#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:32:58 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179850 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/46/7014673.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_7014673
loop_
_publ_author_name
'Kachi-Terajima, Chihiro'
'Yanagi, Katsuya'
'Kaziki, Toru'
'Kitazawa, Takafumi'
'Hasegawa, Miki'
_publ_section_title
;
 Luminescence tuning of imidazole-based lanthanide(iii) complexes [Ln =
 Sm, Eu, Gd, Tb, Dy].
;
_journal_issue                   10
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2249
_journal_page_last               2256
_journal_paper_doi               10.1039/c0dt01046d
_journal_volume                  40
_journal_year                    2011
_chemical_formula_sum            'C19 H28 Eu N13 O10'
_chemical_formula_weight         750.50
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                102.599(6)
_cell_angle_beta                 107.322(6)
_cell_angle_gamma                104.235(6)
_cell_formula_units_Z            4
_cell_length_a                   11.126(4)
_cell_length_b                   16.104(6)
_cell_length_c                   17.585(7)
_cell_measurement_reflns_used    2773
_cell_measurement_temperature    90(2)
_cell_measurement_theta_max      0.00
_cell_measurement_theta_min      0.00
_cell_volume                     2767.2(18)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      90(2)
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.985
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0448
_diffrn_reflns_av_sigmaI/netI    0.0820
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            10528
_diffrn_reflns_theta_full        21.82
_diffrn_reflns_theta_max         21.82
_diffrn_reflns_theta_min         1.28
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    2.344
_exptl_absorpt_correction_T_max  0.5809
_exptl_absorpt_correction_T_min  0.4253
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS; Sheldrick 1996'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.801
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1504
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.31
_exptl_crystal_size_min          0.26
_refine_diff_density_max         7.737
_refine_diff_density_min         -1.449
_refine_diff_density_rms         0.233
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     743
_refine_ls_number_reflns         6529
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.059
_refine_ls_R_factor_all          0.1034
_refine_ls_R_factor_gt           0.0769
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1149P)²+30.7706P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1876
_refine_ls_wR_factor_ref         0.2068
_reflns_number_gt                4775
_reflns_number_total             6529
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0DT01046D.TXT
_cod_data_source_block           7_EuH3L
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1555 2011-01-17 13:19:09Z saulius 
;
_cod_original_cell_volume        2767.4(19)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7014673
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.7113(17) 0.1837(11) 0.1092(10) 0.039(5) Uani 1 1 d . . .
H19A H 0.6635 0.1208 0.1035 0.047 Uiso 1 1 calc R . .
H19B H 0.7220 0.1845 0.0554 0.047 Uiso 1 1 calc R . .
C2 C 0.6291(16) 0.2438(11) 0.1282(10) 0.034(4) Uani 1 1 d . . .
H20A H 0.5409 0.2227 0.0820 0.041 Uiso 1 1 calc R . .
H20B H 0.6148 0.2417 0.1808 0.041 Uiso 1 1 calc R . .
C3 C 0.6522(17) 0.3802(12) 0.0899(10) 0.034(3) Uani 1 1 d . . .
H21 H 0.5632 0.3530 0.0501 0.041 Uiso 1 1 calc R . .
C4 C 0.7293(16) 0.4700(11) 0.0988(10) 0.031(4) Uani 1 1 d . . .
C5 C 0.6978(17) 0.5274(12) 0.0591(10) 0.034(4) Uani 1 1 d . . .
H23 H 0.6146 0.5168 0.0164 0.041 Uiso 1 1 calc R . .
C6 C 0.9008(18) 0.5857(13) 0.1481(10) 0.039(5) Uani 1 1 d . . .
H24 H 0.9879 0.6276 0.1809 0.047 Uiso 1 1 calc R . .
C7 C 0.9380(16) 0.1818(12) 0.1461(10) 0.037(4) Uani 1 1 d . . .
H25A H 0.9392 0.1996 0.0958 0.045 Uiso 1 1 calc R . .
H25B H 0.9049 0.1150 0.1288 0.045 Uiso 1 1 calc R . .
C8 C 1.0782(17) 0.2159(12) 0.2097(10) 0.039(5) Uani 1 1 d . . .
H26A H 1.1404 0.2034 0.1822 0.047 Uiso 1 1 calc R . .
H26B H 1.0835 0.1854 0.2531 0.047 Uiso 1 1 calc R . .
C9 C 1.2351(16) 0.3552(12) 0.3016(10) 0.034(3) Uani 1 1 d . . .
H27 H 1.2987 0.3248 0.3084 0.041 Uiso 1 1 calc R . .
C10 C 1.2692(18) 0.4511(13) 0.3515(10) 0.040(5) Uani 1 1 d . . .
C11 C 1.3862(18) 0.5051(14) 0.4098(11) 0.044(5) Uani 1 1 d . . .
H29 H 1.4683 0.4935 0.4250 0.053 Uiso 1 1 calc R . .
C12 C 1.2294(17) 0.5686(11) 0.4038(9) 0.032(4) Uani 1 1 d . . .
H30 H 1.1853 0.6107 0.4150 0.039 Uiso 1 1 calc R . .
C13 C 0.8276(17) 0.1837(11) 0.2494(10) 0.035(4) Uani 1 1 d . . .
H31A H 0.8456 0.1259 0.2444 0.042 Uiso 1 1 calc R . .
H31B H 0.7337 0.1719 0.2448 0.042 Uiso 1 1 calc R . .
C14 C 0.9185(17) 0.2502(10) 0.3354(10) 0.035(4) Uani 1 1 d . . .
H32A H 0.8919 0.2310 0.3794 0.042 Uiso 1 1 calc R . .
H32B H 1.0121 0.2527 0.3461 0.042 Uiso 1 1 calc R . .
C15 C 0.8714(15) 0.3805(11) 0.3909(10) 0.032(3) Uani 1 1 d . . .
H33 H 0.8555 0.3560 0.4329 0.038 Uiso 1 1 calc R . .
C16 C 0.8551(16) 0.4653(11) 0.3884(10) 0.032(3) Uani 1 1 d . . .
C17 C 0.8216(16) 0.5262(11) 0.4363(11) 0.038(4) Uani 1 1 d . . .
H35 H 0.8003 0.5221 0.4841 0.045 Uiso 1 1 calc R . .
C18 C 0.8605(15) 0.5754(11) 0.3369(9) 0.029(4) Uani 1 1 d . . .
H36 H 0.8716 0.6131 0.3030 0.035 Uiso 1 1 calc R . .
C19 C 0.6818(18) 0.3479(11) 0.8721(10) 0.041(3) Uani 1 1 d . . .
H7A H 0.6676 0.3444 0.9244 0.049 Uiso 1 1 calc R . .
H7B H 0.7117 0.4125 0.8760 0.049 Uiso 1 1 calc R . .
C20 C 0.7888(16) 0.3095(11) 0.8649(10) 0.040(5) Uani 1 1 d . . .
H8A H 0.8079 0.3162 0.8147 0.048 Uiso 1 1 calc R . .
H8B H 0.8718 0.3424 0.9150 0.048 Uiso 1 1 calc R . .
C21 C 0.8210(16) 0.1786(13) 0.9008(10) 0.035(3) Uani 1 1 d . . .
H9 H 0.9119 0.2128 0.9342 0.041 Uiso 1 1 calc R . .
C22 C 0.7657(17) 0.0864(12) 0.8969(9) 0.031(4) Uani 1 1 d . . .
C23 C 0.820(2) 0.0262(17) 0.9289(11) 0.058(6) Uani 1 1 d . . .
H11 H 0.9113 0.0379 0.9614 0.070 Uiso 1 1 calc R . .
C24 C 0.611(2) -0.0372(16) 0.8624(11) 0.051(6) Uani 1 1 d . . .
H12 H 0.5253 -0.0823 0.8407 0.062 Uiso 1 1 calc R . .
C25 C 0.4442(18) 0.3187(11) 0.8223(10) 0.041(3) Uani 1 1 d . . .
H1A H 0.4582 0.3842 0.8355 0.049 Uiso 1 1 calc R . .
H1B H 0.4444 0.3020 0.8733 0.049 Uiso 1 1 calc R . .
C26 C 0.3115(17) 0.2675(10) 0.7530(10) 0.037(4) Uani 1 1 d . . .
H2A H 0.2386 0.2691 0.7741 0.044 Uiso 1 1 calc R . .
H2B H 0.3004 0.2948 0.7072 0.044 Uiso 1 1 calc R . .
C27 C 0.1993(16) 0.1161(12) 0.6640(10) 0.035(3) Uani 1 1 d . . .
H3 H 0.1222 0.1331 0.6459 0.041 Uiso 1 1 calc R . .
C28 C 0.1956(15) 0.0261(9) 0.6267(10) 0.028(4) Uani 1 1 d . . .
C29 C 0.0953(16) -0.0456(12) 0.5668(11) 0.038(5) Uani 1 1 d . . .
H5 H 0.0044 -0.0508 0.5413 0.046 Uiso 1 1 calc R . .
C30 C 0.2842(17) -0.0774(11) 0.6003(9) 0.030(4) Uani 1 1 d . . .
H6 H 0.3451 -0.1097 0.6008 0.037 Uiso 1 1 calc R . .
C31 C 0.5672(17) 0.3322(11) 0.7278(10) 0.036(4) Uani 1 1 d . . .
H13A H 0.6633 0.3580 0.7382 0.043 Uiso 1 1 calc R . .
H13B H 0.5283 0.3811 0.7255 0.043 Uiso 1 1 calc R . .
C32 C 0.4998(16) 0.2588(11) 0.6439(9) 0.034(4) Uani 1 1 d . . .
H14A H 0.4017 0.2434 0.6256 0.041 Uiso 1 1 calc R . .
H14B H 0.5283 0.2800 0.6012 0.041 Uiso 1 1 calc R . .
C33 C 0.5874(15) 0.1440(11) 0.6023(10) 0.031(4) Uani 1 1 d . . .
H15 H 0.5983 0.1668 0.5585 0.037 Uiso 1 1 calc R . .
C34 C 0.6268(15) 0.0679(10) 0.6152(9) 0.026(4) Uani 1 1 d . . .
C35 C 0.6796(16) 0.0150(11) 0.5741(10) 0.032(4) Uani 1 1 d . . .
H17 H 0.7004 0.0198 0.5263 0.038 Uiso 1 1 calc R . .
C36 C 0.6554(15) -0.0283(12) 0.6778(10) 0.031(4) Uani 1 1 d . . .
H18A H 0.6576 -0.0615 0.7164 0.037 Uiso 1 1 calc R . .
C37 C 0.491(2) 0.4354(14) 0.2175(15) 0.067(7) Uani 1 1 d . . .
H37A H 0.5850 0.4732 0.2430 0.100 Uiso 1 1 calc R . .
H37B H 0.4833 0.3723 0.2122 0.100 Uiso 1 1 calc R . .
H37C H 0.4433 0.4553 0.2529 0.100 Uiso 1 1 calc R . .
C38 C 0.965(2) 0.8937(15) 0.1931(17) 0.077(7) Uani 1 1 d . . .
H38A H 0.8977 0.9048 0.2156 0.115 Uiso 1 1 calc R . .
H38B H 0.9443 0.9020 0.1376 0.115 Uiso 1 1 calc R . .
H38C H 1.0534 0.9363 0.2309 0.115 Uiso 1 1 calc R . .
Eu1 Eu 0.94970(7) 0.39851(5) 0.22473(5) 0.0243(3) Uani 1 1 d D . .
Eu2 Eu 0.50698(7) 0.12394(5) 0.76935(4) 0.0205(3) Uani 1 1 d . . .
N1 N 0.8446(13) 0.2161(8) 0.1772(8) 0.032(3) Uani 1 1 d . . .
N2 N 0.7050(15) 0.3366(10) 0.1369(8) 0.045(3) Uani 1 1 d . . .
N3 N 0.8561(12) 0.5029(9) 0.1524(8) 0.032(3) Uani 1 1 d . . .
N4 N 0.8036(15) 0.6025(10) 0.0896(9) 0.040(4) Uani 1 1 d . . .
H15A H 0.8101 0.6521 0.0755 0.048 Uiso 1 1 calc R . .
N5 N 1.1157(12) 0.3168(9) 0.2495(8) 0.045(3) Uani 1 1 d D . .
N6 N 1.1735(13) 0.4886(8) 0.3478(7) 0.029(3) Uani 1 1 d . . .
N7 N 1.3613(14) 0.5820(10) 0.4435(9) 0.042(4) Uani 1 1 d . . .
H18 H 1.4201 0.6309 0.4835 0.050 Uiso 1 1 calc R . .
N8 N 0.9071(12) 0.3382(8) 0.3369(8) 0.026(3) Uani 1 1 d . . .
N9 N 0.8792(12) 0.4961(8) 0.3250(7) 0.024(3) Uani 1 1 d . . .
N10 N 0.8243(13) 0.5955(9) 0.4023(8) 0.035(3) Uani 1 1 d . . .
H39 H 0.8056 0.6443 0.4205 0.043 Uiso 1 1 calc R . .
N11 N 1.0460(13) 0.4213(10) 0.0942(8) 0.034(3) Uani 1 1 d . . .
N12 N 0.5540(12) 0.3004(8) 0.8001(8) 0.028(3) Uani 1 1 d . . .
N13 N 0.7443(13) 0.2135(9) 0.8582(8) 0.034(3) Uani 1 1 d . . .
N14 N 0.6293(13) 0.0421(10) 0.8525(8) 0.029(3) Uani 1 1 d . . .
N15 N 0.7210(18) -0.0500(13) 0.9052(11) 0.054(5) Uani 1 1 d . . .
H7 H 0.7268 -0.1001 0.9158 0.064 Uiso 1 1 calc R . .
N16 N 0.3064(12) 0.1726(9) 0.7214(8) 0.028(3) Uani 1 1 d . . .
N17 N 0.3124(13) 0.0060(8) 0.6475(7) 0.029(3) Uani 1 1 d . . .
N18 N 0.1537(14) -0.1083(10) 0.5513(8) 0.037(4) Uani 1 1 d . . .
H4 H 0.1119 -0.1624 0.5140 0.044 Uiso 1 1 calc R . .
N19 N 0.5367(13) 0.1802(8) 0.6523(7) 0.027(3) Uani 1 1 d . . .
N20 N 0.6103(12) 0.0404(8) 0.6818(7) 0.025(3) Uani 1 1 d . . .
N21 N 0.6971(13) -0.0469(9) 0.6151(9) 0.038(4) Uani 1 1 d . . .
H10 H 0.7296 -0.0903 0.6023 0.045 Uiso 1 1 calc R . .
N22 N 0.4040(13) 0.0954(9) 0.8983(8) 0.031(3) Uani 1 1 d . . .
N23 N 0.4492(14) 0.7427(11) 0.6267(11) 0.041(4) Uani 1 1 d . . .
N24 N 0.789(2) 0.7761(15) 0.9615(14) 0.080(6) Uani 1 1 d . . .
N25 N 0.7900(17) 0.7631(13) 0.5304(10) 0.052(4) Uani 1 1 d . . .
N26 N 0.0998(15) 0.7460(11) 0.3702(11) 0.052(5) Uani 1 1 d . . .
O1 O 1.1149(10) 0.4698(7) 0.1695(6) 0.033(3) Uani 1 1 d . . .
O2 O 0.9448(10) 0.3548(7) 0.0807(6) 0.032(3) Uani 1 1 d . . .
O3 O 1.0797(12) 0.4360(9) 0.0379(7) 0.060(4) Uani 1 1 d . . .
O4 O 0.3533(10) 0.0407(7) 0.8247(6) 0.030(3) Uani 1 1 d . . .
O5 O 0.4894(10) 0.1698(7) 0.9095(6) 0.031(3) Uani 1 1 d . . .
O6 O 0.3722(14) 0.0804(9) 0.9545(7) 0.065(4) Uani 1 1 d . . .
O7 O 0.4315(16) 0.7617(9) 0.5630(8) 0.072(5) Uani 1 1 d . . .
O8 O 0.4501(16) 0.7974(10) 0.6883(9) 0.073(4) Uani 1 1 d . . .
O9 O 0.4655(14) 0.6708(10) 0.6319(9) 0.068(4) Uani 1 1 d . . .
O10 O 0.877(2) 0.8448(12) 0.9828(11) 0.104(7) Uani 1 1 d . . .
O11 O 0.686(2) 0.7670(12) 0.9034(15) 0.118(5) Uani 1 1 d . . .
O12 O 0.8096(18) 0.7050(12) 0.9746(14) 0.118(5) Uani 1 1 d . . .
O13 O 0.8252(12) 0.7740(8) 0.4740(8) 0.050(3) Uani 1 1 d . . .
O14 O 0.7276(17) 0.6873(12) 0.5290(9) 0.075(4) Uani 1 1 d . . .
O15 O 0.8198(16) 0.8296(11) 0.5948(9) 0.092(6) Uani 1 1 d . . .
O16 O 0.1264(14) 0.7328(9) 0.4388(8) 0.056(4) Uani 1 1 d . . .
O17 O 0.0348(14) 0.7961(10) 0.3518(9) 0.064(4) Uani 1 1 d . . .
O18 O 0.1410(14) 0.7098(9) 0.3166(8) 0.064(4) Uani 1 1 d . . .
O19 O 0.4304(18) 0.4434(9) 0.1329(11) 0.079(5) Uani 1 1 d . . .
H19 H 0.3886 0.3917 0.0978 0.119 Uiso 1 1 calc R . .
O20 O 0.9643(18) 0.8044(11) 0.1860(13) 0.105(6) Uani 1 1 d . . .
H20 H 0.9021 0.7687 0.1417 0.157 Uiso 1 1 calc R . .
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'
Eu Eu -0.1578 3.6682 '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
_geom_angle_publ_flag
N1 C1 C2 110.6(12) . . ?
N1 C1 H19A 109.5 . . ?
C2 C1 H19A 109.5 . . ?
N1 C1 H19B 109.5 . . ?
C2 C1 H19B 109.5 . . ?
H19A C1 H19B 108.1 . . ?
N2 C2 C1 107.4(13) . . ?
N2 C2 H20A 110.2 . . ?
C1 C2 H20A 110.2 . . ?
N2 C2 H20B 110.2 . . ?
C1 C2 H20B 110.2 . . ?
H20A C2 H20B 108.5 . . ?
N2 C3 C4 119.5(16) . . ?
N2 C3 H21 120.3 . . ?
C4 C3 H21 120.3 . . ?
C5 C4 N3 111.7(15) . . ?
C5 C4 C3 130.6(16) . . ?
N3 C4 C3 117.7(15) . . ?
C4 C5 N4 107.9(16) . . ?
C4 C5 H23 126.1 . . ?
N4 C5 H23 126.1 . . ?
N3 C6 N4 110.8(15) . . ?
N3 C6 H24 124.6 . . ?
N4 C6 H24 124.6 . . ?
N1 C7 C8 113.5(13) . . ?
N1 C7 H25A 108.9 . . ?
C8 C7 H25A 108.9 . . ?
N1 C7 H25B 108.9 . . ?
C8 C7 H25B 108.9 . . ?
H25A C7 H25B 107.7 . . ?
C7 C8 N5 108.0(13) . . ?
C7 C8 H26A 110.1 . . ?
N5 C8 H26A 110.1 . . ?
C7 C8 H26B 110.1 . . ?
N5 C8 H26B 110.1 . . ?
H26A C8 H26B 108.4 . . ?
N5 C9 C10 115.8(14) . . ?
N5 C9 H27 122.1 . . ?
C10 C9 H27 122.1 . . ?
C11 C10 N6 112.0(16) . . ?
C11 C10 C9 127.1(17) . . ?
N6 C10 C9 120.4(15) . . ?
C10 C11 N7 104.3(15) . . ?
C10 C11 H29 127.8 . . ?
N7 C11 H29 127.8 . . ?
N6 C12 N7 109.0(16) . . ?
N6 C12 H30 125.5 . . ?
N7 C12 H30 125.5 . . ?
N1 C13 C14 113.7(13) . . ?
N1 C13 H31A 108.8 . . ?
C14 C13 H31A 108.8 . . ?
N1 C13 H31B 108.8 . . ?
C14 C13 H31B 108.8 . . ?
H31A C13 H31B 107.7 . . ?
N8 C14 C13 108.2(13) . . ?
N8 C14 H32A 110.1 . . ?
C13 C14 H32A 110.1 . . ?
N8 C14 H32B 110.1 . . ?
C13 C14 H32B 110.1 . . ?
H32A C14 H32B 108.4 . . ?
N8 C15 C16 119.7(15) . . ?
N8 C15 H33 120.1 . . ?
C16 C15 H33 120.1 . . ?
C17 C16 N9 109.2(15) . . ?
C17 C16 C15 134.1(16) . . ?
N9 C16 C15 116.7(14) . . ?
C16 C17 N10 106.5(16) . . ?
C16 C17 H35 126.8 . . ?
N10 C17 H35 126.8 . . ?
N9 C18 N10 111.3(14) . . ?
N9 C18 H36 124.3 . . ?
N10 C18 H36 124.3 . . ?
N12 C19 C20 112.6(12) . . ?
N12 C19 H7A 109.1 . . ?
C20 C19 H7A 109.1 . . ?
N12 C19 H7B 109.1 . . ?
C20 C19 H7B 109.1 . . ?
H7A C19 H7B 107.8 . . ?
N13 C20 C19 109.3(14) . . ?
N13 C20 H8A 109.8 . . ?
C19 C20 H8A 109.8 . . ?
N13 C20 H8B 109.8 . . ?
C19 C20 H8B 109.8 . . ?
H8A C20 H8B 108.3 . . ?
N13 C21 C22 118.3(15) . . ?
N13 C21 H9 120.9 . . ?
C22 C21 H9 120.9 . . ?
N14 C22 C23 108.2(17) . . ?
N14 C22 C21 118.1(14) . . ?
C23 C22 C21 133.7(18) . . ?
N15 C23 C22 106.7(18) . . ?
N15 C23 H11 126.7 . . ?
C22 C23 H11 126.7 . . ?
N14 C24 N15 115(2) . . ?
N14 C24 H12 122.7 . . ?
N15 C24 H12 122.7 . . ?
N12 C25 C26 112.0(12) . . ?
N12 C25 H1A 109.2 . . ?
C26 C25 H1A 109.2 . . ?
N12 C25 H1B 109.2 . . ?
C26 C25 H1B 109.2 . . ?
H1A C25 H1B 107.9 . . ?
N16 C26 C25 107.9(13) . . ?
N16 C26 H2A 110.1 . . ?
C25 C26 H2A 110.1 . . ?
N16 C26 H2B 110.1 . . ?
C25 C26 H2B 110.1 . . ?
H2A C26 H2B 108.4 . . ?
N16 C27 C28 119.5(14) . . ?
N16 C27 H3 120.2 . . ?
C28 C27 H3 120.2 . . ?
C29 C28 N17 109.9(14) . . ?
C29 C28 C27 130.9(16) . . ?
N17 C28 C27 119.0(13) . . ?
N18 C29 C28 104.2(14) . . ?
N18 C29 H5 127.9 . . ?
C28 C29 H5 127.9 . . ?
N17 C30 N18 107.7(15) . . ?
N17 C30 H6 126.2 . . ?
N18 C30 H6 126.2 . . ?
N12 C31 C32 113.7(13) . . ?
N12 C31 H13A 108.8 . . ?
C32 C31 H13A 108.8 . . ?
N12 C31 H13B 108.8 . . ?
C32 C31 H13B 108.8 . . ?
H13A C31 H13B 107.7 . . ?
N19 C32 C31 108.7(13) . . ?
N19 C32 H14A 109.9 . . ?
C31 C32 H14A 109.9 . . ?
N19 C32 H14B 109.9 . . ?
C31 C32 H14B 109.9 . . ?
H14A C32 H14B 108.3 . . ?
N19 C33 C34 117.8(14) . . ?
N19 C33 H15 121.1 . . ?
C34 C33 H15 121.1 . . ?
C35 C34 N20 110.2(15) . . ?
C35 C34 C33 132.4(15) . . ?
N20 C34 C33 117.3(13) . . ?
C34 C35 N21 106.4(14) . . ?
C34 C35 H17 126.8 . . ?
N21 C35 H17 126.8 . . ?
N20 C36 N21 113.9(15) . . ?
N20 C36 H18A 123.0 . . ?
N21 C36 H18A 123.0 . . ?
O19 C37 H37A 109.5 . . ?
O19 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
O19 C37 H37C 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
O20 C38 H38A 109.5 . . ?
O20 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
O20 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
O2 Eu1 O1 52.1(3) . . ?
O2 Eu1 N8 143.7(4) . . ?
O1 Eu1 N8 148.0(4) . . ?
O2 Eu1 N2 76.8(4) . . ?
O1 Eu1 N2 121.0(4) . . ?
N8 Eu1 N2 90.6(4) . . ?
O2 Eu1 N5 82.9(4) . . ?
O1 Eu1 N5 76.6(4) . . ?
N8 Eu1 N5 79.1(4) . . ?
N2 Eu1 N5 129.1(5) . . ?
O2 Eu1 N9 144.5(4) . . ?
O1 Eu1 N9 120.0(4) . . ?
N8 Eu1 N9 64.4(4) . . ?
N2 Eu1 N9 83.8(4) . . ?
N5 Eu1 N9 131.7(4) . . ?
O2 Eu1 N3 72.7(4) . . ?
O1 Eu1 N3 73.0(4) . . ?
N8 Eu1 N3 131.9(4) . . ?
N2 Eu1 N3 64.4(5) . . ?
N5 Eu1 N3 148.7(4) . . ?
N9 Eu1 N3 72.1(4) . . ?
O2 Eu1 N6 119.8(4) . . ?
O1 Eu1 N6 71.0(4) . . ?
N8 Eu1 N6 80.0(4) . . ?
N2 Eu1 N6 161.7(4) . . ?
N5 Eu1 N6 64.8(4) . . ?
N9 Eu1 N6 78.0(4) . . ?
N3 Eu1 N6 110.8(4) . . ?
O2 Eu1 N1 78.2(4) . . ?
O1 Eu1 N1 119.8(4) . . ?
N8 Eu1 N1 65.6(4) . . ?
N2 Eu1 N1 66.0(5) . . ?
N5 Eu1 N1 64.3(4) . . ?
N9 Eu1 N1 120.2(4) . . ?
N3 Eu1 N1 126.7(4) . . ?
N6 Eu1 N1 122.4(4) . . ?
O2 Eu1 N11 26.2(3) . . ?
O1 Eu1 N11 26.2(3) . . ?
N8 Eu1 N11 159.6(4) . . ?
N2 Eu1 N11 97.8(4) . . ?
N5 Eu1 N11 81.2(4) . . ?
N9 Eu1 N11 134.8(4) . . ?
N3 Eu1 N11 68.3(4) . . ?
N6 Eu1 N11 96.3(4) . . ?
N1 Eu1 N11 100.9(4) . . ?
O4 Eu2 N13 122.2(4) . . ?
O4 Eu2 O5 51.2(3) . . ?
N13 Eu2 O5 79.6(4) . . ?
O4 Eu2 N19 148.0(4) . . ?
N13 Eu2 N19 89.5(4) . . ?
O5 Eu2 N19 143.4(4) . . ?
O4 Eu2 N14 72.9(4) . . ?
N13 Eu2 N14 65.7(5) . . ?
O5 Eu2 N14 75.0(4) . . ?
N19 Eu2 N14 131.5(4) . . ?
O4 Eu2 N17 71.6(4) . . ?
N13 Eu2 N17 157.8(4) . . ?
O5 Eu2 N17 119.9(4) . . ?
N19 Eu2 N17 80.2(4) . . ?
N14 Eu2 N17 107.0(4) . . ?
O4 Eu2 N16 77.6(4) . . ?
N13 Eu2 N16 130.9(5) . . ?
O5 Eu2 N16 83.8(4) . . ?
N19 Eu2 N16 77.4(4) . . ?
N14 Eu2 N16 150.2(4) . . ?
N17 Eu2 N16 66.0(4) . . ?
O4 Eu2 N20 120.0(4) . . ?
N13 Eu2 N20 82.9(4) . . ?
O5 Eu2 N20 146.2(4) . . ?
N19 Eu2 N20 64.3(4) . . ?
N14 Eu2 N20 71.4(4) . . ?
N17 Eu2 N20 74.9(4) . . ?
N16 Eu2 N20 128.9(4) . . ?
O4 Eu2 N12 118.5(4) . . ?
N13 Eu2 N12 67.9(4) . . ?
O5 Eu2 N12 77.8(4) . . ?
N19 Eu2 N12 65.8(4) . . ?
N14 Eu2 N12 129.4(4) . . ?
N17 Eu2 N12 123.5(4) . . ?
N16 Eu2 N12 63.5(4) . . ?
N20 Eu2 N12 121.5(4) . . ?
O4 Eu2 N22 25.6(3) . . ?
N13 Eu2 N22 99.9(4) . . ?
O5 Eu2 N22 25.8(3) . . ?
N19 Eu2 N22 158.7(4) . . ?
N14 Eu2 N22 69.6(4) . . ?
N17 Eu2 N22 96.5(4) . . ?
N16 Eu2 N22 82.1(4) . . ?
N20 Eu2 N22 135.4(4) . . ?
N12 Eu2 N22 100.0(4) . . ?
C7 N1 C1 109.9(12) . . ?
C7 N1 C13 111.7(13) . . ?
C1 N1 C13 107.6(12) . . ?
C7 N1 Eu1 105.5(9) . . ?
C1 N1 Eu1 110.3(10) . . ?
C13 N1 Eu1 111.7(9) . . ?
C3 N2 C2 120.7(15) . . ?
C3 N2 Eu1 119.8(12) . . ?
C2 N2 Eu1 118.6(11) . . ?
C6 N3 C4 104.2(14) . . ?
C6 N3 Eu1 137.7(11) . . ?
C4 N3 Eu1 117.9(11) . . ?
C5 N4 C6 105.2(15) . . ?
C5 N4 H15A 127.4 . . ?
C6 N4 H15A 127.4 . . ?
C9 N5 C8 114.5(12) . . ?
C9 N5 Eu1 122.6(10) . . ?
C8 N5 Eu1 122.7(9) . . ?
C12 N6 C10 106.9(14) . . ?
C12 N6 Eu1 137.7(12) . . ?
C10 N6 Eu1 114.6(10) . . ?
C12 N7 C11 107.8(15) . . ?
C12 N7 H18 126.1 . . ?
C11 N7 H18 126.1 . . ?
C15 N8 C14 121.0(14) . . ?
C15 N8 Eu1 121.7(11) . . ?
C14 N8 Eu1 117.2(9) . . ?
C18 N9 C16 105.4(12) . . ?
C18 N9 Eu1 137.1(10) . . ?
C16 N9 Eu1 117.4(10) . . ?
C18 N10 C17 107.6(14) . . ?
C18 N10 H39 126.2 . . ?
C17 N10 H39 126.2 . . ?
O3 N11 O1 120.7(13) . . ?
O3 N11 O2 121.5(13) . . ?
O1 N11 O2 117.7(12) . . ?
O3 N11 Eu1 174.0(12) . . ?
O1 N11 Eu1 59.8(7) . . ?
O2 N11 Eu1 58.8(7) . . ?
C25 N12 C19 110.1(12) . . ?
C25 N12 C31 112.0(13) . . ?
C19 N12 C31 107.3(12) . . ?
C25 N12 Eu2 106.2(9) . . ?
C19 N12 Eu2 108.0(9) . . ?
C31 N12 Eu2 113.3(9) . . ?
C21 N13 C20 121.8(14) . . ?
C21 N13 Eu2 121.1(12) . . ?
C20 N13 Eu2 116.9(10) . . ?
C24 N14 C22 103.2(14) . . ?
C24 N14 Eu2 140.0(13) . . ?
C22 N14 Eu2 116.2(10) . . ?
C23 N15 C24 107.3(18) . . ?
C23 N15 H7 126.4 . . ?
C24 N15 H7 126.4 . . ?
C27 N16 C26 118.3(13) . . ?
C27 N16 Eu2 119.2(11) . . ?
C26 N16 Eu2 122.3(9) . . ?
C30 N17 C28 107.0(13) . . ?
C30 N17 Eu2 137.3(11) . . ?
C28 N17 Eu2 115.3(9) . . ?
C30 N18 C29 111.2(14) . . ?
C30 N18 H4 124.4 . . ?
C29 N18 H4 124.4 . . ?
C33 N19 C32 120.0(13) . . ?
C33 N19 Eu2 122.6(11) . . ?
C32 N19 Eu2 117.4(9) . . ?
C36 N20 C34 103.3(12) . . ?
C36 N20 Eu2 138.8(10) . . ?
C34 N20 Eu2 117.9(10) . . ?
C36 N21 C35 106.2(14) . . ?
C36 N21 H10 126.9 . . ?
C35 N21 H10 126.9 . . ?
O6 N22 O4 123.1(13) . . ?
O6 N22 O5 120.9(13) . . ?
O4 N22 O5 116.0(12) . . ?
O6 N22 Eu2 173.2(13) . . ?
O4 N22 Eu2 57.8(7) . . ?
O5 N22 Eu2 59.0(7) . . ?
O7 N23 O9 122.1(18) . . ?
O7 N23 O8 118.0(16) . . ?
O9 N23 O8 119.9(17) . . ?
O10 N24 O11 116(2) . . ?
O10 N24 O12 122(2) . . ?
O11 N24 O12 118(2) . . ?
O13 N25 O14 121.6(16) . . ?
O13 N25 O15 120(2) . . ?
O14 N25 O15 118.1(19) . . ?
O16 N26 O17 122.0(16) . . ?
O16 N26 O18 120.3(18) . . ?
O17 N26 O18 117.7(19) . . ?
N11 O1 Eu1 94.1(8) . . ?
N11 O2 Eu1 95.0(8) . . ?
N22 O4 Eu2 96.6(8) . . ?
N22 O5 Eu2 95.3(8) . . ?
C37 O19 H19 109.5 . . ?
C38 O20 H20 109.5 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.48(2) . ?
C1 C2 1.54(2) . ?
C1 H19A 0.9900 . ?
C1 H19B 0.9900 . ?
C2 N2 1.47(2) . ?
C2 H20A 0.9900 . ?
C2 H20B 0.9900 . ?
C3 N2 1.30(2) . ?
C3 C4 1.44(2) . ?
C3 H21 0.9500 . ?
C4 C5 1.33(2) . ?
C4 N3 1.33(2) . ?
C5 N4 1.33(2) . ?
C5 H23 0.9500 . ?
C6 N3 1.33(2) . ?
C6 N4 1.38(2) . ?
C6 H24 0.9500 . ?
C7 N1 1.47(2) . ?
C7 C8 1.50(2) . ?
C7 H25A 0.9900 . ?
C7 H25B 0.9900 . ?
C8 N5 1.52(2) . ?
C8 H26A 0.9900 . ?
C8 H26B 0.9900 . ?
C9 N5 1.269(19) . ?
C9 C10 1.49(2) . ?
C9 H27 0.9500 . ?
C10 C11 1.33(2) . ?
C10 N6 1.34(2) . ?
C11 N7 1.38(2) . ?
C11 H29 0.9500 . ?
C12 N6 1.306(19) . ?
C12 N7 1.36(2) . ?
C12 H30 0.9500 . ?
C13 N1 1.52(2) . ?
C13 C14 1.52(2) . ?
C13 H31A 0.9900 . ?
C13 H31B 0.9900 . ?
C14 N8 1.45(2) . ?
C14 H32A 0.9900 . ?
C14 H32B 0.9900 . ?
C15 N8 1.263(19) . ?
C15 C16 1.43(2) . ?
C15 H33 0.9500 . ?
C16 C17 1.35(2) . ?
C16 N9 1.39(2) . ?
C17 N10 1.37(2) . ?
C17 H35 0.9500 . ?
C18 N9 1.325(19) . ?
C18 N10 1.330(19) . ?
C18 H36 0.9500 . ?
C19 N12 1.48(2) . ?
C19 C20 1.50(2) . ?
C19 H7A 0.9900 . ?
C19 H7B 0.9900 . ?
C20 N13 1.47(2) . ?
C20 H8A 0.9900 . ?
C20 H8B 0.9900 . ?
C21 N13 1.28(2) . ?
C21 C22 1.44(2) . ?
C21 H9 0.9500 . ?
C22 N14 1.39(2) . ?
C22 C23 1.39(2) . ?
C23 N15 1.32(3) . ?
C23 H11 0.9500 . ?
C24 N14 1.30(2) . ?
C24 N15 1.32(2) . ?
C24 H12 0.9500 . ?
C25 N12 1.46(2) . ?
C25 C26 1.50(2) . ?
C25 H1A 0.9900 . ?
C25 H1B 0.9900 . ?
C26 N16 1.49(2) . ?
C26 H2A 0.9900 . ?
C26 H2B 0.9900 . ?
C27 N16 1.272(19) . ?
C27 C28 1.44(2) . ?
C27 H3 0.9500 . ?
C28 C29 1.35(2) . ?
C28 N17 1.38(2) . ?
C29 N18 1.35(2) . ?
C29 H5 0.9500 . ?
C30 N17 1.321(19) . ?
C30 N18 1.35(2) . ?
C30 H6 0.9500 . ?
C31 N12 1.50(2) . ?
C31 C32 1.51(2) . ?
C31 H13A 0.9900 . ?
C31 H13B 0.9900 . ?
C32 N19 1.45(2) . ?
C32 H14A 0.9900 . ?
C32 H14B 0.9900 . ?
C33 N19 1.289(19) . ?
C33 C34 1.44(2) . ?
C33 H15 0.9500 . ?
C34 C35 1.35(2) . ?
C34 N20 1.384(19) . ?
C35 N21 1.37(2) . ?
C35 H17 0.9500 . ?
C36 N20 1.32(2) . ?
C36 N21 1.32(2) . ?
C36 H18A 0.9500 . ?
C37 O19 1.49(3) . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C37 H37C 0.9800 . ?
C38 O20 1.41(3) . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C38 H38C 0.9800 . ?
Eu1 O2 2.457(10) . ?
Eu1 O1 2.480(10) . ?
Eu1 N8 2.496(13) . ?
Eu1 N2 2.507(15) . ?
Eu1 N5 2.510(9) . ?
Eu1 N9 2.533(12) . ?
Eu1 N3 2.556(13) . ?
Eu1 N6 2.575(12) . ?
Eu1 N1 2.712(12) . ?
Eu1 N11 2.863(13) . ?
Eu2 O4 2.470(10) . ?
Eu2 N13 2.486(13) . ?
Eu2 O5 2.495(10) . ?
Eu2 N19 2.498(12) . ?
Eu2 N14 2.503(13) . ?
Eu2 N17 2.515(12) . ?
Eu2 N16 2.517(12) . ?
Eu2 N20 2.533(13) . ?
Eu2 N12 2.659(12) . ?
Eu2 N22 2.899(13) . ?
N4 H15A 0.8800 . ?
N7 H18 0.8800 . ?
N10 H39 0.8800 . ?
N11 O3 1.205(17) . ?
N11 O1 1.266(15) . ?
N11 O2 1.269(16) . ?
N15 H7 0.8800 . ?
N18 H4 0.8800 . ?
N21 H10 0.8800 . ?
N22 O6 1.197(17) . ?
N22 O4 1.263(15) . ?
N22 O5 1.265(16) . ?
N23 O7 1.199(19) . ?
N23 O9 1.233(18) . ?
N23 O8 1.233(19) . ?
N24 O10 1.18(2) . ?
N24 O11 1.24(2) . ?
N24 O12 1.27(2) . ?
N25 O13 1.20(2) . ?
N25 O14 1.24(2) . ?
N25 O15 1.269(19) . ?
N26 O16 1.23(2) . ?
N26 O17 1.24(2) . ?
N26 O18 1.259(19) . ?
O19 H19 0.8400 . ?
O20 H20 0.8400 . ?
