# Electronic Supplementary Material (ESI) for Dalton Transactions
# This journal is © The Royal Society of Chemistry 2013


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#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
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# 
#  This CIF contains data from an original supplementary publication 
#  deposited with the CCDC, and may include chemical, crystal,   
#  experimental, refinement, atomic coordinates, 
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted. 
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#  fide research purposes only. It may contain copyright material 
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data_import
_database_code_depnum_ccdc_archive 'CCDC 893273'
#TrackingRef '1.cif'
_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C28 H16 Dy F18 N O7'
_chemical_formula_weight         982.92
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   P-1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
_cell_length_a                   12.694
_cell_length_b                   12.790
_cell_length_c                   13.047
_cell_angle_alpha                64.79
_cell_angle_beta                 81.14
_cell_angle_gamma                64.31
_cell_volume                     1725.9
_cell_formula_units_Z            2
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?
_exptl_crystal_description       ?
_exptl_crystal_colour            ?
_exptl_crystal_size_max          0.6
_exptl_crystal_size_mid          0.5
_exptl_crystal_size_min          0.4
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.891
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             950
_exptl_absorpt_coefficient_mu    2.307
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_correction_T_min  0.729
_exptl_absorpt_correction_T_max  0.788
_exptl_absorpt_process_details   ?
_exptl_special_details           
;
?
;
_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            21264
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_av_sigmaI/netI    0.0388
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_theta_min         3.08
_diffrn_reflns_theta_max         27.50
_reflns_number_total             7840
_reflns_number_gt                6453
_reflns_threshold_expression     >2sigma(I)
_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          
;
Refinement of F^2^ against ALL reflections. The weighted R-factor wR and
goodness of fit S are based on F^2^, conventional R-factors R are based
on F, with F set to zero for negative F^2^. The threshold expression of
F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is
not relevant to the choice of reflections for refinement. R-factors based
on F^2^ are statistically about twice as large as those based on F, and R-
factors based on ALL data will be even larger.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[\s^2^(Fo^2^)+(0.0434P)^2^+1.8055P] where P=(Fo^2^+2Fc^2^)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         7840
_refine_ls_number_parameters     496
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0508
_refine_ls_R_factor_gt           0.0340
_refine_ls_wR_factor_ref         0.0939
_refine_ls_wR_factor_gt          0.0826
_refine_ls_goodness_of_fit_ref   1.092
_refine_ls_restrained_S_all      1.092
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Dy1 Dy 0.631486(15) 0.509334(18) 0.412469(15) 0.03738(7) Uani 1 1 d . . .
O07 O 0.5709(2) 0.3843(2) 0.5791(2) 0.0376(6) Uani 1 1 d . . .
H07A H 0.6103 0.3711 0.6445 0.045 Uiso 1 1 calc R . .
H07B H 0.5899 0.3023 0.5790 0.045 Uiso 1 1 calc R . .
O02 O 0.5623(3) 0.5600(3) 0.2315(3) 0.0514(7) Uani 1 1 d . . .
O04 O 0.8147(3) 0.3920(3) 0.5177(3) 0.0553(8) Uani 1 1 d . . .
O01 O 0.6726(3) 0.3174(3) 0.3963(3) 0.0522(7) Uani 1 1 d . . .
O03 O 0.7885(3) 0.4943(4) 0.2855(3) 0.0631(9) Uani 1 1 d . . .
O05 O 0.6165(4) 0.7166(3) 0.2978(3) 0.0654(10) Uani 1 1 d . . .
O06 O 0.6253(3) 0.6119(3) 0.5324(3) 0.0496(7) Uani 1 1 d . . .
F004 F 0.6839(4) 0.0912(4) 0.4163(3) 0.1010(13) Uani 1 1 d . . .
F008 F 0.5647(4) 0.6870(4) 0.7044(3) 0.0973(12) Uani 1 1 d . . .
F006 F 0.7544(5) 0.1186(4) 0.2535(4) 0.1150(16) Uani 1 1 d . . .
N01 N 1.3097(3) 0.7013(4) 0.2240(4) 0.0582(10) Uani 1 1 d . . .
F001 F 0.6416(5) 0.5335(5) -0.0253(3) 0.137(2) Uani 1 1 d . . .
F007 F 0.7348(4) 0.6707(5) 0.6668(4) 0.1147(16) Uani 1 1 d . . .
C015 C 0.6050(4) 0.5029(5) 0.1679(4) 0.0517(11) Uani 1 1 d . . .
F009 F 0.5934(6) 0.8529(4) 0.6092(4) 0.137(2) Uani 1 1 d . . .
C009 C 1.1559(4) 0.8028(4) 0.0449(4) 0.0485(10) Uani 1 1 d . . .
C016 C 0.6671(4) 0.3733(5) 0.1980(4) 0.0573(12) Uani 1 1 d . . .
H016 H 0.6935 0.3420 0.1420 0.069 Uiso 1 1 calc R . .
C025 C 0.9192(4) 0.3546(6) 0.4933(5) 0.0658(14) Uani 1 1 d . . .
F010 F 0.5730(6) 0.9298(5) 0.1174(4) 0.145(2) Uani 1 1 d . . .
C022 C 0.6187(4) 0.8048(5) 0.3123(4) 0.0541(11) Uani 1 1 d . . .
F005 F 0.8511(4) 0.0944(4) 0.3878(5) 0.1215(16) Uani 1 1 d . . .
C008 C 1.0680(4) 0.8657(5) -0.0476(4) 0.0562(11) Uani 1 1 d . . .
H008 H 1.0713 0.9355 -0.1100 0.067 Uiso 1 1 calc R . .
C019 C 0.6273(5) 0.7333(5) 0.6243(5) 0.0622(13) Uani 1 1 d . . .
C020 C 0.6202(4) 0.7183(4) 0.5154(4) 0.0440(9) Uani 1 1 d . . .
C028 C 0.9537(5) 0.4584(7) 0.1781(5) 0.0734(16) Uani 1 1 d . . .
F012 F 0.7398(5) 0.8787(6) 0.1762(5) 0.170(3) Uani 1 1 d . . .
F011 F 0.5893(5) 1.0216(4) 0.2090(4) 0.1266(18) Uani 1 1 d . . .
C007 C 0.9851(5) 0.8309(5) -0.0488(4) 0.0638(13) Uani 1 1 d . . .
H007 H 0.9835 0.7604 0.0139 0.077 Uiso 1 1 calc R . .
F002 F 0.4748(4) 0.6399(5) 0.0101(4) 0.1325(19) Uani 1 1 d . . .
C013 C 1.2228(4) 0.8630(5) 0.0480(4) 0.0595(12) Uani 1 1 d . . .
H013 H 1.2161 0.9393 -0.0115 0.071 Uiso 1 1 calc R . .
C012 C 1.2993(5) 0.8108(5) 0.1385(5) 0.0641(13) Uani 1 1 d . . .
H012 H 1.3437 0.8520 0.1399 0.077 Uiso 1 1 calc R . .
C011 C 1.2499(5) 0.6385(5) 0.2212(4) 0.0662(14) Uani 1 1 d . . .
H011 H 1.2603 0.5608 0.2802 0.079 Uiso 1 1 calc R . .
F013 F 0.9800(5) 0.2064(5) 0.6834(4) 0.142(2) Uani 1 1 d . . .
F003 F 0.6113(7) 0.6840(6) 0.0189(4) 0.170(3) Uani 1 1 d . . .
C014 C 0.5847(6) 0.5900(7) 0.0409(5) 0.0760(16) Uani 1 1 d . . .
F018 F 1.0658(4) 0.4095(8) 0.1822(5) 0.187(3) Uani 1 1 d . . .
C021 C 0.6149(5) 0.8174(5) 0.4131(4) 0.0574(12) Uani 1 1 d . . .
H021 H 0.6087 0.8930 0.4120 0.069 Uiso 1 1 calc R . .
C017 C 0.6901(4) 0.2902(5) 0.3119(4) 0.0509(10) Uani 1 1 d . . .
C005 C 0.8947(5) 0.8910(5) -0.1383(5) 0.0689(14) Uani 1 1 d . . .
C010 C 1.1744(5) 0.6866(5) 0.1336(4) 0.0637(13) Uani 1 1 d . . .
H010 H 1.1343 0.6408 0.1329 0.076 Uiso 1 1 calc R . .
C006 C 0.8990(5) 0.9797(7) -0.2447(5) 0.0830(18) Uani 1 1 d . . .
H006 H 0.9615 1.0031 -0.2620 0.100 Uiso 1 1 calc R . .
C002 C 0.7185(7) 0.9992(8) -0.3020(7) 0.106(3) Uani 1 1 d . . .
H002 H 0.6600 1.0353 -0.3571 0.128 Uiso 1 1 calc R . .
C004 C 0.7992(6) 0.8581(6) -0.1158(6) 0.088(2) Uani 1 1 d . . .
H004 H 0.7941 0.7991 -0.0444 0.106 Uiso 1 1 calc R . .
C018 C 0.7445(6) 0.1479(6) 0.3413(5) 0.0745(16) Uani 1 1 d . . .
C027 C 0.8961(4) 0.4395(4) 0.2920(4) 0.0514(11) Uani 1 1 d . . .
C003 C 0.7130(7) 0.9115(8) -0.1971(8) 0.105(3) Uani 1 1 d . . .
H003 H 0.6505 0.8879 -0.1807 0.126 Uiso 1 1 calc R . .
C001 C 0.8111(7) 1.0340(8) -0.3260(6) 0.101(2) Uani 1 1 d . . .
H001 H 0.8146 1.0943 -0.3971 0.121 Uiso 1 1 calc R . .
C024 C 1.0067(6) 0.2869(10) 0.5964(7) 0.114(3) Uani 1 1 d . . .
C023 C 0.6295(8) 0.9102(6) 0.2023(6) 0.088(2) Uani 1 1 d . . .
C026 C 0.9663(4) 0.3685(6) 0.3893(5) 0.0784(17) Uani 1 1 d . . .
H026 H 1.0469 0.3293 0.3842 0.094 Uiso 1 1 calc R . .
F017 F 0.9304(7) 0.5750(6) 0.1197(6) 0.205(4) Uani 1 1 d . . .
F014 F 1.0016(8) 0.3681(7) 0.6326(6) 0.217(5) Uani 1 1 d . . .
F015 F 1.1101(4) 0.2285(13) 0.5741(6) 0.322(8) Uani 1 1 d . . .
F016 F 0.9209(6) 0.4243(10) 0.1185(5) 0.195(4) Uani 1 1 d . . .
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_23
_atom_site_aniso_U_13
_atom_site_aniso_U_12
Dy1 0.03544(10) 0.04759(12) 0.03207(10) -0.01689(8) 0.00062(7) -0.01861(8)
O07 0.0383(14) 0.0404(14) 0.0323(13) -0.0131(11) -0.0017(11) -0.0152(11)
O02 0.0464(16) 0.069(2) 0.0406(16) -0.0274(15) -0.0033(13) -0.0184(15)
O04 0.0380(16) 0.072(2) 0.0524(18) -0.0242(16) -0.0016(13) -0.0192(15)
O01 0.0629(19) 0.0587(19) 0.0436(16) -0.0273(15) 0.0085(14) -0.0280(16)
O03 0.0409(17) 0.094(3) 0.0497(18) -0.0264(18) 0.0095(14) -0.0287(17)
O05 0.109(3) 0.060(2) 0.0411(17) -0.0172(15) 0.0071(18) -0.051(2)
O06 0.0645(19) 0.0518(17) 0.0406(15) -0.0195(13) -0.0034(14) -0.0283(15)
F004 0.147(4) 0.074(2) 0.091(3) -0.038(2) 0.035(3) -0.059(2)
F008 0.121(3) 0.146(4) 0.069(2) -0.064(2) 0.027(2) -0.081(3)
F006 0.192(5) 0.092(3) 0.089(3) -0.068(2) 0.039(3) -0.063(3)
N01 0.046(2) 0.067(3) 0.050(2) -0.022(2) -0.0106(17) -0.0112(19)
F001 0.185(5) 0.131(4) 0.0448(19) -0.041(2) 0.021(2) -0.022(3)
F007 0.083(3) 0.188(5) 0.100(3) -0.080(3) -0.020(2) -0.051(3)
C015 0.051(2) 0.075(3) 0.040(2) -0.027(2) 0.0018(19) -0.031(2)
F009 0.250(7) 0.092(3) 0.099(3) -0.059(3) -0.012(4) -0.071(4)
C009 0.046(2) 0.054(2) 0.036(2) -0.0135(18) -0.0061(17) -0.0138(19)
C016 0.067(3) 0.078(3) 0.048(3) -0.039(2) 0.014(2) -0.037(3)
C025 0.044(3) 0.083(4) 0.062(3) -0.021(3) -0.005(2) -0.023(2)
F010 0.263(7) 0.113(4) 0.057(2) 0.009(2) -0.034(3) -0.105(4)
C022 0.061(3) 0.056(3) 0.047(2) -0.013(2) 0.003(2) -0.034(2)
F005 0.092(3) 0.088(3) 0.169(5) -0.070(3) -0.009(3) -0.001(2)
C008 0.058(3) 0.056(3) 0.042(2) -0.012(2) -0.009(2) -0.017(2)
C019 0.073(3) 0.073(3) 0.060(3) -0.035(3) -0.002(3) -0.037(3)
C020 0.039(2) 0.049(2) 0.051(2) -0.0246(19) -0.0023(18) -0.0185(18)
C028 0.059(3) 0.101(5) 0.070(4) -0.040(3) 0.028(3) -0.045(3)
F012 0.137(4) 0.154(5) 0.140(5) 0.017(4) 0.050(4) -0.083(4)
F011 0.206(5) 0.071(2) 0.099(3) -0.003(2) -0.007(3) -0.080(3)
C007 0.062(3) 0.064(3) 0.052(3) -0.012(2) -0.016(2) -0.021(2)
F002 0.110(3) 0.168(5) 0.069(3) -0.037(3) -0.032(2) -0.014(3)
C013 0.058(3) 0.056(3) 0.051(3) -0.006(2) -0.011(2) -0.023(2)
C012 0.058(3) 0.071(3) 0.061(3) -0.018(3) -0.009(2) -0.030(3)
C011 0.073(3) 0.058(3) 0.047(3) -0.005(2) -0.013(2) -0.019(3)
F013 0.116(4) 0.142(4) 0.089(3) 0.001(3) -0.037(3) -0.018(3)
F003 0.322(9) 0.171(5) 0.062(3) -0.001(3) -0.008(4) -0.179(6)
C014 0.098(5) 0.094(4) 0.041(3) -0.030(3) 0.003(3) -0.041(4)
F018 0.067(3) 0.348(10) 0.104(4) -0.090(5) 0.042(3) -0.063(4)
C021 0.069(3) 0.050(3) 0.059(3) -0.021(2) -0.003(2) -0.029(2)
C017 0.058(3) 0.064(3) 0.049(2) -0.035(2) 0.016(2) -0.034(2)
C005 0.065(3) 0.071(3) 0.061(3) -0.024(3) -0.020(3) -0.014(3)
C010 0.072(3) 0.059(3) 0.051(3) -0.006(2) -0.015(2) -0.030(3)
C006 0.069(4) 0.110(5) 0.060(3) -0.029(3) -0.012(3) -0.027(3)
C002 0.085(5) 0.130(7) 0.096(5) -0.047(5) -0.042(4) -0.022(5)
C004 0.078(4) 0.083(4) 0.096(5) -0.022(4) -0.030(4) -0.031(3)
C018 0.092(4) 0.073(4) 0.073(4) -0.046(3) 0.020(3) -0.035(3)
C027 0.046(2) 0.052(3) 0.061(3) -0.023(2) 0.013(2) -0.027(2)
C003 0.087(5) 0.110(6) 0.124(7) -0.040(5) -0.037(5) -0.039(4)
C001 0.096(5) 0.123(6) 0.060(4) -0.028(4) -0.025(4) -0.025(4)
C024 0.050(4) 0.163(8) 0.087(5) -0.013(6) -0.016(3) -0.038(4)
C023 0.126(6) 0.070(4) 0.067(4) -0.007(3) 0.004(4) -0.061(4)
C026 0.037(2) 0.100(4) 0.076(4) -0.027(3) 0.005(2) -0.017(3)
F017 0.260(8) 0.125(5) 0.149(5) -0.020(4) 0.122(6) -0.083(5)
F014 0.297(10) 0.202(7) 0.180(7) 0.003(5) -0.149(7) -0.154(7)
F015 0.049(3) 0.595(18) 0.117(5) -0.090(8) -0.022(3) -0.001(5)
F016 0.203(6) 0.413(12) 0.131(4) -0.185(6) 0.105(4) -0.223(8)
_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
Dy1 O07 2.338(3) . ?
Dy1 O07 2.340(3) 2_666 ?
Dy1 O05 2.361(3) . ?
Dy1 O02 2.368(3) . ?
Dy1 O01 2.375(3) . ?
Dy1 O03 2.383(3) . ?
Dy1 O04 2.398(3) . ?
Dy1 O06 2.407(3) . ?
Dy1 Dy1 3.7810(4) 2_666 ?
O07 Dy1 2.340(3) 2_666 ?
O02 C015 1.245(5) . ?
O04 C025 1.241(6) . ?
O01 C017 1.252(5) . ?
O03 C027 1.232(5) . ?
O05 C022 1.232(6) . ?
O06 C020 1.256(5) . ?
F004 C018 1.313(7) . ?
F008 C019 1.303(7) . ?
F006 C018 1.322(7) . ?
N01 C011 1.335(7) . ?
N01 C012 1.334(7) . ?
F001 C014 1.295(7) . ?
F007 C019 1.310(7) . ?
C015 C016 1.390(7) . ?
C015 C014 1.537(7) . ?
F009 C019 1.327(7) . ?
C009 C010 1.385(6) . ?
C009 C013 1.387(7) . ?
C009 C008 1.469(6) . ?
C016 C017 1.393(7) . ?
C025 C026 1.366(8) . ?
C025 C024 1.557(9) . ?
F010 C023 1.287(8) . ?
C022 C021 1.383(7) . ?
C022 C023 1.532(7) . ?
F005 C018 1.328(8) . ?
C008 C007 1.312(7) . ?
C019 C020 1.534(7) . ?
C020 C021 1.380(7) . ?
C028 F016 1.230(8) . ?
C028 F017 1.269(8) . ?
C028 F018 1.281(7) . ?
C028 C027 1.521(7) . ?
F012 C023 1.311(9) . ?
F011 C023 1.326(8) . ?
C007 C005 1.467(7) . ?
F002 C014 1.302(8) . ?
C013 C012 1.379(7) . ?
C011 C010 1.353(7) . ?
F013 C024 1.284(9) . ?
F003 C014 1.294(8) . ?
C017 C018 1.527(8) . ?
C005 C006 1.381(9) . ?
C005 C004 1.400(9) . ?
C006 C001 1.384(8) . ?
C002 C003 1.367(12) . ?
C002 C001 1.378(11) . ?
C004 C003 1.372(9) . ?
C027 C026 1.377(8) . ?
C024 F015 1.258(10) . ?
C024 F014 1.287(13) . ?
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
O07 Dy1 O07 72.12(10) . 2_666 ?
O07 Dy1 O05 144.78(11) . . ?
O07 Dy1 O05 82.60(12) 2_666 . ?
O07 Dy1 O02 121.69(10) . . ?
O07 Dy1 O02 77.26(10) 2_666 . ?
O05 Dy1 O02 73.94(12) . . ?
O07 Dy1 O01 73.34(10) . . ?
O07 Dy1 O01 108.96(10) 2_666 . ?
O05 Dy1 O01 139.74(11) . . ?
O02 Dy1 O01 71.57(11) . . ?
O07 Dy1 O03 141.05(11) . . ?
O07 Dy1 O03 143.06(10) 2_666 . ?
O05 Dy1 O03 72.01(13) . . ?
O02 Dy1 O03 70.29(11) . . ?
O01 Dy1 O03 77.27(12) . . ?
O07 Dy1 O04 82.06(10) . . ?
O07 Dy1 O04 145.14(10) 2_666 . ?
O05 Dy1 O04 107.96(13) . . ?
O02 Dy1 O04 137.34(11) . . ?
O01 Dy1 O04 84.69(12) . . ?
O03 Dy1 O04 70.19(11) . . ?
O07 Dy1 O06 80.58(10) . . ?
O07 Dy1 O06 79.79(10) 2_666 . ?
O05 Dy1 O06 70.93(11) . . ?
O02 Dy1 O06 139.98(11) . . ?
O01 Dy1 O06 147.76(11) . . ?
O03 Dy1 O06 114.89(12) . . ?
O04 Dy1 O06 73.07(11) . . ?
O07 Dy1 Dy1 36.08(6) . 2_666 ?
O07 Dy1 Dy1 36.04(6) 2_666 2_666 ?
O05 Dy1 Dy1 115.18(10) . 2_666 ?
O02 Dy1 Dy1 100.86(8) . 2_666 ?
O01 Dy1 Dy1 91.36(8) . 2_666 ?
O03 Dy1 Dy1 167.25(9) . 2_666 ?
O04 Dy1 Dy1 114.98(8) . 2_666 ?
O06 Dy1 Dy1 77.83(8) . 2_666 ?
Dy1 O07 Dy1 107.88(10) . 2_666 ?
C015 O02 Dy1 129.1(3) . . ?
C025 O04 Dy1 135.2(3) . . ?
C017 O01 Dy1 131.6(3) . . ?
C027 O03 Dy1 137.5(3) . . ?
C022 O05 Dy1 136.9(3) . . ?
C020 O06 Dy1 134.8(3) . . ?
C011 N01 C012 120.6(4) . . ?
O02 C015 C016 128.2(4) . . ?
O02 C015 C014 114.1(5) . . ?
C016 C015 C014 117.7(4) . . ?
C010 C009 C013 116.6(4) . . ?
C010 C009 C008 123.9(5) . . ?
C013 C009 C008 119.4(4) . . ?
C015 C016 C017 120.2(4) . . ?
O04 C025 C026 128.9(5) . . ?
O04 C025 C024 114.3(5) . . ?
C026 C025 C024 116.8(5) . . ?
O05 C022 C021 128.3(4) . . ?
O05 C022 C023 113.5(5) . . ?
C021 C022 C023 118.2(5) . . ?
C007 C008 C009 125.0(5) . . ?
F008 C019 F007 105.3(5) . . ?
F008 C019 F009 106.8(5) . . ?
F007 C019 F009 107.3(5) . . ?
F008 C019 C020 112.9(4) . . ?
F007 C019 C020 110.6(5) . . ?
F009 C019 C020 113.4(5) . . ?
O06 C020 C021 128.2(4) . . ?
O06 C020 C019 113.8(4) . . ?
C021 C020 C019 117.9(4) . . ?
F016 C028 F017 105.4(8) . . ?
F016 C028 F018 108.3(7) . . ?
F017 C028 F018 101.6(7) . . ?
F016 C028 C027 114.2(5) . . ?
F017 C028 C027 110.6(6) . . ?
F018 C028 C027 115.6(6) . . ?
C008 C007 C005 127.1(5) . . ?
C012 C013 C009 120.6(5) . . ?
N01 C012 C013 120.1(5) . . ?
N01 C011 C010 120.9(5) . . ?
F003 C014 F001 108.7(6) . . ?
F003 C014 F002 106.0(7) . . ?
F001 C014 F002 105.7(5) . . ?
F003 C014 C015 110.5(5) . . ?
F001 C014 C015 114.3(5) . . ?
F002 C014 C015 111.2(5) . . ?
C020 C021 C022 120.4(4) . . ?
O01 C017 C016 127.7(5) . . ?
O01 C017 C018 114.0(4) . . ?
C016 C017 C018 118.3(4) . . ?
C006 C005 C004 117.9(5) . . ?
C006 C005 C007 122.9(6) . . ?
C004 C005 C007 119.2(5) . . ?
C011 C010 C009 121.0(5) . . ?
C005 C006 C001 120.7(7) . . ?
C003 C002 C001 119.8(6) . . ?
C003 C004 C005 121.2(7) . . ?
F004 C018 F006 107.0(5) . . ?
F004 C018 F005 106.3(6) . . ?
F006 C018 F005 107.0(6) . . ?
F004 C018 C017 111.5(5) . . ?
F006 C018 C017 114.3(5) . . ?
F005 C018 C017 110.2(5) . . ?
O03 C027 C026 126.9(5) . . ?
O03 C027 C028 114.4(5) . . ?
C026 C027 C028 118.6(5) . . ?
C002 C003 C004 120.2(7) . . ?
C002 C001 C006 120.3(7) . . ?
F015 C024 F013 106.9(10) . . ?
F015 C024 F014 110.5(10) . . ?
F013 C024 F014 103.1(9) . . ?
F015 C024 C025 112.9(8) . . ?
F013 C024 C025 113.3(6) . . ?
F014 C024 C025 109.7(8) . . ?
F010 C023 F012 107.1(7) . . ?
F010 C023 F011 105.5(6) . . ?
F012 C023 F011 108.1(6) . . ?
F010 C023 C022 113.0(5) . . ?
F012 C023 C022 109.4(6) . . ?
F011 C023 C022 113.4(6) . . ?
C025 C026 C027 120.9(5) . . ?
_diffrn_measured_fraction_theta_max 0.989
_diffrn_reflns_theta_full        27.50
_diffrn_measured_fraction_theta_full 0.989
_refine_diff_density_max         1.850
_refine_diff_density_min         -0.849
_refine_diff_density_rms         0.100