#------------------------------------------------------------------------------
#$Date: 2015-10-09 09:07:57 +0300 (Fri, 09 Oct 2015) $
#$Revision: 161122 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/56/7035649.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7035649
loop_
_publ_author_name
'Visinescu, Diana'
'Alexandru, Maria-Gabriela'
'Madalan, Augustin M.'
'Pichon, Céline'
'Duhayon, Carine'
'Sutter, Jean-Pascal'
'Andruh, Marius'
_publ_section_title
;
 Magneto-structural variety of new 3d-4f-4(5)d heterotrimetallic
 complexes.
;
_journal_issue                   38
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              16713
_journal_page_last               16727
_journal_paper_doi               10.1039/c5dt01738f
_journal_volume                  44
_journal_year                    2015
_chemical_formula_sum            'C46 H44 Cu2 Eu Mo N12 O10'
_chemical_formula_weight         1299.91
_chemical_name_systematic
;
 ?
;
_chemical_properties_physical    Photo-sensitive
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2015-06-15 deposited with the CCDC.
2015-07-06 downloaded from the CCDC.
;
_cell_angle_alpha                94.967(3)
_cell_angle_beta                 102.028(3)
_cell_angle_gamma                116.494(3)
_cell_formula_units_Z            2
_cell_length_a                   11.4089(4)
_cell_length_b                   12.4074(5)
_cell_length_c                   20.6391(9)
_cell_measurement_reflns_used    31261
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      30.00
_cell_measurement_theta_min      2.36
_cell_volume                     2503.0(2)
_computing_cell_refinement       X-Area
_computing_data_collection       X-Area
_computing_data_reduction        X-Area
_computing_molecular_graphics    'Diamond 3.2 (Branderburg, 2014)'
_computing_publication_material  'WinGX (Farrugia, 2013)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXS-2014 (Sheldrick, 2014)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.936
_diffrn_measured_fraction_theta_max 0.958
_diffrn_measurement_device_type  'STOE IPDS II'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0515
_diffrn_reflns_av_unetI/netI     0.0494
_diffrn_reflns_laue_measured_fraction_full 0.936
_diffrn_reflns_laue_measured_fraction_max 0.958
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            31261
_diffrn_reflns_point_group_measured_fraction_full 0.936
_diffrn_reflns_point_group_measured_fraction_max 0.958
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.000
_diffrn_reflns_theta_min         2.360
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    2.387
_exptl_absorpt_correction_T_max  0.6913
_exptl_absorpt_correction_T_min  0.5062
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
[c.f. r.h. blessing, acta cryst. (1995), a51, 33-38]
;
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.725
_exptl_crystal_description       prism
_exptl_crystal_F_000             1294
_exptl_crystal_preparation       'Magnetic properties'
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.779
_refine_diff_density_min         -1.449
_refine_diff_density_rms         0.127
_refine_ls_extinction_coef       0.0042(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     668
_refine_ls_number_reflns         13999
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.068
_refine_ls_R_factor_all          0.0728
_refine_ls_R_factor_gt           0.0549
_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)+(0.0676P)²+3.3783P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1301
_refine_ls_wR_factor_ref         0.1383
_reflns_Friedel_coverage         0.000
_reflns_number_gt                11072
_reflns_number_total             13999
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c5dt01738f2.cif
_cod_data_source_block           Compound_3
_cod_depositor_comments
'Adding full bibliography for 7035647--7035658.cif.'
_cod_original_cell_volume        2502.96(18)
_cod_database_code               7035649
_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.
;
_shelxl_version_number           2014-3
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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
C1 C 0.8807(8) 0.4505(8) 0.4180(4) 0.083(3) Uani 1 1 d . . . . .
H1A H 0.9629 0.5065 0.4083 0.125 Uiso 1 1 calc R U . . .
H1B H 0.8592 0.4943 0.4502 0.125 Uiso 1 1 calc R U . . .
H1C H 0.8935 0.3868 0.4364 0.125 Uiso 1 1 calc R U . . .
C2 C 0.6447(6) 0.3138(5) 0.3605(3) 0.0463(12) Uani 1 1 d . . . . .
C3 C 0.5988(9) 0.3146(8) 0.4173(4) 0.072(2) Uani 1 1 d . . . . .
H3 H 0.6553 0.3725 0.4569 0.086 Uiso 1 1 calc R U . . .
C4 C 0.4670(10) 0.2280(10) 0.4146(5) 0.092(3) Uani 1 1 d . . . . .
H4 H 0.4345 0.2277 0.4524 0.110 Uiso 1 1 calc R U . . .
C5 C 0.3862(8) 0.1442(9) 0.3568(4) 0.076(2) Uani 1 1 d . . . . .
H5 H 0.2986 0.0861 0.3557 0.091 Uiso 1 1 calc R U . . .
C6 C 0.4298(6) 0.1420(6) 0.2990(3) 0.0514(13) Uani 1 1 d . . . . .
C7 C 0.5600(5) 0.2310(5) 0.2999(3) 0.0396(10) Uani 1 1 d . . . . .
C8 C 0.3387(7) 0.0444(7) 0.2405(4) 0.0637(17) Uani 1 1 d . . . . .
H8 H 0.2583 -0.0150 0.2468 0.076 Uiso 1 1 calc R U . . .
C9 C 0.2502(11) -0.0876(9) 0.1366(6) 0.124(5) Uani 0.7 1 d . . P A 1
H9A H 0.2863 -0.1452 0.1386 0.149 Uiso 0.7 1 calc R U P A 1
H9B H 0.1704 -0.1209 0.1534 0.149 Uiso 0.7 1 calc R U P A 1
C10 C 0.2068(11) -0.0837(11) 0.0672(7) 0.081(4) Uani 0.7 1 d . . P A 1
H10A H 0.1716 -0.0255 0.0648 0.097 Uiso 0.7 1 calc R U P A 1
H10B H 0.1322 -0.1641 0.0437 0.097 Uiso 0.7 1 calc R U P A 1
C11 C 0.3149(8) -0.0484(7) 0.0305(4) 0.068(2) Uani 0.7 1 d . . P A 1
H11A H 0.3620 -0.0966 0.0387 0.081 Uiso 0.7 1 calc R U P A 1
H11B H 0.2736 -0.0649 -0.0178 0.081 Uiso 0.7 1 calc R U P A 1
C9A C 0.2502(11) -0.0876(9) 0.1366(6) 0.124(5) Uani 0.3 1 d . . P A 2
H9A1 H 0.2327 -0.1533 0.1616 0.149 Uiso 0.3 1 calc R U P A 2
H9A2 H 0.1662 -0.0832 0.1225 0.149 Uiso 0.3 1 calc R U P A 2
C10A C 0.282(3) -0.121(3) 0.0781(19) 0.086(9) Uani 0.3 1 d . . P A 2
H10C H 0.3577 -0.1368 0.0937 0.103 Uiso 0.3 1 calc R U P A 2
H10D H 0.2047 -0.1988 0.0536 0.103 Uiso 0.3 1 calc R U P A 2
C11A C 0.3149(8) -0.0484(7) 0.0305(4) 0.068(2) Uani 0.3 1 d . . P A 2
H11C H 0.2310 -0.0554 0.0027 0.081 Uiso 0.3 1 calc R U P A 2
H11D H 0.3512 -0.0832 0.0013 0.081 Uiso 0.3 1 calc R U P A 2
C12 C 0.4342(7) 0.1494(7) 0.0097(3) 0.0562(15) Uani 1 1 d . . . . .
H12 H 0.3834 0.1083 -0.0345 0.067 Uiso 1 1 calc R U . . .
C13 C 0.5262(7) 0.2771(7) 0.0190(3) 0.0552(14) Uani 1 1 d . . . . .
C14 C 0.5172(10) 0.3325(9) -0.0372(4) 0.081(2) Uani 1 1 d . . . . .
H14 H 0.4533 0.2850 -0.0780 0.097 Uiso 1 1 calc R U . . .
C15 C 0.6002(12) 0.4540(10) -0.0329(4) 0.092(3) Uani 1 1 d . . . . .
H15 H 0.5922 0.4883 -0.0708 0.110 Uiso 1 1 calc R U . . .
C16 C 0.6959(10) 0.5272(8) 0.0267(4) 0.076(2) Uani 1 1 d . . . . .
H16 H 0.7534 0.6099 0.0289 0.091 Uiso 1 1 calc R U . . .
C17 C 0.7056(7) 0.4769(6) 0.0828(3) 0.0495(13) Uani 1 1 d . . . . .
C18 C 0.6226(6) 0.3499(5) 0.0805(3) 0.0421(11) Uani 1 1 d . . . . .
C19 C 0.8855(9) 0.6674(6) 0.1496(4) 0.075(2) Uani 1 1 d . . . . .
H19A H 0.9392 0.7049 0.1957 0.113 Uiso 1 1 calc R U . . .
H19B H 0.9441 0.6703 0.1217 0.113 Uiso 1 1 calc R U . . .
H19C H 0.8375 0.7112 0.1340 0.113 Uiso 1 1 calc R U . . .
C20 C 0.4623(6) 0.4079(7) 0.1981(4) 0.0626(17) Uani 1 1 d . . . . .
H20A H 0.4604 0.3567 0.1598 0.094 Uiso 1 1 calc R U . . .
H20B H 0.3993 0.3578 0.2211 0.094 Uiso 1 1 calc R U . . .
H20C H 0.4370 0.4675 0.1830 0.094 Uiso 1 1 calc R U . . .
C21 C 0.6151(6) 0.5487(6) 0.3025(3) 0.0496(13) Uani 1 1 d . . . . .
C22 C 0.5114(9) 0.5516(10) 0.3247(5) 0.082(3) Uani 1 1 d . . . . .
H22 H 0.4212 0.4968 0.3016 0.098 Uiso 1 1 calc R U . . .
C23 C 0.5426(11) 0.6384(13) 0.3829(6) 0.112(4) Uani 1 1 d . . . . .
H23 H 0.4734 0.6434 0.3979 0.135 Uiso 1 1 calc R U . . .
C24 C 0.6755(11) 0.7146(11) 0.4167(5) 0.095(3) Uani 1 1 d . . . . .
H24 H 0.6962 0.7707 0.4557 0.114 Uiso 1 1 calc R U . . .
C25 C 0.7820(8) 0.7116(7) 0.3948(4) 0.0636(17) Uani 1 1 d . . . . .
C26 C 0.7531(6) 0.6281(5) 0.3372(3) 0.0464(12) Uani 1 1 d . . . . .
C27 C 0.9171(9) 0.7912(8) 0.4375(4) 0.075(2) Uani 1 1 d . . . . .
H27 H 0.9240 0.8422 0.4755 0.090 Uiso 1 1 calc R U . . .
C28 C 1.1547(12) 0.8910(14) 0.4833(7) 0.142(6) Uani 0.55 1 d . . P B 1
H28A H 1.1330 0.9495 0.5051 0.170 Uiso 0.55 1 calc R U P B 1
H28B H 1.1714 0.8459 0.5170 0.170 Uiso 0.55 1 calc R U P B 1
C29 C 1.2691(17) 0.9545(18) 0.4706(10) 0.093(6) Uani 0.55 1 d . . P B 1
H29A H 1.3338 1.0116 0.5119 0.111 Uiso 0.55 1 calc R U P B 1
H29B H 1.2560 1.0029 0.4381 0.111 Uiso 0.55 1 calc R U P B 1
C30 C 1.3324(9) 0.8806(9) 0.4428(5) 0.094(3) Uani 0.55 1 d . . P B 1
H30A H 1.4197 0.9376 0.4372 0.113 Uiso 0.55 1 calc R U P B 1
H30B H 1.3492 0.8345 0.4760 0.113 Uiso 0.55 1 calc R U P B 1
C28A C 1.1547(12) 0.8910(14) 0.4833(7) 0.142(6) Uani 0.45 1 d . . P B 2
H28C H 1.1868 0.9708 0.4708 0.170 Uiso 0.45 1 calc R U P B 2
H28D H 1.1314 0.8985 0.5254 0.170 Uiso 0.45 1 calc R U P B 2
C29A C 1.2592(18) 0.8633(16) 0.4946(7) 0.059(4) Uani 0.45 1 d . . P B 2
H29C H 1.2230 0.7781 0.4992 0.071 Uiso 0.45 1 calc R U P B 2
H29D H 1.3241 0.9137 0.5375 0.071 Uiso 0.45 1 calc R U P B 2
C30A C 1.3324(9) 0.8806(9) 0.4428(5) 0.094(3) Uani 0.45 1 d . . P B 2
H30C H 1.4117 0.8695 0.4589 0.113 Uiso 0.45 1 calc R U P B 2
H30D H 1.3641 0.9641 0.4358 0.113 Uiso 0.45 1 calc R U P B 2
C31 C 1.3116(6) 0.7813(6) 0.3359(4) 0.0616(17) Uani 1 1 d . . . . .
H31 H 1.4052 0.8335 0.3495 0.074 Uiso 1 1 calc R U . . .
C32 C 1.2594(6) 0.6982(6) 0.2716(4) 0.0593(16) Uani 1 1 d . . . . .
C33 C 1.3519(7) 0.7085(8) 0.2336(5) 0.077(2) Uani 1 1 d . . . . .
H33 H 1.4415 0.7714 0.2493 0.092 Uiso 1 1 calc R U . . .
C34 C 1.3134(9) 0.6304(10) 0.1760(6) 0.093(3) Uani 1 1 d . . . . .
H34 H 1.3763 0.6402 0.1518 0.111 Uiso 1 1 calc R U . . .
C35 C 1.1806(9) 0.5336(8) 0.1507(5) 0.077(2) Uani 1 1 d . . . . .
H35 H 1.1549 0.4798 0.1100 0.092 Uiso 1 1 calc R U . . .
C36 C 1.0873(6) 0.5192(6) 0.1878(4) 0.0526(14) Uani 1 1 d . . . . .
C37 C 1.1233(5) 0.6026(5) 0.2470(3) 0.0467(12) Uani 1 1 d . . . . .
C38 C 0.9182(9) 0.3232(8) 0.1160(5) 0.078(2) Uani 1 1 d . . . . .
H38A H 0.8236 0.2648 0.1076 0.117 Uiso 1 1 calc R U . . .
H38B H 0.9339 0.3523 0.0755 0.117 Uiso 1 1 calc R U . . .
H38C H 0.9730 0.2845 0.1298 0.117 Uiso 1 1 calc R U . . .
C39 C 0.9889(5) 0.9240(4) 0.2751(3) 0.0430(12) Uani 1 1 d . . . . .
C40 C 0.7284(5) 0.8355(5) 0.2210(3) 0.0445(11) Uani 1 1 d . . . . .
C41 C 0.7126(5) 1.0307(5) 0.1834(3) 0.0429(11) Uani 1 1 d . . . . .
C42 C 0.8984(5) 1.2085(5) 0.2720(3) 0.0475(13) Uani 1 1 d . . . . .
C43 C 0.8868(6) 0.9697(6) 0.1503(3) 0.0513(13) Uani 1 1 d . . . . .
C44 C 1.0728(6) 1.1531(6) 0.2371(5) 0.071(2) Uani 1 1 d . . . . .
C45 C 1.0100(8) 1.1038(8) 0.3530(4) 0.0671(19) Uani 1 1 d . . . . .
C46 C 0.7447(7) 0.9985(7) 0.3147(3) 0.0584(15) Uani 1 1 d . . . . .
Cu1 Cu 0.50612(6) 0.14892(6) 0.15314(3) 0.03872(14) Uani 1 1 d . . . . .
Cu2 Cu 1.04500(7) 0.71756(6) 0.34910(4) 0.04274(15) Uani 1 1 d . . . . .
Eu1 Eu 0.79655(2) 0.43161(2) 0.24160(2) 0.03215(8) Uani 1 1 d . . . . .
Mo1 Mo 0.88099(4) 1.02683(4) 0.25126(2) 0.03503(10) Uani 1 1 d . . . . .
N1 N 0.3539(5) 0.0298(5) 0.1837(3) 0.0590(14) Uani 1 1 d . . . . .
N2 N 0.4135(5) 0.0849(5) 0.0552(3) 0.0506(12) Uani 1 1 d . . . . .
N3 N 1.0277(7) 0.8006(6) 0.4298(3) 0.0747(18) Uani 1 1 d . . . . .
N4 N 1.2457(5) 0.7925(5) 0.3765(3) 0.0557(13) Uani 1 1 d . . . . .
N5 N 1.0450(5) 0.8687(4) 0.2888(3) 0.0529(13) Uani 1 1 d . . . . .
N6 N 0.6507(6) 0.7336(5) 0.2035(3) 0.0625(15) Uani 1 1 d . . . . .
N7 N 0.6237(6) 1.0374(5) 0.1496(3) 0.0575(14) Uani 1 1 d . . . . .
N8 N 0.9032(5) 1.3018(5) 0.2790(3) 0.0588(14) Uani 1 1 d . . . . .
N9 N 0.8907(8) 0.9386(9) 0.0974(4) 0.085(2) Uani 1 1 d . . . . .
N10 N 1.1727(8) 1.2212(9) 0.2270(7) 0.125(4) Uani 1 1 d . . . . .
N11 N 1.0840(9) 1.1426(10) 0.4059(4) 0.112(3) Uani 1 1 d . . . . .
N12 N 0.6705(8) 0.9829(8) 0.3466(4) 0.085(2) Uani 1 1 d . . . . .
O1 O 0.7718(4) 0.3970(4) 0.3573(2) 0.0471(9) Uani 1 1 d . . . . .
O2 O 0.6079(4) 0.2414(3) 0.24595(19) 0.0387(7) Uani 1 1 d . . . . .
O1W O 0.8669(19) 0.7943(15) -0.0435(8) 0.230(7) Uani 1 1 d . . . . .
O3 O 0.6406(4) 0.3074(3) 0.13619(18) 0.0400(7) Uani 1 1 d . . . . .
O2W O 0.7856(19) 0.528(2) 0.5840(10) 0.341(13) Uani 1 1 d . . . . .
O4 O 0.7895(5) 0.5420(4) 0.1458(2) 0.0519(10) Uani 1 1 d . . . . .
O5 O 0.5982(4) 0.4703(4) 0.2439(2) 0.0467(9) Uani 1 1 d . . . . .
O6 O 0.8483(4) 0.6171(3) 0.3129(2) 0.0411(8) Uani 1 1 d . . . . .
O7 O 1.0279(4) 0.5889(3) 0.2780(2) 0.0439(8) Uani 1 1 d . . . . .
O8 O 0.9542(4) 0.4255(4) 0.1689(3) 0.0567(11) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 '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'
Mo Mo -1.6832 0.6857 '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'
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
O1 C1 H1A 109.5 . .
O1 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
O1 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
O1 C2 C3 123.9(6) . .
O1 C2 C7 114.6(5) . .
C3 C2 C7 121.3(6) . .
C2 C3 C4 119.2(7) . .
C2 C3 H3 120.4 . .
C4 C3 H3 120.4 . .
C5 C4 C3 119.7(8) . .
C5 C4 H4 120.2 . .
C3 C4 H4 120.2 . .
C4 C5 C6 122.1(7) . .
C4 C5 H5 118.9 . .
C6 C5 H5 118.9 . .
C5 C6 C7 119.1(6) . .
C5 C6 C8 118.2(6) . .
C7 C6 C8 122.7(6) . .
O2 C7 C2 118.0(5) . .
O2 C7 C6 123.6(5) . .
C2 C7 C6 118.4(5) . .
N1 C8 C6 128.5(6) . .
N1 C8 H8 115.7 . .
C6 C8 H8 115.7 . .
C10 C9 N1 117.6(10) . .
C10 C9 H9A 107.9 . .
N1 C9 H9A 107.9 . .
C10 C9 H9B 107.9 . .
N1 C9 H9B 107.9 . .
H9A C9 H9B 107.2 . .
C9 C10 C11 115.2(10) . .
C9 C10 H10A 108.5 . .
C11 C10 H10A 108.5 . .
C9 C10 H10B 108.5 . .
C11 C10 H10B 108.5 . .
H10A C10 H10B 107.5 . .
N2 C11 C10 109.2(7) . .
N2 C11 H11A 109.8 . .
C10 C11 H11A 109.8 . .
N2 C11 H11B 109.8 . .
C10 C11 H11B 109.8 . .
H11A C11 H11B 108.3 . .
H10C C10A H10D 106.4 . .
N2 C12 C13 127.4(6) . .
N2 C12 H12 116.3 . .
C13 C12 H12 116.3 . .
C18 C13 C14 118.8(7) . .
C18 C13 C12 124.1(6) . .
C14 C13 C12 117.2(6) . .
C15 C14 C13 121.3(7) . .
C15 C14 H14 119.4 . .
C13 C14 H14 119.4 . .
C14 C15 C16 121.1(7) . .
C14 C15 H15 119.5 . .
C16 C15 H15 119.5 . .
C17 C16 C15 119.3(8) . .
C17 C16 H16 120.4 . .
C15 C16 H16 120.4 . .
O4 C17 C16 124.6(6) . .
O4 C17 C18 113.7(5) . .
C16 C17 C18 121.7(6) . .
O3 C18 C13 123.9(5) . .
O3 C18 C17 118.2(5) . .
C13 C18 C17 117.9(5) . .
O4 C19 H19A 109.5 . .
O4 C19 H19B 109.5 . .
H19A C19 H19B 109.5 . .
O4 C19 H19C 109.5 . .
H19A C19 H19C 109.5 . .
H19B C19 H19C 109.5 . .
O5 C20 H20A 109.5 . .
O5 C20 H20B 109.5 . .
H20A C20 H20B 109.5 . .
O5 C20 H20C 109.5 . .
H20A C20 H20C 109.5 . .
H20B C20 H20C 109.5 . .
C22 C21 O5 125.2(6) . .
C22 C21 C26 121.9(7) . .
O5 C21 C26 112.9(5) . .
C21 C22 C23 119.4(8) . .
C21 C22 H22 120.3 . .
C23 C22 H22 120.3 . .
C24 C23 C22 118.8(8) . .
C24 C23 H23 120.6 . .
C22 C23 H23 120.6 . .
C23 C24 C25 122.1(8) . .
C23 C24 H24 118.9 . .
C25 C24 H24 118.9 . .
C26 C25 C24 119.7(8) . .
C26 C25 C27 123.7(7) . .
C24 C25 C27 116.4(7) . .
O6 C26 C25 124.0(6) . .
O6 C26 C21 118.0(5) . .
C25 C26 C21 118.0(6) . .
N3 C27 C25 127.8(7) . .
N3 C27 H27 116.1 . .
C25 C27 H27 116.1 . .
C29 C28 N3 123.1(13) . .
C29 C28 H28A 106.6 . .
N3 C28 H28A 106.6 . .
C29 C28 H28B 106.6 . .
N3 C28 H28B 106.6 . .
H28A C28 H28B 106.5 . .
C28 C29 C30 115.9(16) . .
C28 C29 H29A 108.3 . .
C30 C29 H29A 108.3 . .
C28 C29 H29B 108.3 . .
C30 C29 H29B 108.3 . .
H29A C29 H29B 107.4 . .
N4 C30 C29 114.1(8) . .
N4 C30 H30A 108.7 . .
C29 C30 H30A 108.7 . .
N4 C30 H30B 108.7 . .
C29 C30 H30B 108.7 . .
H30A C30 H30B 107.6 . .
H29C C29A H29D 107.4 . .
N4 C31 C32 128.1(6) . .
N4 C31 H31 115.9 . .
C32 C31 H31 115.9 . .
C33 C32 C37 118.9(7) . .
C33 C32 C31 117.6(6) . .
C37 C32 C31 123.4(7) . .
C34 C33 C32 121.1(7) . .
C34 C33 H33 119.5 . .
C32 C33 H33 119.4 . .
C33 C34 C35 121.7(8) . .
C33 C34 H34 119.1 . .
C35 C34 H34 119.1 . .
C36 C35 C34 118.6(8) . .
C36 C35 H35 120.7 . .
C34 C35 H35 120.7 . .
O8 C36 C37 114.9(6) . .
O8 C36 C35 124.1(7) . .
C37 C36 C35 120.9(6) . .
O7 C37 C36 118.4(5) . .
O7 C37 C32 123.0(6) . .
C36 C37 C32 118.6(6) . .
O8 C38 H38A 109.5 . .
O8 C38 H38B 109.5 . .
H38A C38 H38B 109.5 . .
O8 C38 H38C 109.5 . .
H38A C38 H38C 109.5 . .
H38B C38 H38C 109.5 . .
N5 C39 Mo1 178.7(6) . .
N6 C40 Mo1 177.3(6) . .
N7 C41 Mo1 176.6(5) . .
N8 C42 Mo1 176.0(6) . .
N9 C43 Mo1 179.0(6) . .
N10 C44 Mo1 177.2(10) . .
N11 C45 Mo1 175.7(7) . .
N12 C46 Mo1 178.3(7) . .
O2 Cu1 N2 169.72(19) . .
O2 Cu1 N1 91.9(2) . .
N2 Cu1 N1 95.6(2) . .
O2 Cu1 O3 79.03(15) . .
N2 Cu1 O3 91.7(2) . .
N1 Cu1 O3 160.7(2) . .
O2 Cu1 N7 95.32(17) . 1_545
N2 Cu1 N7 90.6(2) . 1_545
N1 Cu1 N7 98.2(2) . 1_545
O3 Cu1 N7 99.58(19) . 1_545
O2 Cu1 Eu1 40.01(11) . .
N2 Cu1 Eu1 131.03(17) . .
N1 Cu1 Eu1 131.01(17) . .
O3 Cu1 Eu1 39.36(10) . .
N7 Cu1 Eu1 95.66(14) 1_545 .
O6 Cu2 N3 92.5(2) . .
O6 Cu2 N4 169.02(19) . .
N3 Cu2 N4 97.1(3) . .
O6 Cu2 O7 77.45(15) . .
N3 Cu2 O7 162.4(3) . .
N4 Cu2 O7 91.9(2) . .
O6 Cu2 N5 91.55(16) . .
N3 Cu2 N5 92.3(3) . .
N4 Cu2 N5 93.4(2) . .
O7 Cu2 N5 102.3(2) . .
O6 Cu2 Eu1 39.06(11) . .
N3 Cu2 Eu1 126.8(2) . .
N4 Cu2 Eu1 129.97(16) . .
O7 Cu2 Eu1 39.51(11) . .
N5 Cu2 Eu1 105.92(13) . .
O3 Eu1 O6 136.95(12) . .
O3 Eu1 O7 135.56(14) . .
O6 Eu1 O7 62.26(13) . .
O3 Eu1 O2 63.56(13) . .
O6 Eu1 O2 119.38(13) . .
O7 Eu1 O2 153.80(13) . .
O3 Eu1 N8 101.32(16) . 1_545
O6 Eu1 N8 121.43(16) . 1_545
O7 Eu1 N8 81.84(15) . 1_545
O2 Eu1 N8 75.76(16) . 1_545
O3 Eu1 O4 64.22(13) . .
O6 Eu1 O4 86.10(14) . .
O7 Eu1 O4 82.52(14) . .
O2 Eu1 O4 123.20(13) . .
N8 Eu1 O4 135.66(19) 1_545 .
O3 Eu1 O1 126.76(13) . .
O6 Eu1 O1 69.09(14) . .
O7 Eu1 O1 96.54(14) . .
O2 Eu1 O1 63.57(12) . .
N8 Eu1 O1 71.22(19) 1_545 .
O4 Eu1 O1 151.93(14) . .
O3 Eu1 O5 79.45(13) . .
O6 Eu1 O5 63.73(12) . .
O7 Eu1 O5 123.40(12) . .
O2 Eu1 O5 71.87(12) . .
N8 Eu1 O5 143.26(18) 1_545 .
O4 Eu1 O5 78.23(15) . .
O1 Eu1 O5 79.05(14) . .
O3 Eu1 O8 76.83(14) . .
O6 Eu1 O8 121.34(13) . .
O7 Eu1 O8 63.05(14) . .
O2 Eu1 O8 118.94(13) . .
N8 Eu1 O8 68.50(19) 1_545 .
O4 Eu1 O8 67.40(16) . .
O1 Eu1 O8 136.78(15) . .
O5 Eu1 O8 144.17(15) . .
O3 Eu1 Cu2 152.98(9) . .
O6 Eu1 Cu2 31.09(9) . .
O7 Eu1 Cu2 32.02(9) . .
O2 Eu1 Cu2 139.72(9) . .
N8 Eu1 Cu2 99.01(12) 1_545 .
O4 Eu1 Cu2 88.78(10) . .
O1 Eu1 Cu2 76.82(9) . .
O5 Eu1 Cu2 94.61(9) . .
O8 Eu1 Cu2 94.49(10) . .
O3 Eu1 Cu1 32.27(9) . .
O6 Eu1 Cu1 138.65(9) . .
O7 Eu1 Cu1 158.96(9) . .
O2 Eu1 Cu1 31.55(9) . .
N8 Eu1 Cu1 85.43(12) 1_545 .
O4 Eu1 Cu1 95.21(10) . .
O1 Eu1 Cu1 95.12(9) . .
O5 Eu1 Cu1 76.06(9) . .
O8 Eu1 Cu1 96.69(10) . .
Cu2 Eu1 Cu1 168.820(18) . .
C45 Mo1 C44 77.3(4) . .
C45 Mo1 C41 140.5(2) . .
C44 Mo1 C41 111.7(3) . .
C45 Mo1 C39 71.8(2) . .
C44 Mo1 C39 81.5(2) . .
C41 Mo1 C39 145.8(2) . .
C45 Mo1 C40 121.3(3) . .
C44 Mo1 C40 141.1(3) . .
C41 Mo1 C40 76.7(2) . .
C39 Mo1 C40 74.25(19) . .
C45 Mo1 C43 140.9(3) . .
C44 Mo1 C43 71.1(3) . .
C41 Mo1 C43 74.3(2) . .
C39 Mo1 C43 81.2(2) . .
C40 Mo1 C43 75.5(2) . .
C45 Mo1 C46 74.4(3) . .
C44 Mo1 C46 144.4(3) . .
C41 Mo1 C46 79.0(3) . .
C39 Mo1 C46 109.1(3) . .
C40 Mo1 C46 73.5(2) . .
C43 Mo1 C46 142.8(2) . .
C45 Mo1 C42 76.1(3) . .
C44 Mo1 C42 73.6(3) . .
C41 Mo1 C42 70.5(2) . .
C39 Mo1 C42 142.85(19) . .
C40 Mo1 C42 140.5(2) . .
C43 Mo1 C42 114.7(3) . .
C46 Mo1 C42 79.0(3) . .
C8 N1 C9 115.9(7) . .
C8 N1 Cu1 124.7(5) . .
C9 N1 Cu1 119.4(6) . .
C12 N2 C11 115.9(6) . .
C12 N2 Cu1 124.7(4) . .
C11 N2 Cu1 119.3(5) . .
C27 N3 C28 116.4(8) . .
C27 N3 Cu2 124.6(5) . .
C28 N3 Cu2 118.7(7) . .
C31 N4 C30 114.9(7) . .
C31 N4 Cu2 122.0(5) . .
C30 N4 Cu2 122.5(6) . .
C39 N5 Cu2 142.6(5) . .
C41 N7 Cu1 138.8(5) . 1_565
C42 N8 Eu1 147.4(5) . 1_565
C2 O1 C1 118.4(5) . .
C2 O1 Eu1 116.6(3) . .
C1 O1 Eu1 124.8(4) . .
C7 O2 Cu1 126.7(3) . .
C7 O2 Eu1 120.4(3) . .
Cu1 O2 Eu1 108.44(16) . .
C18 O3 Cu1 124.8(3) . .
C18 O3 Eu1 124.1(3) . .
Cu1 O3 Eu1 108.37(16) . .
C17 O4 C19 115.9(5) . .
C17 O4 Eu1 119.7(3) . .
C19 O4 Eu1 123.6(4) . .
C21 O5 C20 115.3(5) . .
C21 O5 Eu1 115.8(3) . .
C20 O5 Eu1 128.2(4) . .
C26 O6 Cu2 126.5(4) . .
C26 O6 Eu1 121.1(3) . .
Cu2 O6 Eu1 109.85(16) . .
C37 O7 Cu2 124.3(3) . .
C37 O7 Eu1 125.9(4) . .
Cu2 O7 Eu1 108.48(16) . .
C36 O8 C38 117.5(5) . .
C36 O8 Eu1 117.7(4) . .
C38 O8 Eu1 124.3(4) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.424(8) .
C1 H1A 0.9600 .
C1 H1B 0.9600 .
C1 H1C 0.9600 .
C2 O1 1.375(7) .
C2 C3 1.382(9) .
C2 C7 1.393(8) .
C3 C4 1.390(12) .
C3 H3 0.9300 .
C4 C5 1.351(13) .
C4 H4 0.9300 .
C5 C6 1.386(10) .
C5 H5 0.9300 .
C6 C7 1.396(7) .
C6 C8 1.452(10) .
C7 O2 1.331(6) .
C8 N1 1.231(10) .
C8 H8 0.9300 .
C9 C10 1.428(18) .
C9 N1 1.484(9) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 C11 1.500(16) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 N2 1.488(9) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C10A H10C 0.9700 .
C10A H10D 0.9700 .
C12 N2 1.276(9) .
C12 C13 1.425(10) .
C12 H12 0.9300 .
C13 C18 1.403(8) .
C13 C14 1.407(10) .
C14 C15 1.358(13) .
C14 H14 0.9300 .
C15 C16 1.375(12) .
C15 H15 0.9300 .
C16 C17 1.369(9) .
C16 H16 0.9300 .
C17 O4 1.368(7) .
C17 C18 1.420(8) .
C18 O3 1.322(6) .
C19 O4 1.432(8) .
C19 H19A 0.9600 .
C19 H19B 0.9600 .
C19 H19C 0.9600 .
C20 O5 1.444(7) .
C20 H20A 0.9600 .
C20 H20B 0.9600 .
C20 H20C 0.9600 .
C21 C22 1.367(9) .
C21 O5 1.406(7) .
C21 C26 1.410(9) .
C22 C23 1.410(13) .
C22 H22 0.9300 .
C23 C24 1.359(15) .
C23 H23 0.9300 .
C24 C25 1.397(11) .
C24 H24 0.9300 .
C25 C26 1.382(9) .
C25 C27 1.433(11) .
C26 O6 1.341(7) .
C27 N3 1.259(11) .
C27 H27 0.9300 .
C28 C29 1.29(2) .
C28 N3 1.499(11) .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C29 C30 1.54(2) .
C29 H29A 0.9700 .
C29 H29B 0.9700 .
C30 N4 1.503(10) .
C30 H30A 0.9700 .
C30 H30B 0.9700 .
C29A H29C 0.9700 .
C29A H29D 0.9700 .
C31 N4 1.274(10) .
C31 C32 1.436(10) .
C31 H31 0.9300 .
C32 C33 1.409(11) .
C32 C37 1.415(8) .
C33 C34 1.322(13) .
C33 H33 0.9300 .
C34 C35 1.396(12) .
C34 H34 0.9300 .
C35 C36 1.394(10) .
C35 H35 0.9300 .
C36 O8 1.382(7) .
C36 C37 1.388(9) .
C37 O7 1.329(7) .
C38 O8 1.442(8) .
C38 H38A 0.9600 .
C38 H38B 0.9600 .
C38 H38C 0.9600 .
C39 N5 1.145(6) .
C39 Mo1 2.155(5) .
C40 N6 1.142(8) .
C40 Mo1 2.158(6) .
C41 N7 1.147(7) .
C41 Mo1 2.150(5) .
C42 N8 1.129(7) .
C42 Mo1 2.168(5) .
C43 N9 1.143(9) .
C43 Mo1 2.167(7) .
C44 N10 1.152(10) .
C44 Mo1 2.148(7) .
C45 N11 1.140(9) .
C45 Mo1 2.144(7) .
C46 N12 1.139(10) .
C46 Mo1 2.167(7) .
Cu1 O2 1.959(4) .
Cu1 N2 1.980(5) .
Cu1 N1 1.981(5) .
Cu1 O3 1.998(4) .
Cu1 N7 2.323(5) 1_545
Cu1 Eu1 3.5518(6) .
Cu2 O6 1.948(4) .
Cu2 N3 1.974(6) .
Cu2 N4 1.974(5) .
Cu2 O7 1.983(4) .
Cu2 N5 2.339(5) .
Cu2 Eu1 3.5479(7) .
Eu1 O3 2.374(3) .
Eu1 O6 2.377(4) .
Eu1 O7 2.380(4) .
Eu1 O2 2.407(4) .
Eu1 N8 2.499(5) 1_545
Eu1 O4 2.508(4) .
Eu1 O1 2.512(4) .
Eu1 O5 2.523(4) .
Eu1 O8 2.591(5) .
N7 Cu1 2.323(5) 1_565
N8 Eu1 2.499(5) 1_565
