##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in          #
# Acta Crystallographica Section C. It conforms to the requirements of       #
# Notes for Authors for Acta Crystallographica Section C, and has been       #
# peer reviewed under the auspices of the IUCr Commission on Journals.       #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic.                                       #
#                                                                            #
# Software is freely available for graphical display of the structure(s)     #
# in this CIF. For information consult the CIF software page                 #
# http://www.iucr.org/resources/cif/software.                                #
#                                                                            #
# This file may be used for bona fide research purposes within the           #
# scientific community so long as proper attribution is given to the journal # 
# article from which it was obtained.                                        #
#                                                                            #
##############################################################################
data_I
_audit_creation_method     SHELXL97
_chemical_name_systematic
;
Tetrakis[μ-2-(quinolin-8-yloxy)acetato]tetrakis[μ-2-(quinolin-8-
yloxy)acetonitrile]tetracadmium tetrakis(perchlorate) dihydrate
;
_chemical_name_common     ?
_chemical_formula_moiety     'C88 H64 Cd4 N12 O16 4+, 4(Cl O4 -), 2(H2 O)'
_chemical_formula_sum     'C88 H68 Cd4 Cl4 N12 O34'
_chemical_formula_iupac
                           '[Cd4 (C11 H8 N O3)4 (C11 H8 N2 O)4] (Cl O4)4, 2H2 O'
_chemical_formula_weight     2428.94
_chemical_melting_point     ?
_symmetry_cell_setting     tetragonal
_symmetry_space_group_name_H-M     'I -4'
_symmetry_space_group_name_Hall     'I -4'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    'y, -x, -z'
    '-x, -y, z'
    '-y, x, -z'
    'x+1/2, y+1/2, z+1/2'
    'y+1/2, -x+1/2, -z+1/2'
    '-x+1/2, -y+1/2, z+1/2'
    '-y+1/2, x+1/2, -z+1/2'
_cell_length_a     27.838(4)
_cell_length_b     27.838(4)
_cell_length_c     11.779(2)
_cell_angle_alpha     90.00
_cell_angle_beta     90.00
_cell_angle_gamma     90.00
_cell_volume     9128(2)
_cell_formula_units_Z     4
_cell_measurement_reflns_used     10477
_cell_measurement_theta_min     3.10
_cell_measurement_theta_max     27.48
_cell_measurement_temperature     293(2)
_exptl_crystal_description     block
_exptl_crystal_colour     colourless
_exptl_crystal_size_max     0.2
_exptl_crystal_size_mid     0.2
_exptl_crystal_size_min     0.2
_exptl_crystal_density_diffrn     1.767
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     4848
_exptl_absorpt_coefficient_mu     1.132
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details     '(CrystalClear; Rigaku, 2005)'
_exptl_absorpt_correction_T_min     0.795
_exptl_absorpt_correction_T_max     0.810
_exptl_special_details     ?
_diffrn_ambient_temperature     293(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Rigaku Mercury2'
_diffrn_measurement_method     ω
_diffrn_detector_area_resol_mean     ?
_diffrn_reflns_number     47881
_diffrn_reflns_av_R_equivalents     0.0750
_diffrn_reflns_av_sigmaI/netI     0.0638
_diffrn_reflns_theta_min     3.10
_diffrn_reflns_theta_max     27.48
_diffrn_reflns_theta_full     27.48
_diffrn_measured_fraction_theta_max     0.998
_diffrn_measured_fraction_theta_full     0.998
_diffrn_reflns_limit_h_min     -36
_diffrn_reflns_limit_h_max     35
_diffrn_reflns_limit_k_min     -36
_diffrn_reflns_limit_k_max     36
_diffrn_reflns_limit_l_min     -15
_diffrn_reflns_limit_l_max     15
_diffrn_standards_number     180
_diffrn_standards_interval_count     3
_diffrn_standards_interval_time     9
_diffrn_standards_decay_%     0
_refine_special_details
;
Refinement of F² against ALL reflections. The weighted R-factor
wR and goodness of fit S are based on F², conventional
R-factors R are based on F, with F set to zero for
negative F². The threshold expression of F² >
σ(F²) is used only for calculating R-factors(gt) etc.
and is not relevant to the choice of reflections for refinement.
R-factors based on F² are statistically about twice as large
as those based on F, and R-factors based on ALL data will be
even larger.
;
_reflns_number_total     10477
_reflns_number_gt     8258
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0686
_refine_ls_R_factor_gt     0.0477
_refine_ls_wR_factor_gt     0.0944
_refine_ls_wR_factor_ref     0.1027
_refine_ls_goodness_of_fit_ref     0.999
_refine_ls_restrained_S_all     1.005
_refine_ls_number_reflns     10477
_refine_ls_number_parameters     668
_refine_ls_number_restraints     111
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
       'calc w = 1/[σ²(Fo²)+(0.0495P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.002
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.559
_refine_diff_density_min     -0.335
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
_refine_ls_abs_structure_details
                             'Flack (1983), with how many Friedel pairs?'
_refine_ls_abs_structure_Flack     0.00(2)
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'
    'Cd' 'Cd' -0.8075 1.2024
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'Cl' 'Cl' 0.1484 0.1585
                         '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'
_computing_data_collection     'CrystalClear (Rigaku, 2005)'
_computing_cell_refinement     'CrystalClear (Rigaku, 2005)'
_computing_data_reduction     'CrystalClear (Rigaku, 2005)'
_computing_structure_solution     'SHELXS97 (Sheldrick, 2008)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 2008)'
_computing_molecular_graphics
;
PLATON (Spek, 2009) and DIAMOND (Brandenburg & Putz, 2005)
;
_computing_publication_material     'SHELXTL (Sheldrick, 2008)'
loop_
    _atom_site_type_symbol
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_symmetry_multiplicity
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    Cd Cd1 0.523032(15) 0.616086(14) 0.93900(4) 0.04217(11) Uani d . 1 1 . .
    O O1 0.50675(15) 0.61697(14) 1.1405(3) 0.0494(10) Uani d . 1 1 . .
    O O2 0.56113(14) 0.55616(13) 1.0376(3) 0.0472(10) Uani d . 1 1 . .
    O O3 0.56552(14) 0.50741(13) 1.1839(4) 0.0492(9) Uani d . 1 1 . .
    O O4 0.53631(15) 0.64955(17) 0.7325(3) 0.0609(12) Uani d . 1 1 . .
    N N1 0.48034(16) 0.68182(16) 0.9920(4) 0.0403(11) Uani d . 1 1 . .
    N N2 0.59576(17) 0.64940(16) 0.9094(4) 0.0437(11) Uani d . 1 1 . .
    N N3 0.5496(5) 0.5753(5) 0.5093(8) 0.164(5) Uani d . 1 1 . .
    C C1 0.4699(2) 0.7164(2) 0.9196(6) 0.0535(15) Uani d . 1 1 . .
    H H1 0.4825 0.7145 0.8466 0.064 Uiso calc R 1 1 . .
    C C2 0.4410(2) 0.7557(2) 0.9465(7) 0.0570(16) Uani d . 1 1 . .
    H H2 0.4347 0.7794 0.8928 0.068 Uiso calc R 1 1 . .
    C C3 0.4225(2) 0.7587(2) 1.0502(7) 0.0591(17) Uani d . 1 1 . .
    H H3 0.4025 0.7843 1.0684 0.071 Uiso calc R 1 1 . .
    C C4 0.4327(2) 0.7240(2) 1.1326(6) 0.0476(15) Uani d . 1 1 . .
    C C5 0.46257(18) 0.68543(19) 1.1002(4) 0.0350(12) Uani d . 1 1 . .
    C C6 0.47488(18) 0.64998(18) 1.1788(5) 0.0385(12) Uani d . 1 1 . .
    C C7 0.4551(2) 0.6511(2) 1.2859(5) 0.0496(15) Uani d . 1 1 . .
    H H7 0.4621 0.6266 1.3369 0.059 Uiso calc R 1 1 . .
    C C8 0.4249(2) 0.6885(2) 1.3194(6) 0.0629(18) Uani d . 1 1 . .
    H H8 0.4120 0.6890 1.3922 0.076 Uiso calc R 1 1 . .
    C C9 0.4145(2) 0.7237(2) 1.2450(6) 0.0568(17) Uani d . 1 1 . .
    H H9 0.3947 0.7488 1.2682 0.068 Uiso calc R 1 1 . .
    C C10 0.5181(2) 0.57645(19) 1.2070(5) 0.0425(13) Uani d . 1 1 . .
    H H10A 0.4890 0.5592 1.2271 0.051 Uiso calc R 1 1 . .
    H H10B 0.5340 0.5863 1.2765 0.051 Uiso calc R 1 1 . .
    C C11 0.5506(2) 0.5449(2) 1.1381(5) 0.0433(13) Uani d . 1 1 . .
    C C12 0.6250(2) 0.6495(2) 0.9972(6) 0.0560(17) Uani d . 1 1 . .
    H H12 0.6147 0.6355 1.0647 0.067 Uiso calc R 1 1 . .
    C C13 0.6710(3) 0.6697(3) 0.9928(8) 0.072(2) Uani d . 1 1 . .
    H H13 0.6910 0.6687 1.0560 0.086 Uiso calc R 1 1 . .
    C C14 0.6858(3) 0.6906(3) 0.8973(8) 0.072(2) Uani d . 1 1 . .
    H H14 0.7160 0.7049 0.8944 0.087 Uiso calc R 1 1 . .
    C C15 0.6563(2) 0.6911(2) 0.8016(7) 0.0594(17) Uani d . 1 1 . .
    C C16 0.6109(2) 0.67023(18) 0.8110(5) 0.0462(14) Uani d . 1 1 . .
    C C17 0.5799(2) 0.6695(2) 0.7156(5) 0.0532(15) Uani d . 1 1 . .
    C C18 0.5959(3) 0.6881(3) 0.6152(6) 0.079(2) Uani d . 1 1 . .
    H H18 0.5764 0.6875 0.5510 0.095 Uiso calc R 1 1 . .
    C C19 0.6432(4) 0.7088(3) 0.6100(8) 0.095(3) Uani d . 1 1 . .
    H H19 0.6539 0.7216 0.5416 0.114 Uiso calc R 1 1 . .
    C C20 0.6720(3) 0.7102(3) 0.6988(8) 0.079(2) Uani d . 1 1 . .
    H H20 0.7024 0.7238 0.6929 0.095 Uiso calc R 1 1 . .
    C C21 0.5075(3) 0.6393(3) 0.6360(6) 0.082(2) Uani d . 1 1 . .
    H H21A 0.5029 0.6685 0.5922 0.099 Uiso calc R 1 1 . .
    H H21B 0.4761 0.6282 0.6607 0.099 Uiso calc R 1 1 . .
    C C22 0.5294(4) 0.6032(5) 0.5652(8) 0.112(4) Uani d . 1 1 . .
    Cd Cd2 0.612382(14) 0.961270(14) 0.19432(3) 0.04009(10) Uani d . 1 1 . .
    O O5 0.61361(14) 0.98048(13) 0.3937(3) 0.0434(10) Uani d . 1 1 . .
    O O6 0.54604(13) 0.93311(13) 0.2875(3) 0.0458(9) Uani d . 1 1 . .
    O O7 0.49790(13) 0.93213(14) 0.4358(4) 0.0496(9) Uani d . 1 1 . .
    O O8 0.64871(16) 0.93304(14) 0.0049(3) 0.0514(10) Uani d . 1 1 . .
    N N4 0.64092(15) 0.88495(15) 0.1991(4) 0.0423(10) Uani d . 1 1 . .
    N N5 0.67877(15) 1.00501(16) 0.2419(4) 0.0378(10) Uani d . 1 1 . .
    N N6 0.7314(3) 0.9896(3) -0.1571(7) 0.115(3) Uani d . 1 1 . .
    C C23 0.6376(2) 0.8614(2) 0.2966(6) 0.0556(15) Uani d . 1 1 . .
    H H23 0.6212 0.8760 0.3561 0.067 Uiso calc R 1 1 . .
    C C24 0.6571(2) 0.8165(2) 0.3154(7) 0.0660(18) Uani d . 1 1 . .
    H H24 0.6530 0.8011 0.3849 0.079 Uiso calc R 1 1 . .
    C C25 0.6818(2) 0.7954(2) 0.2318(7) 0.065(2) Uani d . 1 1 . .
    H H25 0.6958 0.7655 0.2435 0.078 Uiso calc R 1 1 . .
    C C26 0.6867(2) 0.8188(2) 0.1248(6) 0.0494(15) Uani d . 1 1 . .
    C C27 0.66579(19) 0.8643(2) 0.1130(5) 0.0423(13) Uani d . 1 1 . .
    C C28 0.6702(2) 0.8879(2) 0.0084(5) 0.0478(15) Uani d . 1 1 . .
    C C29 0.6945(3) 0.8682(2) -0.0798(6) 0.070(2) Uani d . 1 1 . .
    H H29 0.6973 0.8845 -0.1483 0.084 Uiso calc R 1 1 . .
    C C30 0.7155(3) 0.8223(3) -0.0660(9) 0.083(2) Uani d . 1 1 . .
    H H30 0.7321 0.8081 -0.1258 0.100 Uiso calc R 1 1 . .
    C C31 0.7113(3) 0.7989(2) 0.0353(7) 0.070(2) Uani d . 1 1 . .
    H H31 0.7255 0.7688 0.0440 0.084 Uiso calc R 1 1 . .
    C C32 0.6457(3) 0.9567(2) -0.1010(6) 0.0632(18) Uani d . 1 1 . .
    H H32A 0.6227 0.9828 -0.0963 0.076 Uiso calc R 1 1 . .
    H H32B 0.6348 0.9343 -0.1586 0.076 Uiso calc R 1 1 . .
    C C33 0.6951(3) 0.9765(3) -0.1339(7) 0.076(2) Uani d . 1 1 . .
    C C34 0.7131(2) 1.0162(2) 0.1669(5) 0.0513(15) Uani d . 1 1 . .
    H H34 0.7109 1.0034 0.0942 0.062 Uiso calc R 1 1 . .
    C C35 0.7509(2) 1.0453(2) 0.1910(6) 0.0537(15) Uani d . 1 1 . .
    H H35 0.7741 1.0515 0.1361 0.064 Uiso calc R 1 1 . .
    C C36 0.75459(19) 1.0654(2) 0.2963(6) 0.0513(15) Uani d . 1 1 . .
    H H36 0.7803 1.0855 0.3130 0.062 Uiso calc R 1 1 . .
    C C37 0.71982(18) 1.05583(19) 0.3795(5) 0.0390(13) Uani d . 1 1 . .
    C C38 0.68234(18) 1.02470(18) 0.3473(5) 0.0368(12) Uani d . 1 1 . .
    C C39 0.64666(18) 1.01325(18) 0.4313(5) 0.0401(12) Uani d . 1 1 . .
    C C40 0.6480(2) 1.0331(2) 0.5347(5) 0.0489(14) Uani d . 1 1 . .
    H H40 0.6243 1.0259 0.5878 0.059 Uiso calc R 1 1 . .
    C C41 0.6855(2) 1.0648(2) 0.5624(6) 0.0549(15) Uani d . 1 1 . .
    H H41 0.6861 1.0786 0.6343 0.066 Uiso calc R 1 1 . .
    C C42 0.7205(2) 1.0759(2) 0.4884(6) 0.0541(16) Uani d . 1 1 . .
    H H42 0.7450 1.0968 0.5093 0.065 Uiso calc R 1 1 . .
    C C43 0.57017(18) 0.9741(2) 0.4575(5) 0.0420(13) Uani d . 1 1 . .
    H H43A 0.5558 1.0051 0.4741 0.050 Uiso calc R 1 1 . .
    H H43B 0.5770 0.9580 0.5287 0.050 Uiso calc R 1 1 . .
    C C44 0.53637(19) 0.94426(19) 0.3874(5) 0.0401(13) Uani d . 1 1 . .
    Cl Cl1 0.60467(7) 0.86489(7) 0.62933(16) 0.0695(5) Uani d . 1 1 . .
    O O9 0.6258(3) 0.8249(2) 0.6794(7) 0.133(3) Uani d . 1 1 . .
    O O10 0.5717(3) 0.8859(2) 0.7072(6) 0.120(2) Uani d . 1 1 . .
    O O11 0.6394(2) 0.8977(3) 0.6031(8) 0.149(3) Uani d . 1 1 . .
    O O12 0.5784(2) 0.8534(3) 0.5320(5) 0.117(2) Uani d . 1 1 . .
    Cl Cl2 0.84046(8) 0.86683(7) 0.81348(17) 0.0806(5) Uani d D 1 1 . .
    O O13 0.8297(3) 0.8870(2) 0.9199(5) 0.122(2) Uani d D 1 1 A .
    O O14 0.8882(4) 0.8483(7) 0.8260(17) 0.135(6) Uani d PDU 0.435(12) 1 A 1
    O O15 0.8161(8) 0.8266(7) 0.7711(18) 0.136(7) Uani d PDU 0.435(12) 1 A 1
    O O16 0.8503(8) 0.9054(6) 0.7378(17) 0.106(6) Uani d PDU 0.435(12) 1 A 1
    O O14B 0.8430(6) 0.8164(3) 0.8210(15) 0.125(5) Uani d PDU 0.565(12) 1 A 2
    O O15B 0.7955(3) 0.8758(5) 0.7556(10) 0.123(5) Uani d PDU 0.565(12) 1 A 2
    O O16B 0.8747(6) 0.8910(6) 0.7473(13) 0.128(6) Uani d PDU 0.565(12) 1 A 2
    O O1W 0.7277(3) 0.8093(3) 0.6219(9) 0.172(4) Uani d . 1 1 . .
    H H1W 0.7002 0.8193 0.6299 0.258 Uiso d R 1 1 . .
    H H2W 0.7404 0.8353 0.6336 0.258 Uiso d R 1 1 . .
_geom_special_details
;
All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes)
are estimated using the full covariance matrix. The cell e.s.d.'s are taken
into account individually in the estimation of e.s.d.'s in distances, angles
and torsion angles; correlations between e.s.d.'s in cell parameters are only
used when they are defined by crystal symmetry. An approximate (isotropic)
treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s.
planes.
;
loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Cd1 O3 4_657 2.190(4) ?
    Cd1 N2 . 2.254(5) ?
    Cd1 N1 . 2.270(4) ?
    Cd1 O2 . 2.293(4) ?
    Cd1 O1 . 2.416(4) ?
    Cd1 O4 . 2.631(4) ?
    O1 C6 . 1.355(6) ?
    O1 C10 . 1.410(6) ?
    O2 C11 . 1.258(7) ?
    O3 C11 . 1.245(6) ?
    O3 Cd1 2_567 2.190(4) ?
    O4 C17 . 1.349(7) ?
    O4 C21 . 1.420(8) ?
    N1 C1 . 1.319(7) ?
    N1 C5 . 1.372(7) ?
    N2 C12 . 1.316(8) ?
    N2 C16 . 1.362(7) ?
    N3 C22 . 1.163(14) ?
    C1 C2 . 1.394(8) ?
    C1 H1 . 0.9300 ?
    C2 C3 . 1.328(10) ?
    C2 H2 . 0.9300 ?
    C3 C4 . 1.398(9) ?
    C3 H3 . 0.9300 ?
    C4 C5 . 1.410(8) ?
    C4 C9 . 1.417(9) ?
    C5 C6 . 1.395(7) ?
    C6 C7 . 1.377(8) ?
    C7 C8 . 1.395(8) ?
    C7 H7 . 0.9300 ?
    C8 C9 . 1.346(10) ?
    C8 H8 . 0.9300 ?
    C9 H9 . 0.9300 ?
    C10 C11 . 1.502(8) ?
    C10 H10A . 0.9700 ?
    C10 H10B . 0.9700 ?
    C12 C13 . 1.400(10) ?
    C12 H12 . 0.9300 ?
    C13 C14 . 1.331(10) ?
    C13 H13 . 0.9300 ?
    C14 C15 . 1.394(10) ?
    C14 H14 . 0.9300 ?
    C15 C20 . 1.394(11) ?
    C15 C16 . 1.396(8) ?
    C16 C17 . 1.416(8) ?
    C17 C18 . 1.366(9) ?
    C18 C19 . 1.440(11) ?
    C18 H18 . 0.9300 ?
    C19 C20 . 1.317(12) ?
    C19 H19 . 0.9300 ?
    C20 H20 . 0.9300 ?
    C21 C22 . 1.442(13) ?
    C21 H21A . 0.9700 ?
    C21 H21B . 0.9700 ?
    Cd2 O7 8_655 2.219(4) ?
    Cd2 N4 . 2.269(4) ?
    Cd2 N5 . 2.283(4) ?
    Cd2 O6 . 2.287(4) ?
    Cd2 O5 . 2.409(4) ?
    Cd2 O8 . 2.573(4) ?
    O5 C39 . 1.369(6) ?
    O5 C43 . 1.434(6) ?
    O6 C44 . 1.245(7) ?
    O7 C44 . 1.259(6) ?
    O7 Cd2 6_465 2.219(4) ?
    O8 C28 . 1.391(7) ?
    O8 C32 . 1.413(7) ?
    N4 C23 . 1.326(8) ?
    N4 C27 . 1.356(7) ?
    N5 C34 . 1.338(7) ?
    N5 C38 . 1.361(7) ?
    N6 C33 . 1.106(10) ?
    C23 C24 . 1.380(9) ?
    C23 H23 . 0.9300 ?
    C24 C25 . 1.338(10) ?
    C24 H24 . 0.9300 ?
    C25 C26 . 1.424(10) ?
    C25 H25 . 0.9300 ?
    C26 C31 . 1.374(10) ?
    C26 C27 . 1.402(8) ?
    C27 C28 . 1.402(8) ?
    C28 C29 . 1.356(8) ?
    C29 C30 . 1.414(10) ?
    C29 H29 . 0.9300 ?
    C30 C31 . 1.365(12) ?
    C30 H30 . 0.9300 ?
    C31 H31 . 0.9300 ?
    C32 C33 . 1.531(11) ?
    C32 H32A . 0.9700 ?
    C32 H32B . 0.9700 ?
    C34 C35 . 1.357(8) ?
    C34 H34 . 0.9300 ?
    C35 C36 . 1.364(9) ?
    C35 H35 . 0.9300 ?
    C36 C37 . 1.403(8) ?
    C36 H36 . 0.9300 ?
    C37 C42 . 1.399(8) ?
    C37 C38 . 1.408(7) ?
    C38 C39 . 1.438(8) ?
    C39 C40 . 1.338(8) ?
    C40 C41 . 1.407(8) ?
    C40 H40 . 0.9300 ?
    C41 C42 . 1.343(9) ?
    C41 H41 . 0.9300 ?
    C42 H42 . 0.9300 ?
    C43 C44 . 1.503(7) ?
    C43 H43A . 0.9700 ?
    C43 H43B . 0.9700 ?
    Cl1 O11 . 1.366(6) ?
    Cl1 O9 . 1.389(6) ?
    Cl1 O12 . 1.396(6) ?
    Cl1 O10 . 1.424(6) ?
    Cl2 O15 . 1.403(8) ?
    Cl2 O16B . 1.403(7) ?
    Cl2 O13 . 1.407(5) ?
    Cl2 O14B . 1.408(7) ?
    Cl2 O16 . 1.421(8) ?
    Cl2 O14 . 1.433(8) ?
    Cl2 O15B . 1.447(7) ?
    O1W H1W . 0.8201 ?
    O1W H2W . 0.8200 ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    O3 Cd1 N2 4_657 . 120.65(15) ?
    O3 Cd1 N1 4_657 . 119.83(15) ?
    N2 Cd1 N1 . . 100.44(15) ?
    O3 Cd1 O2 4_657 . 92.65(15) ?
    N2 Cd1 O2 . . 87.84(15) ?
    N1 Cd1 O2 . . 133.59(15) ?
    O3 Cd1 O1 4_657 . 125.68(14) ?
    N2 Cd1 O1 . . 108.44(16) ?
    N1 Cd1 O1 . . 67.87(15) ?
    O2 Cd1 O1 . . 66.20(13) ?
    O3 Cd1 O4 4_657 . 70.78(14) ?
    N2 Cd1 O4 . . 65.48(15) ?
    N1 Cd1 O4 . . 92.43(16) ?
    O2 Cd1 O4 . . 131.39(15) ?
    O1 Cd1 O4 . . 158.57(14) ?
    C6 O1 C10 . . 120.3(4) ?
    C6 O1 Cd1 . . 117.2(3) ?
    C10 O1 Cd1 . . 119.8(3) ?
    C11 O2 Cd1 . . 123.4(4) ?
    C11 O3 Cd1 . 2_567 104.6(4) ?
    C17 O4 C21 . . 118.2(5) ?
    C17 O4 Cd1 . . 114.1(3) ?
    C21 O4 Cd1 . . 126.1(4) ?
    C1 N1 C5 . . 117.9(5) ?
    C1 N1 Cd1 . . 121.8(4) ?
    C5 N1 Cd1 . . 120.2(4) ?
    C12 N2 C16 . . 118.5(5) ?
    C12 N2 Cd1 . . 115.7(4) ?
    C16 N2 Cd1 . . 125.7(4) ?
    N1 C1 C2 . . 123.6(6) ?
    N1 C1 H1 . . 118.2 ?
    C2 C1 H1 . . 118.2 ?
    C3 C2 C1 . . 118.8(6) ?
    C3 C2 H2 . . 120.6 ?
    C1 C2 H2 . . 120.6 ?
    C2 C3 C4 . . 121.1(6) ?
    C2 C3 H3 . . 119.4 ?
    C4 C3 H3 . . 119.4 ?
    C3 C4 C5 . . 117.2(6) ?
    C3 C4 C9 . . 125.4(6) ?
    C5 C4 C9 . . 117.3(6) ?
    N1 C5 C6 . . 118.4(5) ?
    N1 C5 C4 . . 121.3(5) ?
    C6 C5 C4 . . 120.2(5) ?
    O1 C6 C7 . . 125.6(5) ?
    O1 C6 C5 . . 114.8(5) ?
    C7 C6 C5 . . 119.5(5) ?
    C6 C7 C8 . . 121.2(6) ?
    C6 C7 H7 . . 119.4 ?
    C8 C7 H7 . . 119.4 ?
    C9 C8 C7 . . 119.2(6) ?
    C9 C8 H8 . . 120.4 ?
    C7 C8 H8 . . 120.4 ?
    C8 C9 C4 . . 122.4(6) ?
    C8 C9 H9 . . 118.8 ?
    C4 C9 H9 . . 118.8 ?
    O1 C10 C11 . . 107.6(5) ?
    O1 C10 H10A . . 110.2 ?
    C11 C10 H10A . . 110.2 ?
    O1 C10 H10B . . 110.2 ?
    C11 C10 H10B . . 110.2 ?
    H10A C10 H10B . . 108.5 ?
    O3 C11 O2 . . 122.7(5) ?
    O3 C11 C10 . . 117.2(5) ?
    O2 C11 C10 . . 120.2(5) ?
    N2 C12 C13 . . 122.5(7) ?
    N2 C12 H12 . . 118.8 ?
    C13 C12 H12 . . 118.8 ?
    C14 C13 C12 . . 119.3(7) ?
    C14 C13 H13 . . 120.3 ?
    C12 C13 H13 . . 120.3 ?
    C13 C14 C15 . . 120.3(7) ?
    C13 C14 H14 . . 119.8 ?
    C15 C14 H14 . . 119.8 ?
    C20 C15 C14 . . 121.4(7) ?
    C20 C15 C16 . . 120.8(7) ?
    C14 C15 C16 . . 117.8(7) ?
    N2 C16 C15 . . 121.6(6) ?
    N2 C16 C17 . . 118.8(5) ?
    C15 C16 C17 . . 119.6(6) ?
    O4 C17 C18 . . 125.2(6) ?
    O4 C17 C16 . . 115.9(5) ?
    C18 C17 C16 . . 118.9(6) ?
    C17 C18 C19 . . 119.1(8) ?
    C17 C18 H18 . . 120.4 ?
    C19 C18 H18 . . 120.4 ?
    C20 C19 C18 . . 122.4(8) ?
    C20 C19 H19 . . 118.8 ?
    C18 C19 H19 . . 118.8 ?
    C19 C20 C15 . . 119.2(7) ?
    C19 C20 H20 . . 120.4 ?
    C15 C20 H20 . . 120.4 ?
    O4 C21 C22 . . 111.3(7) ?
    O4 C21 H21A . . 109.4 ?
    C22 C21 H21A . . 109.4 ?
    O4 C21 H21B . . 109.4 ?
    C22 C21 H21B . . 109.4 ?
    H21A C21 H21B . . 108.0 ?
    N3 C22 C21 . . 176.0(13) ?
    O7 Cd2 N4 8_655 . 130.02(16) ?
    O7 Cd2 N5 8_655 . 112.12(15) ?
    N4 Cd2 N5 . . 102.11(15) ?
    O7 Cd2 O6 8_655 . 92.18(14) ?
    N4 Cd2 O6 . . 87.13(15) ?
    N5 Cd2 O6 . . 135.95(14) ?
    O7 Cd2 O5 8_655 . 125.40(14) ?
    N4 Cd2 O5 . . 100.29(15) ?
    N5 Cd2 O5 . . 68.34(14) ?
    O6 Cd2 O5 . . 67.63(13) ?
    O7 Cd2 O8 8_655 . 76.17(14) ?
    N4 Cd2 O8 . . 66.29(15) ?
    N5 Cd2 O8 . . 93.30(15) ?
    O6 Cd2 O8 . . 128.98(13) ?
    O5 Cd2 O8 . . 155.20(14) ?
    C39 O5 C43 . . 118.7(4) ?
    C39 O5 Cd2 . . 118.2(3) ?
    C43 O5 Cd2 . . 118.1(3) ?
    C44 O6 Cd2 . . 122.8(3) ?
    C44 O7 Cd2 . 6_465 103.2(4) ?
    C28 O8 C32 . . 118.1(5) ?
    C28 O8 Cd2 . . 114.8(3) ?
    C32 O8 Cd2 . . 126.9(3) ?
    C23 N4 C27 . . 118.3(5) ?
    C23 N4 Cd2 . . 117.4(4) ?
    C27 N4 Cd2 . . 123.9(4) ?
    C34 N5 C38 . . 117.1(5) ?
    C34 N5 Cd2 . . 122.7(4) ?
    C38 N5 Cd2 . . 119.9(3) ?
    N4 C23 C24 . . 124.1(7) ?
    N4 C23 H23 . . 118.0 ?
    C24 C23 H23 . . 118.0 ?
    C25 C24 C23 . . 118.7(7) ?
    C25 C24 H24 . . 120.6 ?
    C23 C24 H24 . . 120.6 ?
    C24 C25 C26 . . 120.0(6) ?
    C24 C25 H25 . . 120.0 ?
    C26 C25 H25 . . 120.0 ?
    C31 C26 C27 . . 119.7(7) ?
    C31 C26 C25 . . 122.9(6) ?
    C27 C26 C25 . . 117.5(6) ?
    N4 C27 C28 . . 120.2(5) ?
    N4 C27 C26 . . 121.4(6) ?
    C28 C27 C26 . . 118.4(6) ?
    C29 C28 O8 . . 123.9(6) ?
    C29 C28 C27 . . 121.7(6) ?
    O8 C28 C27 . . 114.3(5) ?
    C28 C29 C30 . . 119.0(7) ?
    C28 C29 H29 . . 120.5 ?
    C30 C29 H29 . . 120.5 ?
    C31 C30 C29 . . 119.8(7) ?
    C31 C30 H30 . . 120.1 ?
    C29 C30 H30 . . 120.1 ?
    C30 C31 C26 . . 121.4(7) ?
    C30 C31 H31 . . 119.3 ?
    C26 C31 H31 . . 119.3 ?
    O8 C32 C33 . . 109.8(6) ?
    O8 C32 H32A . . 109.7 ?
    C33 C32 H32A . . 109.7 ?
    O8 C32 H32B . . 109.7 ?
    C33 C32 H32B . . 109.7 ?
    H32A C32 H32B . . 108.2 ?
    N6 C33 C32 . . 178.0(9) ?
    N5 C34 C35 . . 123.7(6) ?
    N5 C34 H34 . . 118.1 ?
    C35 C34 H34 . . 118.1 ?
    C34 C35 C36 . . 119.5(6) ?
    C34 C35 H35 . . 120.2 ?
    C36 C35 H35 . . 120.2 ?
    C35 C36 C37 . . 120.4(5) ?
    C35 C36 H36 . . 119.8 ?
    C37 C36 H36 . . 119.8 ?
    C42 C37 C36 . . 123.8(6) ?
    C42 C37 C38 . . 120.2(5) ?
    C36 C37 C38 . . 116.1(5) ?
    N5 C38 C37 . . 123.2(5) ?
    N5 C38 C39 . . 119.2(5) ?
    C37 C38 C39 . . 117.6(5) ?
    C40 C39 O5 . . 126.0(5) ?
    C40 C39 C38 . . 121.1(5) ?
    O5 C39 C38 . . 112.9(5) ?
    C39 C40 C41 . . 119.4(6) ?
    C39 C40 H40 . . 120.3 ?
    C41 C40 H40 . . 120.3 ?
    C42 C41 C40 . . 122.2(6) ?
    C42 C41 H41 . . 118.9 ?
    C40 C41 H41 . . 118.9 ?
    C41 C42 C37 . . 119.6(6) ?
    C41 C42 H42 . . 120.2 ?
    C37 C42 H42 . . 120.2 ?
    O5 C43 C44 . . 108.0(4) ?
    O5 C43 H43A . . 110.1 ?
    C44 C43 H43A . . 110.1 ?
    O5 C43 H43B . . 110.1 ?
    C44 C43 H43B . . 110.1 ?
    H43A C43 H43B . . 108.4 ?
    O6 C44 O7 . . 123.0(5) ?
    O6 C44 C43 . . 121.4(5) ?
    O7 C44 C43 . . 115.6(5) ?
    O11 Cl1 O9 . . 109.4(5) ?
    O11 Cl1 O12 . . 109.8(5) ?
    O9 Cl1 O12 . . 112.7(5) ?
    O11 Cl1 O10 . . 109.2(5) ?
    O9 Cl1 O10 . . 109.2(4) ?
    O12 Cl1 O10 . . 106.5(4) ?
    O15 Cl2 O16B . . 121.0(11) ?
    O15 Cl2 O13 . . 122.3(9) ?
    O16B Cl2 O13 . . 116.6(7) ?
    O15 Cl2 O14B . . 41.4(10) ?
    O16B Cl2 O14B . . 118.6(10) ?
    O13 Cl2 O14B . . 110.7(8) ?
    O15 Cl2 O16 . . 118.3(15) ?
    O16B Cl2 O16 . . 32.7(9) ?
    O13 Cl2 O16 . . 107.3(10) ?
    O14B Cl2 O16 . . 141.4(11) ?
    O15 Cl2 O14 . . 101.3(13) ?
    O16B Cl2 O14 . . 66.5(10) ?
    O13 Cl2 O14 . . 104.5(8) ?
    O14B Cl2 O14 . . 65.6(9) ?
    O16 Cl2 O14 . . 99.1(11) ?
    O15 Cl2 O15B . . 63.3(12) ?
    O16B Cl2 O15B . . 104.1(10) ?
    O13 Cl2 O15B . . 99.6(6) ?
    O14B Cl2 O15B . . 104.2(9) ?
    O16 Cl2 O15B . . 75.0(11) ?
    O14 Cl2 O15B . . 155.8(9) ?
    H1W O1W H2W . . 94.8 ?
loop_
    _geom_torsion_atom_site_label_1
    _geom_torsion_atom_site_label_2
    _geom_torsion_atom_site_label_3
    _geom_torsion_atom_site_label_4
    _geom_torsion_site_symmetry_1
    _geom_torsion_site_symmetry_2
    _geom_torsion_site_symmetry_3
    _geom_torsion_site_symmetry_4
    _geom_torsion
    _geom_torsion_publ_flag
    O3 Cd1 O1 C6 4_657 . . . -100.9(4) ?
    N2 Cd1 O1 C6 . . . . 104.9(4) ?
    N1 Cd1 O1 C6 . . . . 10.8(3) ?
    O2 Cd1 O1 C6 . . . . -176.1(4) ?
    O4 Cd1 O1 C6 . . . . 35.2(6) ?
    O3 Cd1 O1 C10 4_657 . . . 60.3(4) ?
    N2 Cd1 O1 C10 . . . . -94.0(4) ?
    N1 Cd1 O1 C10 . . . . 171.9(4) ?
    O2 Cd1 O1 C10 . . . . -15.0(4) ?
    O4 Cd1 O1 C10 . . . . -163.7(4) ?
    O3 Cd1 O2 C11 4_657 . . . -114.5(4) ?
    N2 Cd1 O2 C11 . . . . 124.9(4) ?
    N1 Cd1 O2 C11 . . . . 22.5(5) ?
    O1 Cd1 O2 C11 . . . . 13.7(4) ?
    O4 Cd1 O2 C11 . . . . 179.0(4) ?
    O3 Cd1 O4 C17 4_657 . . . -138.9(4) ?
    N2 Cd1 O4 C17 . . . . -0.1(4) ?
    N1 Cd1 O4 C17 . . . . 100.2(4) ?
    O2 Cd1 O4 C17 . . . . -62.9(5) ?
    O1 Cd1 O4 C17 . . . . 77.7(6) ?
    O3 Cd1 O4 C21 4_657 . . . 26.5(6) ?
    N2 Cd1 O4 C21 . . . . 165.3(6) ?
    N1 Cd1 O4 C21 . . . . -94.3(6) ?
    O2 Cd1 O4 C21 . . . . 102.5(6) ?
    O1 Cd1 O4 C21 . . . . -116.8(6) ?
    O3 Cd1 N1 C1 4_657 . . . -65.6(5) ?
    N2 Cd1 N1 C1 . . . . 69.1(5) ?
    O2 Cd1 N1 C1 . . . . 166.2(4) ?
    O1 Cd1 N1 C1 . . . . 174.9(5) ?
    O4 Cd1 N1 C1 . . . . 3.6(5) ?
    O3 Cd1 N1 C5 4_657 . . . 111.2(4) ?
    N2 Cd1 N1 C5 . . . . -114.1(4) ?
    O2 Cd1 N1 C5 . . . . -17.0(5) ?
    O1 Cd1 N1 C5 . . . . -8.3(4) ?
    O4 Cd1 N1 C5 . . . . -179.6(4) ?
    O3 Cd1 N2 C12 4_657 . . . -134.0(4) ?
    N1 Cd1 N2 C12 . . . . 91.8(4) ?
    O2 Cd1 N2 C12 . . . . -42.2(4) ?
    O1 Cd1 N2 C12 . . . . 21.8(4) ?
    O4 Cd1 N2 C12 . . . . 179.7(5) ?
    O3 Cd1 N2 C16 4_657 . . . 48.1(5) ?
    N1 Cd1 N2 C16 . . . . -86.1(4) ?
    O2 Cd1 N2 C16 . . . . 139.9(4) ?
    O1 Cd1 N2 C16 . . . . -156.1(4) ?
    O4 Cd1 N2 C16 . . . . 1.8(4) ?
    C5 N1 C1 C2 . . . . -1.5(9) ?
    Cd1 N1 C1 C2 . . . . 175.3(5) ?
    N1 C1 C2 C3 . . . . -0.4(10) ?
    C1 C2 C3 C4 . . . . 1.7(10) ?
    C2 C3 C4 C5 . . . . -1.0(9) ?
    C2 C3 C4 C9 . . . . -179.4(6) ?
    C1 N1 C5 C6 . . . . -177.6(5) ?
    Cd1 N1 C5 C6 . . . . 5.5(6) ?
    C1 N1 C5 C4 . . . . 2.2(8) ?
    Cd1 N1 C5 C4 . . . . -174.8(4) ?
    C3 C4 C5 N1 . . . . -0.9(8) ?
    C9 C4 C5 N1 . . . . 177.6(5) ?
    C3 C4 C5 C6 . . . . 178.8(5) ?
    C9 C4 C5 C6 . . . . -2.6(8) ?
    C10 O1 C6 C7 . . . . 7.8(8) ?
    Cd1 O1 C6 C7 . . . . 168.8(4) ?
    C10 O1 C6 C5 . . . . -173.1(5) ?
    Cd1 O1 C6 C5 . . . . -12.0(6) ?
    N1 C5 C6 O1 . . . . 4.8(7) ?
    C4 C5 C6 O1 . . . . -175.0(5) ?
    N1 C5 C6 C7 . . . . -176.0(5) ?
    C4 C5 C6 C7 . . . . 4.2(8) ?
    O1 C6 C7 C8 . . . . 175.9(5) ?
    C5 C6 C7 C8 . . . . -3.2(8) ?
    C6 C7 C8 C9 . . . . 0.6(10) ?
    C7 C8 C9 C4 . . . . 1.0(10) ?
    C3 C4 C9 C8 . . . . 178.4(6) ?
    C5 C4 C9 C8 . . . . 0.0(9) ?
    C6 O1 C10 C11 . . . . 175.1(5) ?
    Cd1 O1 C10 C11 . . . . 14.6(6) ?
    Cd1 O3 C11 O2 2_567 . . . 6.6(6) ?
    Cd1 O3 C11 C10 2_567 . . . -174.8(4) ?
    Cd1 O2 C11 O3 . . . . 167.4(4) ?
    Cd1 O2 C11 C10 . . . . -11.3(7) ?
    O1 C10 C11 O3 . . . . 178.5(5) ?
    O1 C10 C11 O2 . . . . -2.8(7) ?
    C16 N2 C12 C13 . . . . -0.5(9) ?
    Cd1 N2 C12 C13 . . . . -178.6(5) ?
    N2 C12 C13 C14 . . . . 1.2(11) ?
    C12 C13 C14 C15 . . . . -1.7(11) ?
    C13 C14 C15 C20 . . . . -176.3(7) ?
    C13 C14 C15 C16 . . . . 1.7(10) ?
    C12 N2 C16 C15 . . . . 0.5(8) ?
    Cd1 N2 C16 C15 . . . . 178.4(4) ?
    C12 N2 C16 C17 . . . . 178.9(5) ?
    Cd1 N2 C16 C17 . . . . -3.2(7) ?
    C20 C15 C16 N2 . . . . 177.0(6) ?
    C14 C15 C16 N2 . . . . -1.0(9) ?
    C20 C15 C16 C17 . . . . -1.4(9) ?
    C14 C15 C16 C17 . . . . -179.4(6) ?
    C21 O4 C17 C18 . . . . 11.5(10) ?
    Cd1 O4 C17 C18 . . . . 178.1(6) ?
    C21 O4 C17 C16 . . . . -168.0(6) ?
    Cd1 O4 C17 C16 . . . . -1.3(7) ?
    N2 C16 C17 O4 . . . . 2.8(8) ?
    C15 C16 C17 O4 . . . . -178.8(5) ?
    N2 C16 C17 C18 . . . . -176.7(6) ?
    C15 C16 C17 C18 . . . . 1.8(9) ?
    O4 C17 C18 C19 . . . . 179.4(7) ?
    C16 C17 C18 C19 . . . . -1.2(11) ?
    C17 C18 C19 C20 . . . . 0.4(13) ?
    C18 C19 C20 C15 . . . . 0.0(14) ?
    C14 C15 C20 C19 . . . . 178.4(8) ?
    C16 C15 C20 C19 . . . . 0.5(12) ?
    C17 O4 C21 C22 . . . . 64.7(9) ?
    Cd1 O4 C21 C22 . . . . -100.2(7) ?
    O4 C21 C22 N3 . . . . -40(19) ?
    O7 Cd2 O5 C39 8_655 . . . -91.5(4) ?
    N4 Cd2 O5 C39 . . . . 110.0(4) ?
    N5 Cd2 O5 C39 . . . . 10.9(3) ?
    O6 Cd2 O5 C39 . . . . -167.5(4) ?
    O8 Cd2 O5 C39 . . . . 55.5(5) ?
    O7 Cd2 O5 C43 8_655 . . . 63.1(4) ?
    N4 Cd2 O5 C43 . . . . -95.4(4) ?
    N5 Cd2 O5 C43 . . . . 165.5(4) ?
    O6 Cd2 O5 C43 . . . . -12.9(3) ?
    O8 Cd2 O5 C43 . . . . -149.9(3) ?
    O7 Cd2 O6 C44 8_655 . . . -118.2(4) ?
    N4 Cd2 O6 C44 . . . . 111.9(4) ?
    N5 Cd2 O6 C44 . . . . 7.4(5) ?
    O5 Cd2 O6 C44 . . . . 9.5(4) ?
    O8 Cd2 O6 C44 . . . . 167.9(4) ?
    O7 Cd2 O8 C28 8_655 . . . -151.5(4) ?
    N4 Cd2 O8 C28 . . . . -5.3(4) ?
    N5 Cd2 O8 C28 . . . . 96.5(4) ?
    O6 Cd2 O8 C28 . . . . -70.1(4) ?
    O5 Cd2 O8 C28 . . . . 55.7(5) ?
    O7 Cd2 O8 C32 8_655 . . . 23.3(5) ?
    N4 Cd2 O8 C32 . . . . 169.6(5) ?
    N5 Cd2 O8 C32 . . . . -88.6(5) ?
    O6 Cd2 O8 C32 . . . . 104.8(5) ?
    O5 Cd2 O8 C32 . . . . -129.5(5) ?
    O7 Cd2 N4 C23 8_655 . . . -136.2(4) ?
    N5 Cd2 N4 C23 . . . . 90.7(4) ?
    O6 Cd2 N4 C23 . . . . -45.8(4) ?
    O5 Cd2 N4 C23 . . . . 20.9(4) ?
    O8 Cd2 N4 C23 . . . . 179.0(4) ?
    O7 Cd2 N4 C27 8_655 . . . 51.6(5) ?
    N5 Cd2 N4 C27 . . . . -81.5(4) ?
    O6 Cd2 N4 C27 . . . . 142.1(4) ?
    O5 Cd2 N4 C27 . . . . -151.3(4) ?
    O8 Cd2 N4 C27 . . . . 6.8(4) ?
    O7 Cd2 N5 C34 8_655 . . . -61.8(5) ?
    N4 Cd2 N5 C34 . . . . 81.0(5) ?
    O6 Cd2 N5 C34 . . . . 179.5(4) ?
    O5 Cd2 N5 C34 . . . . 177.4(5) ?
    O8 Cd2 N5 C34 . . . . 14.6(5) ?
    O7 Cd2 N5 C38 8_655 . . . 111.8(4) ?
    N4 Cd2 N5 C38 . . . . -105.3(4) ?
    O6 Cd2 N5 C38 . . . . -6.8(5) ?
    O5 Cd2 N5 C38 . . . . -8.9(4) ?
    O8 Cd2 N5 C38 . . . . -171.8(4) ?
    C27 N4 C23 C24 . . . . -1.6(9) ?
    Cd2 N4 C23 C24 . . . . -174.2(5) ?
    N4 C23 C24 C25 . . . . 1.7(10) ?
    C23 C24 C25 C26 . . . . -1.6(10) ?
    C24 C25 C26 C31 . . . . -179.5(6) ?
    C24 C25 C26 C27 . . . . 1.5(9) ?
    C23 N4 C27 C28 . . . . 180.0(5) ?
    Cd2 N4 C27 C28 . . . . -7.9(7) ?
    C23 N4 C27 C26 . . . . 1.4(8) ?
    Cd2 N4 C27 C26 . . . . 173.5(4) ?
    C31 C26 C27 N4 . . . . 179.5(6) ?
    C25 C26 C27 N4 . . . . -1.4(8) ?
    C31 C26 C27 C28 . . . . 1.0(9) ?
    C25 C26 C27 C28 . . . . -180.0(5) ?
    C32 O8 C28 C29 . . . . 9.9(9) ?
    Cd2 O8 C28 C29 . . . . -174.8(5) ?
    C32 O8 C28 C27 . . . . -171.7(5) ?
    Cd2 O8 C28 C27 . . . . 3.6(6) ?
    N4 C27 C28 C29 . . . . -179.5(6) ?
    C26 C27 C28 C29 . . . . -1.0(9) ?
    N4 C27 C28 O8 . . . . 2.0(8) ?
    C26 C27 C28 O8 . . . . -179.4(5) ?
    O8 C28 C29 C30 . . . . 179.0(6) ?
    C27 C28 C29 C30 . . . . 0.7(10) ?
    C28 C29 C30 C31 . . . . -0.4(12) ?
    C29 C30 C31 C26 . . . . 0.5(12) ?
    C27 C26 C31 C30 . . . . -0.8(10) ?
    C25 C26 C31 C30 . . . . -179.8(7) ?
    C28 O8 C32 C33 . . . . -75.2(7) ?
    Cd2 O8 C32 C33 . . . . 110.1(5) ?
    O8 C32 C33 N6 . . . .  5E1(3)
                                 ?
    C38 N5 C34 C35 . . . . 0.8(9) ?
    Cd2 N5 C34 C35 . . . . 174.6(5) ?
    N5 C34 C35 C36 . . . . -1.1(10) ?
    C34 C35 C36 C37 . . . . 0.4(9) ?
    C35 C36 C37 C42 . . . . -178.4(6) ?
    C35 C36 C37 C38 . . . . 0.6(8) ?
    C34 N5 C38 C37 . . . . 0.2(8) ?
    Cd2 N5 C38 C37 . . . . -173.8(4) ?
    C34 N5 C38 C39 . . . . -179.2(5) ?
    Cd2 N5 C38 C39 . . . . 6.8(6) ?
    C42 C37 C38 N5 . . . . 178.1(5) ?
    C36 C37 C38 N5 . . . . -0.9(8) ?
    C42 C37 C38 C39 . . . . -2.4(8) ?
    C36 C37 C38 C39 . . . . 178.6(5) ?
    C43 O5 C39 C40 . . . . 15.4(8) ?
    Cd2 O5 C39 C40 . . . . 169.8(5) ?
    C43 O5 C39 C38 . . . . -165.7(4) ?
    Cd2 O5 C39 C38 . . . . -11.3(5) ?
    N5 C38 C39 C40 . . . . -177.7(5) ?
    C37 C38 C39 C40 . . . . 2.8(8) ?
    N5 C38 C39 O5 . . . . 3.3(7) ?
    C37 C38 C39 O5 . . . . -176.2(4) ?
    O5 C39 C40 C41 . . . . 177.4(5) ?
    C38 C39 C40 C41 . . . . -1.4(9) ?
    C39 C40 C41 C42 . . . . -0.3(10) ?
    C40 C41 C42 C37 . . . . 0.6(10) ?
    C36 C37 C42 C41 . . . . 179.7(6) ?
    C38 C37 C42 C41 . . . . 0.8(9) ?
    C39 O5 C43 C44 . . . . 168.9(4) ?
    Cd2 O5 C43 C44 . . . . 14.4(5) ?
    Cd2 O6 C44 O7 . . . . 173.8(4) ?
    Cd2 O6 C44 C43 . . . . -5.2(7) ?
    Cd2 O7 C44 O6 6_465 . . . 2.8(6) ?
    Cd2 O7 C44 C43 6_465 . . . -178.2(4) ?
    O5 C43 C44 O6 . . . . -6.6(7) ?
    O5 C43 C44 O7 . . . . 174.4(4) ?
loop_
    _geom_hbond_atom_site_label_D
    _geom_hbond_atom_site_label_H
    _geom_hbond_atom_site_label_A
    _geom_hbond_site_symmetry_A
    _geom_hbond_distance_DH
    _geom_hbond_distance_HA
    _geom_hbond_distance_DA
    _geom_hbond_angle_DHA
    O1W H2W O15B . 0.82 2.38 3.078(15) 142.9
    O1W H2W O15 . 0.82 2.67 3.06(2) 111.3
    O1W H1W O9 . 0.82 2.16 2.948(10) 162.1
    C2 H2 O11 6_466 0.93 2.49 3.212(8) 135.2
    C8 H8 O13 6_467 0.93 2.38 3.285(9) 165.4
    C10 H10A O3 3_665 0.97 2.45 3.308(7) 147.3
    C12 H12 O16B 7_665 0.93 2.29 3.155(17) 153.7
    C13 H13 O1W 7_665 0.93 2.47 3.258(10) 142.4
    C21 H21B O3 4_657 0.97 2.57 2.982(8) 105.7
    C23 H23 O12 . 0.93 2.47 3.233(9) 139.1
    C32 H32A O7 8_655 0.97 2.47 3.131(8) 125.5
    C41 H41 O9 8_656 0.93 2.58 3.495(10) 169.8
    C43 H43A O7 3_675 0.97 2.34 3.236(7) 152.5
    C43 H43B O11 . 0.97 2.57 3.344(9) 136.8
data_global
_journal_date_recd_electronic     2012-11-02
_journal_date_accepted     2012-12-01
_journal_name_full     'Acta Crystallographica, Section C'
_journal_year     2013
_journal_volume     69
_journal_issue      1
_journal_page_first     17
_journal_page_last     20
_journal_paper_category     FM
_journal_paper_doi     10.1107/S0108270112049360
_journal_coeditor_code     WQ3022
_publ_contact_author_name     'Qiong Ye'
_publ_contact_author_address
;
Ordered Matter Science Research Center
Southeast University
Nanjing 211189
People's Republic of China
;
_publ_contact_author_email     jgsdxlml@163.com
_publ_contact_author_fax     ?
_publ_contact_author_phone     ?
_publ_section_title
;
A tetranuclear cadmium(II) complex based on the 2-(quinolin-8-yloxy)acetonitrile
ligand
;
loop_
    _publ_author_name
    _publ_author_address
    'Liu, Ming-Liang'
;
Ordered Matter Science Research Center
Southeast University
Nanjing 211189
People's Republic of China
;
    'Ye, Qiong'
;
Ordered Matter Science Research Center
Southeast University
Nanjing 211189
People's Republic of China
;
