . ?
C41 O41 Dy2 156.9(2) . . ?
C41 O41 Tb2 156.9(2) . . ?
O41 C41 N41 124.6(3) . . ?
O41 C41 N42 126.1(3) . . ?
N42 C41 N41 109.2(3) . . ?
O42 C42 N43 126.1(3) . . ?
O42 C42 N44 125.7(3) . . ?
N43 C42 N44 108.1(3) . . ?
C44 C43 H43 111.7 . . ?
N41 C43 H43 111.7 . . ?
N41 C43 C44 102.9(3) . . ?
N44 C43 H43 111.7 . . ?
N44 C43 C44 103.2(3) . . ?
N44 C43 N41 115.0(3) . . ?
C43 C44 H44 111.6 . . ?
N42 C44 C43 102.7(3) . . ?
N42 C44 H44 111.6 . . ?
N43 C44 C43 103.2(3) . . ?
N43 C44 H44 111.6 . . ?
N43 C44 N42 115.3(3) . . ?
C41 N41 C43 112.0(3) . . ?
C41 N41 C66 123.1(3) . 2_665 ?
C66 N41 C43 124.1(3) 2_665 . ?
C41 N42 C44 113.0(3) . . ?
C41 N42 C45 123.1(3) . . ?
C45 N42 C44 123.7(3) . . ?
C42 N43 C44 112.1(3) . . ?
C42 N43 C46 123.0(3) . . ?
C44 N43 C46 124.2(3) . . ?
C42 N44 C43 112.4(3) . . ?
C42 N44 C65 121.8(3) . 2_665 ?
C43 N44 C65 124.3(3) . 2_665 ?
N42 C45 H45A 109.0 . . ?
N42 C45 H45B 109.0 . . ?
N42 C45 N51 113.0(3) . . ?
H45A C45 H45B 107.8 . . ?
N51 C45 H45A 109.0 . . ?
N51 C45 H45B 109.0 . . ?
N43 C46 H46A 109.1 . . ?
N43 C46 H46B 109.1 . . ?
N43 C46 N54 112.5(3) . . ?
H46A C46 H46B 107.8 . . ?
N54 C46 H46A 109.1 . . ?
N54 C46 H46B 109.1 . . ?
C51 O51 Eu2 159.8(2) . . ?
C51 O51 Dy2 159.8(2) . . ?
C51 O51 Tb2 159.8(2) . . ?
O51 C51 N51 125.7(3) . . ?
O51 C51 N52 125.1(3) . . ?
N51 C51 N52 109.2(3) . . ?
O52 C52 N53 125.6(3) . . ?
O52 C52 N54 126.2(3) . . ?
N54 C52 N53 108.2(3) . . ?
C54 C53 H53 111.7 . . ?
N51 C53 H53 111.7 . . ?
N51 C53 C54 103.1(3) . . ?
N51 C53 N54 114.6(3) . . ?
N54 C53 H53 111.7 . . ?
N54 C53 C54 103.3(3) . . ?
C53 C54 H54 111.7 . . ?
N52 C54 C53 102.7(3) . . ?
N52 C54 H54 111.7 . . ?
N53 C54 C53 102.9(3) . . ?
N53 C54 H54 111.7 . . ?
N53 C54 N52 115.4(3) . . ?
C51 N51 C45 122.6(3) . . ?
C51 N51 C53 112.6(3) . . ?
C53 N51 C45 124.5(3) . . ?
C51 N52 C54 111.5(3) . . ?
C51 N52 C55 120.1(3) . . ?
C55 N52 C54 124.8(3) . . ?
C52 N53 C54 112.8(3) . . ?
C52 N53 C56 122.5(3) . . ?
C54 N53 C56 124.7(3) . . ?
C52 N54 C46 121.6(3) . . ?
C52 N54 C53 111.6(3) . . ?
C53 N54 C46 124.3(3) . . ?
N52 C55 H55A 109.0 . . ?
N52 C55 H55B 109.0 . . ?
H55A C55 H55B 107.8 . . ?
N61 C55 N52 113.1(3) . . ?
N61 C55 H55A 109.0 . . ?
N61 C55 H55B 109.0 . . ?
N53 C56 H56A 108.8 . . ?
N53 C56 H56B 108.8 . . ?
N53 C56 N64 113.9(3) . . ?
H56A C56 H56B 107.7 . . ?
N64 C56 H56A 108.8 . . ?
N64 C56 H56B 108.8 . . ?
O61 C61 N61 126.3(3) . . ?
O61 C61 N62 125.6(3) . . ?
N62 C61 N61 108.1(3) . . ?
O62 C62 N63 125.1(3) . . ?
O62 C62 N64 126.3(3) . . ?
N64 C62 N63 108.6(3) . . ?
C64 C63 H63 111.5 . . ?
N61 C63 H63 111.5 . . ?
N61 C63 C64 103.6(3) . . ?
N64 C63 H63 111.5 . . ?
N64 C63 C64 103.7(3) . . ?
N64 C63 N61 114.5(3) . . ?
C63 C64 H64 111.9 . . ?
N62 C64 C63 103.1(3) . . ?
N62 C64 H64 111.9 . . ?
N62 C64 N63 114.5(3) . . ?
N63 C64 C63 102.9(2) . . ?
N63 C64 H64 111.9 . . ?
C55 N61 C63 121.2(3) . . ?
C61 N61 C55 123.2(3) . . ?
C61 N61 C63 111.6(3) . . ?
C61 N62 C64 112.9(3) . . ?
C61 N62 C65 124.2(3) . . ?
C64 N62 C65 122.3(3) . . ?
C62 N63 C64 111.9(3) . . ?
C62 N63 C66 121.8(3) . . ?
C66 N63 C64 123.1(3) . . ?
C62 N64 C56 122.6(3) . . ?
C62 N64 C63 112.4(3) . . ?
C63 N64 C56 122.9(3) . . ?
N44 C65 N62 113.9(3) 2_665 . ?
N44 C65 H65A 108.8 2_665 . ?
N44 C65 H65B 108.8 2_665 . ?
N62 C65 H65A 108.8 . . ?
N62 C65 H65B 108.8 . . ?
H65A C65 H65B 107.7 . . ?
N41 C66 H66A 108.9 2_665 . ?
N41 C66 H66B 108.9 2_665 . ?
N63 C66 N41 113.6(3) . 2_665 ?
N63 C66 H66A 108.9 . . ?
N63 C66 H66B 108.9 . . ?
H66A C66 H66B 107.7 . . ?
O31N N3 O32N 120.4(3) . . ?
O31N N3 O33N 120.2(3) . . ?
O33N N3 O32N 119.4(3) . . ?
O41N N4 O42N 121.2(4) . . ?
O41N N4 O43N 118.3(4) . . ?
O42N N4 O43N 120.5(4) . . ?
O51N N5 O52N 120.5(3) . . ?
O51N N5 O53N 120.0(3) . . ?
O53N N5 O52N 119.5(3) . . ?
O62N N6 O61N 119.7(3) . . ?
O63N N6 O61N 121.0(3) . . ?
O63N N6 O62N 119.3(3) . . ?
O72N N7 O71N 119.3(8) . . ?
O72N N7 O73N 119.9(8) . . ?
O73N N7 O71N 118.8(8) . . ?
O71A N7A O72A 127.0(19) . . ?
O71A N7A O73A 113.2(18) . . ?
O73A N7A O72A 119.8(18) . . ?
O82N N8 O81N 118.9(8) . . ?
O83N N8 O81N 119.4(8) . . ?
O83N N8 O82N 119.3(8) . . ?
O81A N8A O83A 121(2) . . ?
O82A N8A O81A 110(2) . . ?
O82A N8A O83A 128(2) . . ?
H1WA O1W H1WB 104.4 . . ?
H2WA O2W H2WB 104.6 . . ?
H3WA O3W H3WB 104.5 . . ?
H4WA O4W H4WB 104.3 . . ?
H5WA O5W H5WB 104.4 . . ?
H6WA O6W H6WB 104.4 . . ?
O21M Dy2 O23M 131.01(9) . . ?
O21M Dy2 N2 89.07(9) . . ?
O21M Dy2 O21N 105.52(9) . . ?
O21M Dy2 O22N 69.07(9) . . ?
O21M Dy2 O41 126.03(9) . . ?
O22M Dy2 O21M 70.33(9) . . ?
O22M Dy2 O23M 74.20(8) . . ?
O22M Dy2 O25M 146.77(9) . . ?
O22M Dy2 N2 96.96(8) . . ?
O22M Dy2 O21N 120.76(8) . . ?
O22M Dy2 O22N 75.20(8) . . ?
O22M Dy2 O41 69.98(8) . . ?
O23M Dy2 N2 62.78(8) . . ?
O23M Dy2 O21N 66.11(8) . . ?
O24M Dy2 O21M 147.94(9) . . ?
O24M Dy2 O22M 136.54(8) . . ?
O24M Dy2 O23M 79.92(8) . . ?
O24M Dy2 O25M 74.42(9) . . ?
O24M Dy2 N2 101.48(9) . . ?
O24M Dy2 O21N 77.15(8) . . ?
O24M Dy2 O22N 126.96(8) . . ?
O24M Dy2 O41 68.11(8) . . ?
O25M Dy2 O21M 76.54(10) . . ?
O25M Dy2 O23M 133.32(9) . . ?
O25M Dy2 N2 84.86(8) . . ?
O25M Dy2 O21N 70.50(9) . . ?
O25M Dy2 O22N 95.63(8) . . ?
O25M Dy2 O41 131.96(9) . . ?
O21N Dy2 N2 25.67(8) . . ?
O22N Dy2 O23M 69.98(8) . . ?
O22N Dy2 N2 25.73(7) . . ?
O22N Dy2 O21N 51.12(7) . . ?
O41 Dy2 O23M 67.86(8) . . ?
O41 Dy2 N2 130.63(8) . . ?
O41 Dy2 O21N 125.85(8) . . ?
O41 Dy2 O22N 130.81(8) . . ?
O51 Dy2 O21M 74.07(9) . . ?
O51 Dy2 O22M 94.55(8) . . ?
O51 Dy2 O23M 142.05(8) . . ?
O51 Dy2 O24M 84.88(9) . . ?
O51 Dy2 O25M 73.52(9) . . ?
O51 Dy2 N2 155.03(8) . . ?
O51 Dy2 O21N 142.90(8) . . ?
O51 Dy2 O22N 143.09(8) . . ?
O51 Dy2 O41 74.22(8) . . ?
O11M Dy1 N1 63.57(8) . . ?
O11M Dy1 O12N 69.31(9) . . ?
O12M Dy1 O11M 76.59(9) . . ?
O12M Dy1 O13M 70.54(9) . . ?
O12M Dy1 O14M 144.34(9) . . ?
O12M Dy1 N1 95.42(8) . . ?
O12M Dy1 O11N 120.07(8) . . ?
O12M Dy1 O12N 72.29(8) . . ?
O12M Dy1 O21 73.68(8) . . ?
O13M Dy1 O11M 132.63(9) . . ?
O13M Dy1 O14M 74.13(10) . . ?
O13M Dy1 N1 86.35(9) . . ?
O13M Dy1 O11N 101.13(9) . . ?
O13M Dy1 O12N 68.76(9) . . ?
O13M Dy1 O21 130.46(9) . . ?
O14M Dy1 O11M 134.12(9) . . ?
O14M Dy1 N1 86.98(8) . . ?
O14M Dy1 O11N 71.39(8) . . ?
O14M Dy1 O12N 99.39(8) . . ?
O14M Dy1 O21 129.59(8) . . ?
O15M Dy1 O11M 80.36(9) . . ?
O15M Dy1 O12M 141.11(8) . . ?
O15M Dy1 O13M 144.43(9) . . ?
O15M Dy1 O14M 71.85(9) . . ?
O15M Dy1 N1 101.81(9) . . ?
O15M Dy1 O11N 77.58(9) . . ?
O15M Dy1 O12N 126.93(9) . . ?
O15M Dy1 O21 68.58(8) . . ?
O11N Dy1 O11M 67.39(8) . . ?
O11N Dy1 N1 25.68(8) . . ?
O11N Dy1 O12N 51.07(8) . . ?
O11N Dy1 O21 126.40(8) . . ?
O12N Dy1 N1 25.58(8) . . ?
O11 Dy1 O11M 141.58(8) . . ?
O11 Dy1 O12M 90.48(8) . . ?
O11 Dy1 O13M 72.47(9) . . ?
O11 Dy1 O14M 74.25(8) . . ?
O11 Dy1 O15M 88.50(9) . . ?
O11 Dy1 N1 154.71(8) . . ?
O11 Dy1 O11N 145.44(7) . . ?
O11 Dy1 O12N 140.91(9) . . ?
O11 Dy1 O21 74.75(8) . . ?
O21 Dy1 O11M 66.93(8) . . ?
O21 Dy1 N1 130.49(8) . . ?
O21 Dy1 O12N 129.23(8) . . ?
O21M Tb2 O23M 131.01(9) . . ?
O21M Tb2 N2 89.07(9) . . ?
O21M Tb2 O21N 105.52(9) . . ?
O21M Tb2 O22N 69.07(9) . . ?
O21M Tb2 O41 126.03(9) . . ?
O22M Tb2 O21M 70.33(9) . . ?
O22M Tb2 O23M 74.20(8) . . ?
O22M Tb2 O25M 146.77(9) . . ?
O22M Tb2 N2 96.96(8) . . ?
O22M Tb2 O21N 120.76(8) . . ?
O22M Tb2 O22N 75.20(8) . . ?
O22M Tb2 O41 69.98(8) . . ?
O23M Tb2 N2 62.78(8) . . ?
O23M Tb2 O21N 66.11(8) . . ?
O24M Tb2 O21M 147.94(9) . . ?
O24M Tb2 O22M 136.54(8) . . ?
O24M Tb2 O23M 79.92(8) . . ?
O24M Tb2 O25M 74.42(9) . . ?
O24M Tb2 N2 101.48(9) . . ?
O24M Tb2 O21N 77.15(8) . . ?
O24M Tb2 O22N 126.96(8) . . ?
O24M Tb2 O41 68.11(8) . . ?
O25M Tb2 O21M 76.54(10) . . ?
O25M Tb2 O23M 133.32(9) . . ?
O25M Tb2 N2 84.86(8) . . ?
O25M Tb2 O21N 70.50(9) . . ?
O25M Tb2 O22N 95.63(8) . . ?
O25M Tb2 O41 131.96(9) . . ?
O21N Tb2 N2 25.67(8) . . ?
O22N Tb2 O23M 69.98(8) . . ?
O22N Tb2 N2 25.73(7) . . ?
O22N Tb2 O21N 51.12(7) . . ?
O41 Tb2 O23M 67.86(8) . . ?
O41 Tb2 N2 130.63(8) . . ?
O41 Tb2 O21N 125.85(8) . . ?
O41 Tb2 O22N 130.81(8) . . ?
O51 Tb2 O21M 74.07(9) . . ?
O51 Tb2 O22M 94.55(8) . . ?
O51 Tb2 O23M 142.05(8) . . ?
O51 Tb2 O24M 84.88(9) . . ?
O51 Tb2 O25M 73.52(9) . . ?
O51 Tb2 N2 155.03(8) . . ?
O51 Tb2 O21N 142.90(8) . . ?
O51 Tb2 O22N 143.09(8) . . ?
O51 Tb2 O41 74.22(8) . . ?
O11M Tb1 N1 63.57(8) . . ?
O11M Tb1 O12N 69.31(9) . . ?
O12M Tb1 O11M 76.59(9) . . ?
O12M Tb1 O13M 70.54(9) . . ?
O12M Tb1 O14M 144.34(9) . . ?
O12M Tb1 N1 95.42(8) . . ?
O12M Tb1 O11N 120.07(8) . . ?
O12M Tb1 O12N 72.29(8) . . ?
O12M Tb1 O21 73.68(8) . . ?
O13M Tb1 O11M 132.63(9) . . ?
O13M Tb1 O14M 74.13(10) . . ?
O13M Tb1 N1 86.35(9) . . ?
O13M Tb1 O11N 101.13(9) . . ?
O13M Tb1 O12N 68.76(9) . . ?
O13M Tb1 O21 130.46(9) . . ?
O14M Tb1 O11M 134.12(9) . . ?
O14M Tb1 N1 86.98(8) . . ?
O14M Tb1 O11N 71.39(8) . . ?
O14M Tb1 O12N 99.39(8) . . ?
O14M Tb1 O21 129.59(8) . . ?
O15M Tb1 O11M 80.36(9) . . ?
O15M Tb1 O12M 141.11(8) . . ?
O15M Tb1 O13M 144.43(9) . . ?
O15M Tb1 O14M 71.85(9) . . ?
O15M Tb1 N1 101.81(9) . . ?
O15M Tb1 O11N 77.58(9) . . ?
O15M Tb1 O12N 126.93(9) . . ?
O15M Tb1 O21 68.58(8) . . ?
O11N Tb1 O11M 67.39(8) . . ?
O11N Tb1 N1 25.68(8) . . ?
O11N Tb1 O12N 51.07(8) . . ?
O11N Tb1 O21 126.40(8) . . ?
O12N Tb1 N1 25.58(8) . . ?
O11 Tb1 O11M 141.58(8) . . ?
O11 Tb1 O12M 90.48(8) . . ?
O11 Tb1 O13M 72.47(9) . . ?
O11 Tb1 O14M 74.25(8) . . ?
O11 Tb1 O15M 88.50(9) . . ?
O11 Tb1 N1 154.71(8) . . ?
O11 Tb1 O11N 145.44(7) . . ?
O11 Tb1 O12N 140.91(9) . . ?
O11 Tb1 O21 74.75(8) . . ?
O21 Tb1 O11M 66.93(8) . . ?
O21 Tb1 N1 130.49(8) . . ?
O21 Tb1 O12N 129.23(8) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_exptl_crystal_preparation       Luminescent
