#------------------------------------------------------------------------------
#$Date: 2016-03-25 23:37:57 +0200 (Fri, 25 Mar 2016) $
#$Revision: 180047 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/41/7034106.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_7034106
loop_
_publ_author_name
'Xiao, Hong-Ping'
'Zhou, Jian'
'Zhao, Rong-Qing'
'Zhang, Wei-Bing'
'Huang, Yong'
_publ_section_title
;
 A series of lanthanoid selenidoantimonates(v): rare examples of
 lanthanoid selenidoantimonates based on dinuclear lanthanide complexes.
;
_journal_issue                   13
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6032
_journal_page_last               6039
_journal_paper_doi               10.1039/c5dt00146c
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety
'C16 H48 Gd2 N10 O2 Sb2 Se8, C16 H48 Cl2 Gd2 N10 O2'
_chemical_formula_sum            'C32 H96 Cl2 Gd4 N20 O4 Sb2 Se8'
_chemical_formula_weight         2400.39
_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
_audit_update_record
;
2015-01-07 deposited with the CCDC.
2015-02-18 downloaded from the CCDC.
;
_cell_angle_alpha                95.2920(10)
_cell_angle_beta                 91.4440(10)
_cell_angle_gamma                90.1410(10)
_cell_formula_units_Z            2
_cell_length_a                   12.2255(7)
_cell_length_b                   16.0958(10)
_cell_length_c                   16.9124(10)
_cell_measurement_temperature    296(2)
_cell_volume                     3312.7(3)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       ω
_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  0.0368
_diffrn_reflns_av_sigmaI/netI    0.0332
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            45736
_diffrn_reflns_theta_full        25.10
_diffrn_reflns_theta_max         25.10
_diffrn_reflns_theta_min         1.27
_exptl_absorpt_coefficient_mu    9.275
_exptl_absorpt_correction_T_max  0.3300
_exptl_absorpt_correction_T_min  0.2448
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    2.408
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2248
_exptl_crystal_size_max          0.11
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.08
_refine_diff_density_max         2.902
_refine_diff_density_min         -1.387
_refine_diff_density_rms         0.180
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.040
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     649
_refine_ls_number_reflns         11704
_refine_ls_number_restraints     918
_refine_ls_restrained_S_all      1.056
_refine_ls_R_factor_all          0.0389
_refine_ls_R_factor_gt           0.0316
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0324P)²+27.4391P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0759
_refine_ls_wR_factor_ref         0.0798
_reflns_number_gt                10118
_reflns_number_total             11704
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5dt00146c2.cif
_cod_data_source_block           IIc
_cod_depositor_comments
'Adding full bibliography for 7034101--7034109.cif.'
_cod_database_code               7034106
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
Sb1 Sb 0.40220(4) 0.29597(3) 1.22364(3) 0.01501(10) Uani 1 1 d .
Sb2 Sb 0.92573(4) -0.31835(3) 0.28211(3) 0.01745(10) Uani 1 1 d .
Gd1 Gd 0.37668(3) 0.51401(2) 1.432785(18) 0.01214(8) Uani 1 1 d .
Gd2 Gd 0.91863(3) -0.550126(19) 0.076065(18) 0.01070(8) Uani 1 1 d .
Gd3 Gd 0.43559(3) 0.072129(19) 0.932460(18) 0.01134(8) Uani 1 1 d .
Gd4 Gd 0.86666(3) -0.03627(2) 0.53814(2) 0.01896(9) Uani 1 1 d .
Se1 Se 0.59488(6) 0.28634(5) 1.18356(5) 0.02332(16) Uani 1 1 d .
Se2 Se 0.30285(6) 0.16222(4) 1.19742(4) 0.02304(16) Uani 1 1 d .
Se3 Se 0.39542(6) 0.33056(4) 1.37022(4) 0.02131(16) Uani 1 1 d .
Se4 Se 0.30814(6) 0.40434(4) 1.15284(4) 0.01968(15) Uani 1 1 d .
Se5 Se 0.74621(7) -0.37636(5) 0.31422(4) 0.02900(18) Uani 1 1 d .
Se6 Se 0.89953(6) -0.19420(5) 0.20980(5) 0.02668(17) Uani 1 1 d .
Se7 Se 1.03957(7) -0.28366(5) 0.40397(4) 0.02461(17) Uani 1 1 d .
Se8 Se 1.03080(6) -0.42524(4) 0.19876(4) 0.01919(15) Uani 1 1 d .
Cl2 Cl 0.7456(2) 0.05316(13) 0.43869(14) 0.0542(7) Uani 1 1 d .
Cl1 Cl 0.63422(14) 0.13221(11) 0.89459(11) 0.0221(4) Uani 1 1 d .
O1W O 0.5531(4) 0.5536(3) 1.4602(3) 0.0156(10) Uani 1 1 d .
H1WA H 0.5548 0.6047 1.4781 0.023 Uiso 1 1 d R
O2W O 0.9074(4) -0.4716(3) -0.0287(3) 0.0141(9) Uani 1 1 d .
H2WA H 0.8768 -0.5000 -0.0681 0.021 Uiso 1 1 d R
O3W O 0.4667(4) 0.0491(3) 1.0609(3) 0.0171(10) Uani 1 1 d .
H3WA H 0.4088 0.0298 1.0793 0.026 Uiso 1 1 d R
O4W O 0.9910(4) 0.0719(3) 0.5423(3) 0.0265(12) Uani 1 1 d .
H4WA H 1.0450 0.0613 0.5723 0.040 Uiso 1 1 d R
N1 N 0.4452(5) 0.5358(4) 1.2943(3) 0.0247(13) Uani 1 1 d U
H1A H 0.5188 0.5347 1.2957 0.030 Uiso 1 1 calc R
H1B H 0.4216 0.4930 1.2600 0.030 Uiso 1 1 calc R
N2 N 0.3331(7) 0.6614(5) 1.3907(4) 0.0393(14) Uani 1 1 d U
H2C H 0.2605 0.6657 1.3788 0.047 Uiso 1 1 calc R
N3 N 0.3465(5) 0.6239(4) 1.5482(4) 0.0313(13) Uani 1 1 d U
H3C H 0.4130 0.6314 1.5733 0.038 Uiso 1 1 calc R
N4 N 0.2105(5) 0.4765(5) 1.5115(4) 0.0363(14) Uani 1 1 d DU
H4C H 0.2349 0.4376 1.5435 0.044 Uiso 1 1 calc R
N5 N 0.2024(5) 0.4898(5) 1.3454(4) 0.0328(13) Uani 1 1 d DU
H5A H 0.1945 0.5329 1.3154 0.039 Uiso 1 1 calc R
H5B H 0.2112 0.4434 1.3123 0.039 Uiso 1 1 calc R
N6 N 0.7551(5) -0.4563(3) 0.1134(3) 0.0173(11) Uani 1 1 d U
H6A H 0.7625 -0.4375 0.1651 0.021 Uiso 1 1 calc R
H6B H 0.7574 -0.4116 0.0851 0.021 Uiso 1 1 calc R
N7 N 0.7323(5) -0.6131(3) 0.0236(3) 0.0169(11) Uani 1 1 d U
H7C H 0.7125 -0.6507 0.0576 0.020 Uiso 1 1 calc R
N8 N 0.9390(5) -0.6777(3) -0.0244(3) 0.0163(11) Uani 1 1 d U
H8C H 0.9636 -0.6570 -0.0690 0.020 Uiso 1 1 calc R
N9 N 1.0349(5) -0.6673(3) 0.1322(3) 0.0156(11) Uani 1 1 d U
H9C H 1.1062 -0.6529 0.1269 0.019 Uiso 1 1 calc R
N10 N 0.8429(5) -0.5994(4) 0.2051(3) 0.0196(11) Uani 1 1 d U
H10A H 0.8473 -0.5565 0.2432 0.023 Uiso 1 1 calc R
H10B H 0.7715 -0.6120 0.1967 0.023 Uiso 1 1 calc R
N11 N 0.2379(5) 0.1017(4) 0.9822(4) 0.0287(13) Uani 1 1 d DU
H11A H 0.2403 0.1050 1.0356 0.034 Uiso 1 1 calc R
H11B H 0.2177 0.1521 0.9682 0.034 Uiso 1 1 calc R
N12 N 0.2955(5) -0.0487(4) 0.8982(4) 0.0316(13) Uani 1 1 d DU
H12C H 0.3303 -0.0940 0.9152 0.038 Uiso 1 1 calc R
N13 N 0.4309(5) 0.0177(3) 0.7836(3) 0.0195(11) Uani 1 1 d U
H13C H 0.5023 0.0130 0.7700 0.023 Uiso 1 1 calc R
N14 N 0.3770(5) 0.1843(3) 0.8402(3) 0.0150(10) Uani 1 1 d U
H14C H 0.3026 0.1839 0.8371 0.018 Uiso 1 1 calc R
N15 N 0.4287(5) 0.2194(4) 1.0048(3) 0.0209(12) Uani 1 1 d U
H15A H 0.3911 0.2170 1.0496 0.025 Uiso 1 1 calc R
H15B H 0.4975 0.2357 1.0190 0.025 Uiso 1 1 calc R
N16 N 0.7778(7) -0.1492(4) 0.4385(4) 0.0413(16) Uani 1 1 d U
H16A H 0.7582 -0.1257 0.3940 0.050 Uiso 1 1 calc R
H16B H 0.8282 -0.1884 0.4252 0.050 Uiso 1 1 calc R
N17 N 0.6768(6) -0.0861(4) 0.5833(4) 0.0366(14) Uani 1 1 d DU
H17C H 0.6884 -0.1237 0.6195 0.044 Uiso 1 1 calc R
N18 N 0.7735(6) 0.0716(5) 0.6369(5) 0.0491(16) Uani 1 1 d DU
H18C H 0.7544 0.1177 0.6124 0.059 Uiso 1 1 calc R
N19 N 0.9547(8) -0.0303(5) 0.6787(5) 0.0583(16) Uani 1 1 d DU
H19C H 1.0173 -0.0008 0.6735 0.070 Uiso 1 1 calc R
N20 N 0.9137(7) -0.1808(5) 0.5799(5) 0.0578(17) Uani 1 1 d DU
H20A H 0.8594 -0.1995 0.6087 0.069 Uiso 1 1 calc R
H20B H 0.9220 -0.2170 0.5367 0.069 Uiso 1 1 calc R
C1 C 0.4090(9) 0.6144(6) 1.2646(5) 0.0447(18) Uani 1 1 d U
H1C H 0.4605 0.6294 1.2255 0.054 Uiso 1 1 calc R
H1D H 0.3387 0.6047 1.2374 0.054 Uiso 1 1 calc R
C2 C 0.3986(9) 0.6846(7) 1.3236(6) 0.0522(19) Uani 1 1 d U
H2A H 0.3636 0.7305 1.2995 0.063 Uiso 1 1 calc R
H2B H 0.4707 0.7031 1.3431 0.063 Uiso 1 1 calc R
C3 C 0.3661(8) 0.7255(6) 1.4564(6) 0.0451(17) Uani 1 1 d U
H3A H 0.4449 0.7251 1.4645 0.054 Uiso 1 1 calc R
H3B H 0.3446 0.7805 1.4427 0.054 Uiso 1 1 calc R
C4 C 0.3131(7) 0.7068(5) 1.5282(5) 0.0396(17) Uani 1 1 d U
H4A H 0.2343 0.7083 1.5204 0.048 Uiso 1 1 calc R
H4B H 0.3336 0.7482 1.5714 0.048 Uiso 1 1 calc R
C5 C 0.2747(7) 0.5914(6) 1.6072(5) 0.0394(17) Uani 1 1 d U
H5C H 0.2512 0.6371 1.6443 0.047 Uiso 1 1 calc R
H5D H 0.3150 0.5523 1.6369 0.047 Uiso 1 1 calc R
C6 C 0.1754(7) 0.5482(6) 1.5664(5) 0.0388(16) Uani 1 1 d U
H6C H 0.1278 0.5286 1.6060 0.047 Uiso 1 1 calc R
H6D H 0.1346 0.5873 1.5369 0.047 Uiso 1 1 calc R
C7 C 0.1252(7) 0.4333(6) 1.4588(5) 0.0474(19) Uani 1 1 d DU
H7A H 0.1497 0.3775 1.4410 0.057 Uiso 1 1 calc R
H7B H 0.0585 0.4282 1.4879 0.057 Uiso 1 1 calc R
C8 C 0.1027(6) 0.4812(7) 1.3887(5) 0.0454(19) Uani 1 1 d DU
H8A H 0.0749 0.5360 1.4063 0.055 Uiso 1 1 calc R
H8B H 0.0476 0.4523 1.3541 0.055 Uiso 1 1 calc R
C9 C 0.6456(6) -0.4966(4) 0.1001(4) 0.0181(13) Uani 1 1 d U
H9A H 0.5896 -0.4541 0.0987 0.022 Uiso 1 1 calc R
H9B H 0.6304 -0.5301 0.1435 0.022 Uiso 1 1 calc R
C10 C 0.6432(6) -0.5513(4) 0.0226(4) 0.0200(13) Uani 1 1 d U
H10C H 0.5732 -0.5798 0.0152 0.024 Uiso 1 1 calc R
H10D H 0.6524 -0.5172 -0.0212 0.024 Uiso 1 1 calc R
C11 C 0.7456(6) -0.6600(4) -0.0544(4) 0.0212(13) Uani 1 1 d U
H11C H 0.7624 -0.6217 -0.0936 0.025 Uiso 1 1 calc R
H11D H 0.6779 -0.6888 -0.0710 0.025 Uiso 1 1 calc R
C12 C 0.8362(6) -0.7222(4) -0.0498(4) 0.0223(13) Uani 1 1 d U
H12A H 0.8185 -0.7617 -0.0120 0.027 Uiso 1 1 calc R
H12B H 0.8450 -0.7528 -0.1013 0.027 Uiso 1 1 calc R
C13 C 1.0253(6) -0.7355(4) -0.0013(4) 0.0204(13) Uani 1 1 d U
H13A H 1.0966 -0.7131 -0.0120 0.024 Uiso 1 1 calc R
H13B H 1.0164 -0.7890 -0.0323 0.024 Uiso 1 1 calc R
C14 C 1.0187(6) -0.7473(4) 0.0856(4) 0.0214(13) Uani 1 1 d U
H14A H 0.9478 -0.7702 0.0964 0.026 Uiso 1 1 calc R
H14B H 1.0745 -0.7863 0.1003 0.026 Uiso 1 1 calc R
C15 C 1.0187(6) -0.6710(5) 0.2177(4) 0.0208(13) Uani 1 1 d U
H15C H 1.0531 -0.6228 0.2471 0.025 Uiso 1 1 calc R
H15D H 1.0531 -0.7208 0.2349 0.025 Uiso 1 1 calc R
C16 C 0.8985(6) -0.6723(5) 0.2352(4) 0.0236(14) Uani 1 1 d U
H16C H 0.8656 -0.7233 0.2102 0.028 Uiso 1 1 calc R
H16D H 0.8892 -0.6713 0.2921 0.028 Uiso 1 1 calc R
C17 C 0.1517(7) 0.0409(5) 0.9535(7) 0.058(2) Uani 1 1 d DU
H17A H 0.0934 0.0429 0.9915 0.070 Uiso 1 1 calc R
H17B H 0.1211 0.0560 0.9034 0.070 Uiso 1 1 calc R
C18 C 0.1955(7) -0.0443(5) 0.9428(6) 0.0468(18) Uani 1 1 d DU
H18A H 0.2099 -0.0640 0.9945 0.056 Uiso 1 1 calc R
H18B H 0.1410 -0.0808 0.9152 0.056 Uiso 1 1 calc R
C19 C 0.2780(7) -0.0715(5) 0.8120(5) 0.0321(15) Uani 1 1 d U
H19A H 0.2258 -0.0334 0.7908 0.038 Uiso 1 1 calc R
H19B H 0.2478 -0.1274 0.8034 0.038 Uiso 1 1 calc R
C20 C 0.3851(6) -0.0676(5) 0.7685(5) 0.0259(14) Uani 1 1 d U
H20C H 0.4363 -0.1077 0.7874 0.031 Uiso 1 1 calc R
H20D H 0.3722 -0.0812 0.7120 0.031 Uiso 1 1 calc R
C21 C 0.3831(6) 0.0766(4) 0.7310(4) 0.0232(13) Uani 1 1 d U
H21A H 0.3039 0.0717 0.7301 0.028 Uiso 1 1 calc R
H21B H 0.4079 0.0631 0.6773 0.028 Uiso 1 1 calc R
C22 C 0.4161(6) 0.1648(4) 0.7595(4) 0.0196(13) Uani 1 1 d U
H22A H 0.4951 0.1704 0.7593 0.024 Uiso 1 1 calc R
H22B H 0.3846 0.2033 0.7245 0.024 Uiso 1 1 calc R
C23 C 0.4115(6) 0.2686(4) 0.8732(4) 0.0187(13) Uani 1 1 d U
H23A H 0.3777 0.3100 0.8424 0.022 Uiso 1 1 calc R
H23B H 0.4903 0.2741 0.8701 0.022 Uiso 1 1 calc R
C24 C 0.3784(6) 0.2833(4) 0.9584(4) 0.0198(13) Uani 1 1 d U
H24A H 0.4023 0.3384 0.9803 0.024 Uiso 1 1 calc R
H24B H 0.2994 0.2805 0.9614 0.024 Uiso 1 1 calc R
C25 C 0.6812(8) -0.1902(5) 0.4680(5) 0.0376(17) Uani 1 1 d U
H25A H 0.7045 -0.2333 0.5011 0.045 Uiso 1 1 calc R
H25B H 0.6381 -0.2163 0.4235 0.045 Uiso 1 1 calc R
C26 C 0.6132(8) -0.1278(5) 0.5150(5) 0.0388(17) Uani 1 1 d U
H26A H 0.5871 -0.0863 0.4810 0.047 Uiso 1 1 calc R
H26B H 0.5500 -0.1556 0.5343 0.047 Uiso 1 1 calc R
C27 C 0.6120(7) -0.0177(5) 0.6201(5) 0.0441(16) Uani 1 1 d DU
H27A H 0.5807 0.0139 0.5790 0.053 Uiso 1 1 calc R
H27B H 0.5522 -0.0406 0.6480 0.053 Uiso 1 1 calc R
C28 C 0.6781(8) 0.0391(6) 0.6768(6) 0.0540(17) Uani 1 1 d DU
H28A H 0.7032 0.0092 0.7211 0.065 Uiso 1 1 calc R
H28B H 0.6331 0.0853 0.6976 0.065 Uiso 1 1 calc R
C29 C 0.8410(10) 0.0956(7) 0.7094(6) 0.061(2) Uani 1 1 d U
H29A H 0.7946 0.1191 0.7513 0.073 Uiso 1 1 calc R
H29B H 0.8940 0.1378 0.6985 0.073 Uiso 1 1 calc R
C30 C 0.9026(11) 0.0174(7) 0.7375(7) 0.065(2) Uani 1 1 d U
H30A H 0.9562 0.0364 0.7785 0.078 Uiso 1 1 calc R
H30B H 0.8501 -0.0175 0.7612 0.078 Uiso 1 1 calc R
C31 C 0.9966(10) -0.1125(6) 0.6989(6) 0.069(2) Uani 1 1 d DU
H31A H 0.9453 -0.1364 0.7335 0.082 Uiso 1 1 calc R
H31B H 1.0657 -0.1041 0.7281 0.082 Uiso 1 1 calc R
C32 C 1.0134(9) -0.1739(7) 0.6263(6) 0.072(2) Uani 1 1 d DU
H32A H 1.0719 -0.1545 0.5949 0.086 Uiso 1 1 calc R
H32B H 1.0335 -0.2281 0.6429 0.086 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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Se Se -0.0929 2.2259 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Gd Gd -0.1653 3.9035 '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
Se2 Sb1 Se1 112.69(3) . .
Se2 Sb1 Se4 109.55(3) . .
Se1 Sb1 Se4 109.45(3) . .
Se2 Sb1 Se3 105.13(3) . .
Se1 Sb1 Se3 109.39(3) . .
Se4 Sb1 Se3 110.56(3) . .
Se6 Sb2 Se5 110.07(3) . .
Se6 Sb2 Se7 110.34(3) . .
Se5 Sb2 Se7 111.09(3) . .
Se6 Sb2 Se8 109.40(3) . .
Se5 Sb2 Se8 109.99(3) . .
Se7 Sb2 Se8 105.85(3) . .
O1W Gd1 O1W 69.86(19) . 2_668
O1W Gd1 N3 80.70(19) . .
O1W Gd1 N3 78.76(19) 2_668 .
O1W Gd1 N4 136.93(17) . .
O1W Gd1 N4 74.35(19) 2_668 .
N3 Gd1 N4 69.4(2) . .
O1W Gd1 N1 78.28(18) . .
O1W Gd1 N1 134.18(18) 2_668 .
N3 Gd1 N1 128.0(2) . .
N4 Gd1 N1 144.7(2) . .
O1W Gd1 N5 155.52(18) . .
O1W Gd1 N5 132.1(2) 2_668 .
N3 Gd1 N5 111.3(2) . .
N4 Gd1 N5 67.14(19) . .
N1 Gd1 N5 77.6(2) . .
O1W Gd1 N2 89.9(2) . .
O1W Gd1 N2 141.7(2) 2_668 .
N3 Gd1 N2 65.7(2) . .
N4 Gd1 N2 104.3(2) . .
N1 Gd1 N2 67.2(2) . .
N5 Gd1 N2 76.9(3) . .
O1W Gd1 Se3 103.51(12) . .
O1W Gd1 Se3 74.59(11) 2_668 .
N3 Gd1 Se3 149.41(17) . .
N4 Gd1 Se3 88.99(18) . .
N1 Gd1 Se3 82.12(14) . .
N5 Gd1 Se3 77.35(17) . .
N2 Gd1 Se3 143.35(17) . .
O1W Gd1 Gd1 35.55(11) . 2_668
O1W Gd1 Gd1 34.31(11) 2_668 2_668
N3 Gd1 Gd1 77.42(15) . 2_668
N4 Gd1 Gd1 105.75(14) . 2_668
N1 Gd1 Gd1 108.04(15) . 2_668
N5 Gd1 Gd1 164.14(17) . 2_668
N2 Gd1 Gd1 119.00(19) . 2_668
Se3 Gd1 Gd1 88.608(18) . 2_668
O2W Gd2 O2W 70.04(18) . 2_745
O2W Gd2 N8 87.56(17) . .
O2W Gd2 N8 78.56(17) 2_745 .
O2W Gd2 N6 78.55(17) . .
O2W Gd2 N6 134.94(16) 2_745 .
N8 Gd2 N6 132.30(18) . .
O2W Gd2 N10 151.58(17) . .
O2W Gd2 N10 135.04(17) 2_745 .
N8 Gd2 N10 108.36(18) . .
N6 Gd2 N10 73.33(18) . .
O2W Gd2 N7 85.68(17) . .
O2W Gd2 N7 138.56(16) 2_745 .
N8 Gd2 N7 66.99(18) . .
N6 Gd2 N7 66.63(18) . .
N10 Gd2 N7 79.57(19) . .
O2W Gd2 N9 141.47(16) . .
O2W Gd2 N9 76.42(16) 2_745 .
N8 Gd2 N9 67.34(17) . .
N6 Gd2 N9 139.95(17) . .
N10 Gd2 N9 66.82(18) . .
N7 Gd2 N9 108.64(17) . .
O2W Gd2 Se8 99.74(11) . .
O2W Gd2 Se8 74.11(11) 2_745 .
N8 Gd2 Se8 147.13(13) . .
N6 Gd2 Se8 80.52(13) . .
N10 Gd2 Se8 79.81(14) . .
N7 Gd2 Se8 145.02(13) . .
N9 Gd2 Se8 88.53(12) . .
O2W Gd2 Gd2 35.51(11) . 2_745
O2W Gd2 Gd2 34.53(11) 2_745 2_745
N8 Gd2 Gd2 81.47(13) . 2_745
N6 Gd2 Gd2 108.47(13) . 2_745
N10 Gd2 Gd2 165.39(14) . 2_745
N7 Gd2 Gd2 114.70(13) . 2_745
N9 Gd2 Gd2 109.07(12) . 2_745
Se8 Gd2 Gd2 86.151(18) . 2_745
O3W Gd3 O3W 70.30(18) . 2_657
O3W Gd3 N15 77.03(17) . .
O3W Gd3 N15 138.70(17) 2_657 .
O3W Gd3 N14 143.51(16) . .
O3W Gd3 N14 144.05(16) 2_657 .
N15 Gd3 N14 67.00(17) . .
O3W Gd3 N13 149.68(17) . .
O3W Gd3 N13 80.40(17) 2_657 .
N15 Gd3 N13 132.68(18) . .
N14 Gd3 N13 66.81(17) . .
O3W Gd3 N12 97.0(2) . .
O3W Gd3 N12 74.3(2) 2_657 .
N15 Gd3 N12 135.5(2) . .
N14 Gd3 N12 104.1(2) . .
N13 Gd3 N12 66.8(2) . .
O3W Gd3 N11 82.34(19) . .
O3W Gd3 N11 126.92(19) 2_657 .
N15 Gd3 N11 70.71(19) . .
N14 Gd3 N11 80.29(19) . .
N13 Gd3 N11 110.6(2) . .
N12 Gd3 N11 64.81(19) . .
O3W Gd3 Cl1 100.92(13) . .
O3W Gd3 Cl1 82.32(13) 2_657 .
N15 Gd3 Cl1 79.74(15) . .
N14 Gd3 Cl1 79.14(13) . .
N13 Gd3 Cl1 82.19(14) . .
N12 Gd3 Cl1 143.58(14) . .
N11 Gd3 Cl1 148.80(14) . .
O3W Gd3 Gd3 35.50(11) . 2_657
O3W Gd3 Gd3 34.80(11) 2_657 2_657
N15 Gd3 Gd3 109.10(13) . 2_657
N14 Gd3 Gd3 170.64(13) . 2_657
N13 Gd3 Gd3 114.86(13) . 2_657
N12 Gd3 Gd3 84.67(16) . 2_657
N11 Gd3 Gd3 106.84(15) . 2_657
Cl1 Gd3 Gd3 91.86(4) . 2_657
O4W Gd4 O4W 69.7(2) 2_756 .
O4W Gd4 N20 78.9(2) 2_756 .
O4W Gd4 N20 123.5(2) . .
O4W Gd4 N19 103.2(3) 2_756 .
O4W Gd4 N19 75.5(2) . .
N20 Gd4 N19 67.4(3) . .
O4W Gd4 N18 149.4(2) 2_756 .
O4W Gd4 N18 79.67(19) . .
N20 Gd4 N18 119.8(3) . .
N19 Gd4 N18 67.6(3) . .
O4W Gd4 N16 78.5(2) 2_756 .
O4W Gd4 N16 140.3(2) . .
N20 Gd4 N16 70.4(3) . .
N19 Gd4 N16 136.5(2) . .
N18 Gd4 N16 128.9(2) . .
O4W Gd4 N17 143.74(19) 2_756 .
O4W Gd4 N17 146.30(18) . .
N20 Gd4 N17 78.7(3) . .
N19 Gd4 N17 94.0(3) . .
N18 Gd4 N17 66.8(2) . .
N16 Gd4 N17 67.2(2) . .
O4W Gd4 Cl2 99.32(15) 2_756 .
O4W Gd4 Cl2 85.73(15) . .
N20 Gd4 Cl2 146.5(2) . .
N19 Gd4 Cl2 143.2(2) . .
N18 Gd4 Cl2 78.1(2) . .
N16 Gd4 Cl2 76.38(19) . .
N17 Gd4 Cl2 84.30(18) . .
O4W Gd4 Gd4 35.09(13) 2_756 2_756
O4W Gd4 Gd4 34.65(12) . 2_756
N20 Gd4 Gd4 102.8(2) . 2_756
N19 Gd4 Gd4 89.1(2) . 2_756
N18 Gd4 Gd4 114.31(16) . 2_756
N16 Gd4 Gd4 110.54(15) . 2_756
N17 Gd4 Gd4 176.83(17) . 2_756
Cl2 Gd4 Gd4 93.01(6) . 2_756
Sb1 Se3 Gd1 117.99(3) . .
Sb2 Se8 Gd2 122.08(3) . .
Gd1 O1W Gd1 110.14(18) . 2_668
Gd1 O1W H1WA 109.3 . .
Gd1 O1W H1WA 102.8 2_668 .
Gd2 O2W Gd2 109.96(18) . 2_745
Gd2 O2W H2WA 109.3 . .
Gd2 O2W H2WA 101.8 2_745 .
Gd3 O3W Gd3 109.70(18) . 2_657
Gd3 O3W H3WA 109.2 . .
Gd3 O3W H3WA 94.5 2_657 .
Gd4 O4W Gd4 110.3(2) 2_756 .
Gd4 O4W H4WA 73.1 2_756 .
Gd4 O4W H4WA 109.1 . .
C1 N1 Gd1 113.9(5) . .
C1 N1 H1A 108.8 . .
Gd1 N1 H1A 108.8 . .
C1 N1 H1B 108.8 . .
Gd1 N1 H1B 108.8 . .
H1A N1 H1B 107.7 . .
C2 N2 C3 103.0(8) . .
C2 N2 Gd1 113.6(6) . .
C3 N2 Gd1 109.4(5) . .
C2 N2 H2C 110.2 . .
C3 N2 H2C 110.2 . .
Gd1 N2 H2C 110.2 . .
C4 N3 C5 112.1(7) . .
C4 N3 Gd1 116.9(5) . .
C5 N3 Gd1 110.8(5) . .
C4 N3 H3C 105.3 . .
C5 N3 H3C 105.3 . .
Gd1 N3 H3C 105.3 . .
C6 N4 C7 117.4(7) . .
C6 N4 Gd1 111.4(5) . .
C7 N4 Gd1 111.2(5) . .
C6 N4 H4C 105.2 . .
C7 N4 H4C 105.2 . .
Gd1 N4 H4C 105.2 . .
C8 N5 Gd1 114.9(5) . .
C8 N5 H5A 108.5 . .
Gd1 N5 H5A 108.5 . .
C8 N5 H5B 108.5 . .
Gd1 N5 H5B 108.5 . .
H5A N5 H5B 107.5 . .
C9 N6 Gd2 115.3(4) . .
C9 N6 H6A 108.4 . .
Gd2 N6 H6A 108.4 . .
C9 N6 H6B 108.4 . .
Gd2 N6 H6B 108.4 . .
H6A N6 H6B 107.5 . .
C11 N7 C10 112.3(5) . .
C11 N7 Gd2 110.0(4) . .
C10 N7 Gd2 113.7(4) . .
C11 N7 H7C 106.8 . .
C10 N7 H7C 106.8 . .
Gd2 N7 H7C 106.8 . .
C13 N8 C12 111.9(5) . .
C13 N8 Gd2 113.1(4) . .
C12 N8 Gd2 115.6(4) . .
C13 N8 H8C 105.0 . .
C12 N8 H8C 105.0 . .
Gd2 N8 H8C 105.0 . .
C14 N9 C15 113.5(5) . .
C14 N9 Gd2 111.9(4) . .
C15 N9 Gd2 111.7(4) . .
C14 N9 H9C 106.4 . .
C15 N9 H9C 106.4 . .
Gd2 N9 H9C 106.4 . .
C16 N10 Gd2 115.7(4) . .
C16 N10 H10A 108.4 . .
Gd2 N10 H10A 108.4 . .
C16 N10 H10B 108.4 . .
Gd2 N10 H10B 108.4 . .
H10A N10 H10B 107.4 . .
C17 N11 Gd3 117.1(5) . .
C17 N11 H11A 108.0 . .
Gd3 N11 H11A 108.0 . .
C17 N11 H11B 108.0 . .
Gd3 N11 H11B 108.0 . .
H11A N11 H11B 107.3 . .
C18 N12 C19 113.9(7) . .
C18 N12 Gd3 116.1(5) . .
C19 N12 Gd3 114.1(5) . .
C18 N12 H12C 103.5 . .
C19 N12 H12C 103.5 . .
Gd3 N12 H12C 103.5 . .
C21 N13 C20 113.1(6) . .
C21 N13 Gd3 114.0(4) . .
C20 N13 Gd3 113.0(4) . .
C21 N13 H13C 105.2 . .
C20 N13 H13C 105.2 . .
Gd3 N13 H13C 105.2 . .
C22 N14 C23 111.5(5) . .
C22 N14 Gd3 111.6(4) . .
C23 N14 Gd3 111.6(4) . .
C22 N14 H14C 107.3 . .
C23 N14 H14C 107.3 . .
Gd3 N14 H14C 107.3 . .
C24 N15 Gd3 115.1(4) . .
C24 N15 H15A 108.5 . .
Gd3 N15 H15A 108.5 . .
C24 N15 H15B 108.5 . .
Gd3 N15 H15B 108.5 . .
H15A N15 H15B 107.5 . .
C25 N16 Gd4 114.5(5) . .
C25 N16 H16A 108.6 . .
Gd4 N16 H16A 108.6 . .
C25 N16 H16B 108.6 . .
Gd4 N16 H16B 108.6 . .
H16A N16 H16B 107.6 . .
C27 N17 C26 108.8(7) . .
C27 N17 Gd4 112.5(5) . .
C26 N17 Gd4 110.7(5) . .
C27 N17 H17C 108.2 . .
C26 N17 H17C 108.2 . .
Gd4 N17 H17C 108.2 . .
C29 N18 C28 97.3(7) . .
C29 N18 Gd4 113.4(7) . .
C28 N18 Gd4 114.6(5) . .
C29 N18 H18C 110.3 . .
C28 N18 H18C 110.3 . .
Gd4 N18 H18C 110.3 . .
C30 N19 C31 116.7(9) . .
C30 N19 Gd4 116.6(7) . .
C31 N19 Gd4 112.8(6) . .
C30 N19 H19C 102.6 . .
C31 N19 H19C 102.6 . .
Gd4 N19 H19C 102.6 . .
C32 N20 Gd4 108.1(7) . .
C32 N20 H20A 110.1 . .
Gd4 N20 H20A 110.1 . .
C32 N20 H20B 110.1 . .
Gd4 N20 H20B 110.1 . .
H20A N20 H20B 108.4 . .
C2 C1 N1 116.0(8) . .
C2 C1 H1C 108.3 . .
N1 C1 H1C 108.3 . .
C2 C1 H1D 108.3 . .
N1 C1 H1D 108.3 . .
H1C C1 H1D 107.4 . .
C1 C2 N2 110.7(8) . .
C1 C2 H2A 109.5 . .
N2 C2 H2A 109.5 . .
C1 C2 H2B 109.5 . .
N2 C2 H2B 109.5 . .
H2A C2 H2B 108.1 . .
C4 C3 N2 109.0(8) . .
C4 C3 H3A 109.9 . .
N2 C3 H3A 109.9 . .
C4 C3 H3B 109.9 . .
N2 C3 H3B 109.9 . .
H3A C3 H3B 108.3 . .
C3 C4 N3 109.3(7) . .
C3 C4 H4A 109.8 . .
N3 C4 H4A 109.8 . .
C3 C4 H4B 109.8 . .
N3 C4 H4B 109.8 . .
H4A C4 H4B 108.3 . .
N3 C5 C6 110.6(7) . .
N3 C5 H5C 109.5 . .
C6 C5 H5C 109.5 . .
N3 C5 H5D 109.5 . .
C6 C5 H5D 109.5 . .
H5C C5 H5D 108.1 . .
N4 C6 C5 109.9(7) . .
N4 C6 H6C 109.7 . .
C5 C6 H6C 109.7 . .
N4 C6 H6D 109.7 . .
C5 C6 H6D 109.7 . .
H6C C6 H6D 108.2 . .
C8 C7 N4 110.0(7) . .
C8 C7 H7A 109.7 . .
N4 C7 H7A 109.7 . .
C8 C7 H7B 109.7 . .
N4 C7 H7B 109.7 . .
H7A C7 H7B 108.2 . .
C7 C8 N5 109.9(7) . .
C7 C8 H8A 109.7 . .
N5 C8 H8A 109.7 . .
C7 C8 H8B 109.7 . .
N5 C8 H8B 109.7 . .
H8A C8 H8B 108.2 . .
N6 C9 C10 109.8(5) . .
N6 C9 H9A 109.7 . .
C10 C9 H9A 109.7 . .
N6 C9 H9B 109.7 . .
C10 C9 H9B 109.7 . .
H9A C9 H9B 108.2 . .
N7 C10 C9 109.4(6) . .
N7 C10 H10C 109.8 . .
C9 C10 H10C 109.8 . .
N7 C10 H10D 109.8 . .
C9 C10 H10D 109.8 . .
H10C C10 H10D 108.2 . .
N7 C11 C12 110.0(6) . .
N7 C11 H11C 109.7 . .
C12 C11 H11C 109.7 . .
N7 C11 H11D 109.7 . .
C12 C11 H11D 109.7 . .
H11C C11 H11D 108.2 . .
N8 C12 C11 109.2(6) . .
N8 C12 H12A 109.8 . .
C11 C12 H12A 109.8 . .
N8 C12 H12B 109.8 . .
C11 C12 H12B 109.8 . .
H12A C12 H12B 108.3 . .
N8 C13 C14 110.0(6) . .
N8 C13 H13A 109.7 . .
C14 C13 H13A 109.7 . .
N8 C13 H13B 109.7 . .
C14 C13 H13B 109.7 . .
H13A C13 H13B 108.2 . .
N9 C14 C13 109.5(6) . .
N9 C14 H14A 109.8 . .
C13 C14 H14A 109.8 . .
N9 C14 H14B 109.8 . .
C13 C14 H14B 109.8 . .
H14A C14 H14B 108.2 . .
N9 C15 C16 110.5(6) . .
N9 C15 H15C 109.5 . .
C16 C15 H15C 109.5 . .
N9 C15 H15D 109.5 . .
C16 C15 H15D 109.5 . .
H15C C15 H15D 108.1 . .
N10 C16 C15 110.5(6) . .
N10 C16 H16C 109.6 . .
C15 C16 H16C 109.6 . .
N10 C16 H16D 109.6 . .
C15 C16 H16D 109.6 . .
H16C C16 H16D 108.1 . .
C18 C17 N11 111.2(8) . .
C18 C17 H17A 109.4 . .
N11 C17 H17A 109.4 . .
C18 C17 H17B 109.4 . .
N11 C17 H17B 109.4 . .
H17A C17 H17B 108.0 . .
N12 C18 C17 112.4(8) . .
N12 C18 H18A 109.1 . .
C17 C18 H18A 109.1 . .
N12 C18 H18B 109.1 . .
C17 C18 H18B 109.1 . .
H18A C18 H18B 107.9 . .
N12 C19 C20 110.7(6) . .
N12 C19 H19A 109.5 . .
C20 C19 H19A 109.5 . .
N12 C19 H19B 109.5 . .
C20 C19 H19B 109.5 . .
H19A C19 H19B 108.1 . .
N13 C20 C19 108.7(6) . .
N13 C20 H20C 110.0 . .
C19 C20 H20C 110.0 . .
N13 C20 H20D 110.0 . .
C19 C20 H20D 110.0 . .
H20C C20 H20D 108.3 . .
N13 C21 C22 110.4(6) . .
N13 C21 H21A 109.6 . .
C22 C21 H21A 109.6 . .
N13 C21 H21B 109.6 . .
C22 C21 H21B 109.6 . .
H21A C21 H21B 108.1 . .
N14 C22 C21 108.8(6) . .
N14 C22 H22A 109.9 . .
C21 C22 H22A 109.9 . .
N14 C22 H22B 109.9 . .
C21 C22 H22B 109.9 . .
H22A C22 H22B 108.3 . .
N14 C23 C24 109.9(6) . .
N14 C23 H23A 109.7 . .
C24 C23 H23A 109.7 . .
N14 C23 H23B 109.7 . .
C24 C23 H23B 109.7 . .
H23A C23 H23B 108.2 . .
N15 C24 C23 109.5(6) . .
N15 C24 H24A 109.8 . .
C23 C24 H24A 109.8 . .
N15 C24 H24B 109.8 . .
C23 C24 H24B 109.8 . .
H24A C24 H24B 108.2 . .
N16 C25 C26 110.2(7) . .
N16 C25 H25A 109.6 . .
C26 C25 H25A 109.6 . .
N16 C25 H25B 109.6 . .
C26 C25 H25B 109.6 . .
H25A C25 H25B 108.1 . .
N17 C26 C25 111.1(8) . .
N17 C26 H26A 109.4 . .
C25 C26 H26A 109.4 . .
N17 C26 H26B 109.4 . .
C25 C26 H26B 109.4 . .
H26A C26 H26B 108.0 . .
C28 C27 N17 112.2(8) . .
C28 C27 H27A 109.2 . .
N17 C27 H27A 109.2 . .
C28 C27 H27B 109.2 . .
N17 C27 H27B 109.2 . .
H27A C27 H27B 107.9 . .
C27 C28 N18 110.4(7) . .
C27 C28 H28A 109.6 . .
N18 C28 H28A 109.6 . .
C27 C28 H28B 109.6 . .
N18 C28 H28B 109.6 . .
H28A C28 H28B 108.1 . .
N18 C29 C30 110.5(8) . .
N18 C29 H29A 109.6 . .
C30 C29 H29A 109.6 . .
N18 C29 H29B 109.6 . .
C30 C29 H29B 109.6 . .
H29A C29 H29B 108.1 . .
N19 C30 C29 114.8(9) . .
N19 C30 H30A 108.6 . .
C29 C30 H30A 108.6 . .
N19 C30 H30B 108.6 . .
C29 C30 H30B 108.6 . .
H30A C30 H30B 107.5 . .
N19 C31 C32 113.2(8) . .
N19 C31 H31A 108.9 . .
C32 C31 H31A 108.9 . .
N19 C31 H31B 108.9 . .
C32 C31 H31B 108.9 . .
H31A C31 H31B 107.8 . .
N20 C32 C31 108.8(9) . .
N20 C32 H32A 109.9 . .
C31 C32 H32A 109.9 . .
N20 C32 H32B 109.9 . .
C31 C32 H32B 109.9 . .
H32A C32 H32B 108.3 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sb1 Se2 2.4678(8) .
Sb1 Se1 2.4689(9) .
Sb1 Se4 2.4748(8) .
Sb1 Se3 2.4936(8) .
Sb2 Se6 2.4548(9) .
Sb2 Se5 2.4752(9) .
Sb2 Se7 2.4771(8) .
Sb2 Se8 2.5004(8) .
Gd1 O1W 2.271(5) .
Gd1 O1W 2.343(4) 2_668
Gd1 N3 2.545(6) .
Gd1 N4 2.559(7) .
Gd1 N1 2.561(6) .
Gd1 N5 2.570(6) .
Gd1 N2 2.592(7) .
Gd1 Se3 3.0544(8) .
Gd1 Gd1 3.7834(6) 2_668
Gd2 O2W 2.272(4) .
Gd2 O2W 2.328(4) 2_745
Gd2 N8 2.558(5) .
Gd2 N6 2.565(6) .
Gd2 N10 2.582(6) .
Gd2 N7 2.594(5) .
Gd2 N9 2.599(5) .
Gd2 Se8 3.0497(7) .
Gd2 Gd2 3.7669(6) 2_745
Gd3 O3W 2.261(4) .
Gd3 O3W 2.300(4) 2_657
Gd3 N15 2.567(6) .
Gd3 N14 2.584(5) .
Gd3 N13 2.588(6) .
Gd3 N12 2.603(6) .
Gd3 N11 2.610(6) .
Gd3 Cl1 2.7246(17) .
Gd3 Gd3 3.7291(6) 2_657
Gd4 O4W 2.278(5) 2_756
Gd4 O4W 2.303(5) .
Gd4 N20 2.555(8) .
Gd4 N19 2.578(8) .
Gd4 N18 2.583(7) .
Gd4 N16 2.581(7) .
Gd4 N17 2.609(7) .
Gd4 Cl2 2.724(2) .
Gd4 Gd4 3.7588(7) 2_756
O1W Gd1 2.343(4) 2_668
O1W H1WA 0.8500 .
O2W Gd2 2.328(4) 2_745
O2W H2WA 0.8499 .
O3W Gd3 2.300(4) 2_657
O3W H3WA 0.8500 .
O4W Gd4 2.278(5) 2_756
O4W H4WA 0.8500 .
N1 C1 1.469(11) .
N1 H1A 0.9000 .
N1 H1B 0.9000 .
N2 C2 1.480(12) .
N2 C3 1.491(12) .
N2 H2C 0.9100 .
N3 C4 1.463(11) .
N3 C5 1.475(11) .
N3 H3C 0.9100 .
N4 C6 1.485(11) .
N4 C7 1.484(8) .
N4 H4C 0.9100 .
N5 C8 1.449(8) .
N5 H5A 0.9000 .
N5 H5B 0.9000 .
N6 C9 1.490(9) .
N6 H6A 0.9000 .
N6 H6B 0.9000 .
N7 C11 1.471(9) .
N7 C10 1.478(9) .
N7 H7C 0.9100 .
N8 C13 1.479(9) .
N8 C12 1.479(9) .
N8 H8C 0.9100 .
N9 C14 1.456(9) .
N9 C15 1.472(9) .
N9 H9C 0.9100 .
N10 C16 1.482(9) .
N10 H10A 0.9000 .
N10 H10B 0.9000 .
N11 C17 1.478(8) .
N11 H11A 0.9000 .
N11 H11B 0.9000 .
N12 C18 1.452(8) .
N12 C19 1.480(10) .
N12 H12C 0.9100 .
N13 C21 1.471(9) .
N13 C20 1.480(9) .
N13 H13C 0.9100 .
N14 C22 1.464(8) .
N14 C23 1.476(8) .
N14 H14C 0.9100 .
N15 C24 1.476(9) .
N15 H15A 0.9000 .
N15 H15B 0.9000 .
N16 C25 1.471(11) .
N16 H16A 0.9000 .
N16 H16B 0.9000 .
N17 C27 1.459(8) .
N17 C26 1.483(11) .
N17 H17C 0.9100 .
N18 C29 1.481(13) .
N18 C28 1.481(8) .
N18 H18C 0.9100 .
N19 C30 1.370(15) .
N19 C31 1.487(8) .
N19 H19C 0.9100 .
N20 C32 1.432(9) .
N20 H20A 0.9000 .
N20 H20B 0.9000 .
C1 C2 1.445(13) .
C1 H1C 0.9700 .
C1 H1D 0.9700 .
C2 H2A 0.9700 .
C2 H2B 0.9700 .
C3 C4 1.447(14) .
C3 H3A 0.9700 .
C3 H3B 0.9700 .
C4 H4A 0.9700 .
C4 H4B 0.9700 .
C5 C6 1.516(12) .
C5 H5C 0.9700 .
C5 H5D 0.9700 .
C6 H6C 0.9700 .
C6 H6D 0.9700 .
C7 C8 1.493(8) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 C10 1.510(9) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 H10C 0.9700 .
C10 H10D 0.9700 .
C11 C12 1.500(10) .
C11 H11C 0.9700 .
C11 H11D 0.9700 .
C12 H12A 0.9700 .
C12 H12B 0.9700 .
C13 C14 1.503(10) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
C15 C16 1.507(10) .
C15 H15C 0.9700 .
C15 H15D 0.9700 .
C16 H16C 0.9700 .
C16 H16D 0.9700 .
C17 C18 1.470(8) .
C17 H17A 0.9700 .
C17 H17B 0.9700 .
C18 H18A 0.9700 .
C18 H18B 0.9700 .
C19 C20 1.521(11) .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C20 H20C 0.9700 .
C20 H20D 0.9700 .
C21 C22 1.507(10) .
C21 H21A 0.9700 .
C21 H21B 0.9700 .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 C24 1.504(9) .
C23 H23A 0.9700 .
C23 H23B 0.9700 .
C24 H24A 0.9700 .
C24 H24B 0.9700 .
C25 C26 1.490(12) .
C25 H25A 0.9700 .
C25 H25B 0.9700 .
C26 H26A 0.9700 .
C26 H26B 0.9700 .
C27 C28 1.484(8) .
C27 H27A 0.9700 .
C27 H27B 0.9700 .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C29 C30 1.572(17) .
C29 H29A 0.9700 .
C29 H29B 0.9700 .
C30 H30A 0.9700 .
C30 H30B 0.9700 .
C31 C32 1.522(9) .
C31 H31A 0.9700 .
C31 H31B 0.9700 .
C32 H32A 0.9700 .
C32 H32B 0.9700 .
