#------------------------------------------------------------------------------
#$Date: 2016-03-24 03:15:55 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179621 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/85/4508571.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_4508571
loop_
_publ_author_name
'Xu, Wentao'
'Zhou, Youfu'
'Huang, Decai'
'Xiong, Wei'
'Su, Mingyi'
'Wang, Kun'
'Han, Shuo'
'Hong, Maochun'
_publ_section_title
;
 Crystal Structure, Multiplex Photoluminescence, and Magnetic Properties
 of a Series of Lanthanide Coordination Polymers Based on Quinoline
 Carboxylate Ligand
;
_journal_issue                   12
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              5420
_journal_paper_doi               10.1021/cg401391b
_journal_volume                  13
_journal_year                    2013
_chemical_formula_moiety         'C32 H21 N4 O10 Tm1'
_chemical_formula_sum            'C32 H21 N4 O10 Tm'
_chemical_formula_weight         790.46
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 94.053(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   10.002(5)
_cell_length_b                   16.375(8)
_cell_length_c                   17.040(9)
_cell_measurement_reflns_used    7835
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.5943
_cell_measurement_theta_min      2.0412
_cell_volume                     2784(2)
_computing_cell_refinement       CrystalClear
_computing_data_collection       'CrystalClear (Rigaku, 2000)'
_computing_data_reduction        CrystalClear
_computing_molecular_graphics    'SHELXL-97 (Sheldrick, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Saturn 70 CCD diffractometer'
_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  0.0446
_diffrn_reflns_av_sigmaI/netI    0.0518
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            21366
_diffrn_reflns_theta_full        27.52
_diffrn_reflns_theta_max         27.52
_diffrn_reflns_theta_min         2.04
_exptl_absorpt_coefficient_mu    3.259
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8473
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(CrystalClear; Rigaku, 2000)'
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.886
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             1560
_exptl_crystal_size_max          0.2500
_exptl_crystal_size_mid          0.1500
_exptl_crystal_size_min          0.1000
_refine_diff_density_max         1.398
_refine_diff_density_min         -1.656
_refine_diff_density_rms         0.135
_refine_ls_extinction_coef       SHELXL
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.141
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     428
_refine_ls_number_reflns         6355
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.141
_refine_ls_R_factor_all          0.0490
_refine_ls_R_factor_gt           0.0412
_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)+(0.0190P)²+2.8816P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0678
_refine_ls_wR_factor_ref         0.0706
_reflns_number_gt                5789
_reflns_number_total             6355
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg401391b_si_002.cif
_cod_data_source_block           8-Tm
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_original_sg_symbol_H-M      P21/C
_cod_database_code               4508571
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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
Tm1 Tm 0.247477(16) 0.020814(10) 0.012557(10) 0.01716(6) Uani 1 1 d .
O1 O 0.1100(2) 0.13037(15) -0.00246(17) 0.0203(6) Uani 1 1 d .
O2 O -0.0906(3) 0.07288(16) -0.01933(19) 0.0278(7) Uani 1 1 d .
O4 O 0.5937(3) -0.11102(16) -0.05769(17) 0.0216(6) Uani 1 1 d .
O3 O 0.3936(3) -0.07595(15) -0.01732(17) 0.0222(7) Uani 1 1 d .
O6 O 0.1707(3) 0.05318(16) 0.14156(17) 0.0232(6) Uani 1 1 d .
O5 O 0.3153(3) -0.04394(17) 0.13877(18) 0.0266(7) Uani 1 1 d .
O7 O 0.2236(3) -0.01593(17) 0.24847(18) 0.0322(7) Uani 1 1 d .
O8 O 0.1794(3) -0.00382(17) -0.12320(18) 0.0282(7) Uani 1 1 d .
O9 O 0.3416(3) 0.08208(17) -0.10063(18) 0.0274(7) Uani 1 1 d .
O10 O 0.2872(4) 0.0431(2) -0.2214(2) 0.0416(9) Uani 1 1 d .
N1 N -0.2173(3) 0.36785(19) -0.0367(2) 0.0210(8) Uani 1 1 d .
N2 N 0.3053(3) -0.3271(2) -0.1734(2) 0.0220(8) Uani 1 1 d .
N3 N 0.2351(3) -0.0024(2) 0.1781(2) 0.0239(8) Uani 1 1 d .
N4 N 0.2710(4) 0.0405(2) -0.1519(2) 0.0286(9) Uani 1 1 d .
C1 C -0.0160(4) 0.1340(2) -0.0101(2) 0.0172(8) Uani 1 1 d .
C2 C -0.0829(4) 0.2166(2) -0.0134(2) 0.0176(8) Uani 1 1 d .
C3 C -0.0336(4) 0.2864(2) 0.0289(2) 0.0179(8) Uani 1 1 d .
C4 C 0.0803(4) 0.2869(2) 0.0839(2) 0.0222(9) Uani 1 1 d .
H4 H 0.1312 0.2384 0.0928 0.027 Uiso 1 1 calc R
C5 C 0.1167(4) 0.3566(3) 0.1237(3) 0.0276(10) Uani 1 1 d .
H5 H 0.1927 0.3559 0.1604 0.033 Uiso 1 1 calc R
C6 C 0.0442(5) 0.4292(3) 0.1115(3) 0.0302(10) Uani 1 1 d .
H6 H 0.0721 0.4773 0.1392 0.036 Uiso 1 1 calc R
C7 C -0.0670(4) 0.4309(2) 0.0595(3) 0.0269(10) Uani 1 1 d .
H7 H -0.1171 0.4800 0.0523 0.032 Uiso 1 1 calc R
C8 C -0.1076(4) 0.3605(2) 0.0167(2) 0.0201(9) Uani 1 1 d .
C9 C -0.1959(4) 0.2243(2) -0.0633(2) 0.0175(8) Uani 1 1 d .
H9 H -0.2327 0.1776 -0.0899 0.021 Uiso 1 1 calc R
C10 C -0.2581(4) 0.3013(2) -0.0753(2) 0.0185(8) Uani 1 1 d .
C11 C -0.3729(4) 0.3096(2) -0.1359(2) 0.0196(9) Uani 1 1 d .
C16 C -0.3947(4) 0.3832(2) -0.1752(2) 0.0226(9) Uani 1 1 d .
H16 H -0.3373 0.4284 -0.1632 0.027 Uiso 1 1 calc R
C15 C -0.5008(4) 0.3906(2) -0.2322(3) 0.0252(10) Uani 1 1 d .
H15 H -0.5150 0.4409 -0.2592 0.030 Uiso 1 1 calc R
C14 C -0.5860(4) 0.3254(3) -0.2499(3) 0.0259(10) Uani 1 1 d .
H14 H -0.6586 0.3311 -0.2885 0.031 Uiso 1 1 calc R
C13 C -0.5644(4) 0.2515(3) -0.2108(3) 0.0249(10) Uani 1 1 d .
H13 H -0.6229 0.2067 -0.2224 0.030 Uiso 1 1 calc R
C12 C -0.4576(4) 0.2429(2) -0.1547(2) 0.0222(9) Uani 1 1 d .
H12 H -0.4418 0.1919 -0.1292 0.027 Uiso 1 1 calc R
C17 C 0.4708(4) -0.1222(2) -0.0497(2) 0.0203(9) Uani 1 1 d .
C18 C 0.4120(4) -0.1989(2) -0.0888(2) 0.0191(9) Uani 1 1 d .
C19 C 0.4719(4) -0.2771(2) -0.0772(2) 0.0189(9) Uani 1 1 d .
C20 C 0.5824(4) -0.2946(2) -0.0232(2) 0.0238(9) Uani 1 1 d .
H20 H 0.6244 -0.2518 0.0071 0.029 Uiso 1 1 calc R
C21 C 0.6290(4) -0.3731(2) -0.0145(3) 0.0283(10) Uani 1 1 d .
H21 H 0.7011 -0.3848 0.0232 0.034 Uiso 1 1 calc R
C22 C 0.5708(5) -0.4362(3) -0.0609(3) 0.0308(11) Uani 1 1 d .
H22 H 0.6060 -0.4900 -0.0552 0.037 Uiso 1 1 calc R
C23 C 0.4648(5) -0.4220(2) -0.1138(3) 0.0282(10) Uani 1 1 d .
H23 H 0.4259 -0.4652 -0.1449 0.034 Uiso 1 1 calc R
C24 C 0.4144(4) -0.3424(2) -0.1216(2) 0.0230(9) Uani 1 1 d .
C25 C 0.2977(4) -0.1898(2) -0.1374(2) 0.0180(8) Uani 1 1 d .
H25 H 0.2542 -0.1382 -0.1405 0.022 Uiso 1 1 calc R
C26 C 0.2440(4) -0.2547(2) -0.1822(2) 0.0199(9) Uani 1 1 d .
C27 C 0.1242(4) -0.2453(2) -0.2369(2) 0.0212(9) Uani 1 1 d .
C32 C 0.0762(4) -0.1666(3) -0.2551(3) 0.0297(11) Uani 1 1 d .
H32 H 0.1223 -0.1200 -0.2337 0.036 Uiso 1 1 calc R
C31 C -0.0397(4) -0.1570(3) -0.3049(3) 0.0348(12) Uani 1 1 d .
H31 H -0.0726 -0.1038 -0.3170 0.042 Uiso 1 1 calc R
C30 C -0.1072(4) -0.2245(3) -0.3367(3) 0.0353(12) Uani 1 1 d .
H30 H -0.1855 -0.2179 -0.3710 0.042 Uiso 1 1 calc R
C29 C -0.0589(5) -0.3015(3) -0.3178(3) 0.0348(12) Uani 1 1 d .
H29 H -0.1049 -0.3480 -0.3394 0.042 Uiso 1 1 calc R
C28 C 0.0547(4) -0.3121(3) -0.2682(3) 0.0297(10) Uani 1 1 d .
H28 H 0.0855 -0.3657 -0.2555 0.036 Uiso 1 1 calc R
HN2 H 0.280(5) -0.367(3) -0.202(3) 0.038(14) Uiso 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Tm Tm -0.3139 5.2483 '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'
H H 0.0000 0.0000 '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
O2 Tm1 O3 89.86(11) 3 .
O2 Tm1 O4 157.19(11) 3 3_655
O3 Tm1 O4 94.90(10) . 3_655
O2 Tm1 O1 97.40(10) 3 .
O3 Tm1 O1 159.45(10) . .
O4 Tm1 O1 85.83(10) 3_655 .
O2 Tm1 O8 77.21(11) 3 .
O3 Tm1 O8 78.88(10) . .
O4 Tm1 O8 125.59(10) 3_655 .
O1 Tm1 O8 84.00(10) . .
O2 Tm1 O9 130.41(11) 3 .
O3 Tm1 O9 79.37(10) . .
O4 Tm1 O9 72.39(10) 3_655 .
O1 Tm1 O9 81.31(10) . .
O8 Tm1 O9 53.26(10) . .
O2 Tm1 O6 80.40(11) 3 .
O3 Tm1 O6 127.69(9) . .
O4 Tm1 O6 79.05(10) 3_655 .
O1 Tm1 O6 72.67(9) . .
O8 Tm1 O6 145.09(10) . .
O9 Tm1 O6 142.45(9) . .
O2 Tm1 O5 78.85(10) 3 .
O3 Tm1 O5 75.44(10) . .
O4 Tm1 O5 80.80(10) 3_655 .
O1 Tm1 O5 124.78(10) . .
O8 Tm1 O5 144.66(9) . .
O9 Tm1 O5 141.16(10) . .
O6 Tm1 O5 52.26(9) . .
O2 Tm1 N4 103.84(11) 3 .
O3 Tm1 N4 75.86(10) . .
O4 Tm1 N4 98.95(11) 3_655 .
O1 Tm1 N4 83.73(10) . .
O8 Tm1 N4 26.82(10) . .
O9 Tm1 N4 26.57(9) . .
O6 Tm1 N4 156.38(9) . .
O5 Tm1 N4 151.16(10) . .
O2 Tm1 N3 77.00(11) 3 .
O3 Tm1 N3 101.82(10) . .
O4 Tm1 N3 80.20(10) 3_655 .
O1 Tm1 N3 98.55(10) . .
O8 Tm1 N3 154.20(10) . .
O9 Tm1 N3 152.54(9) . .
O6 Tm1 N3 25.89(9) . .
O5 Tm1 N3 26.44(9) . .
N4 Tm1 N3 177.48(10) . .
C1 O1 Tm1 130.2(2) . .
C1 O2 Tm1 166.1(3) . 3
C17 O4 Tm1 136.5(3) . 3_655
C17 O3 Tm1 166.3(3) . .
N3 O6 Tm1 96.1(2) . .
N3 O5 Tm1 94.9(2) . .
N4 O8 Tm1 96.3(2) . .
N4 O9 Tm1 95.6(2) . .
C10 N1 C8 117.3(3) . .
C26 N2 C24 124.7(3) . .
C26 N2 HN2 120(3) . .
C24 N2 HN2 115(3) . .
O7 N3 O6 122.2(4) . .
O7 N3 O5 121.4(3) . .
O6 N3 O5 116.4(4) . .
O7 N3 Tm1 176.0(3) . .
O6 N3 Tm1 58.0(2) . .
O5 N3 Tm1 58.7(2) . .
O10 N4 O9 123.1(4) . .
O10 N4 O8 122.6(4) . .
O9 N4 O8 114.3(4) . .
O10 N4 Tm1 174.6(3) . .
O9 N4 Tm1 57.9(2) . .
O8 N4 Tm1 56.9(2) . .
O2 C1 O1 124.0(3) . .
O2 C1 C2 117.0(3) . .
O1 C1 C2 119.0(3) . .
C9 C2 C3 118.9(3) . .
C9 C2 C1 116.7(3) . .
C3 C2 C1 124.4(3) . .
C2 C3 C4 124.8(3) . .
C2 C3 C8 116.8(3) . .
C4 C3 C8 118.3(3) . .
C5 C4 C3 120.3(4) . .
C5 C4 H4 119.8 . .
C3 C4 H4 119.8 . .
C4 C5 C6 121.2(4) . .
C4 C5 H5 119.4 . .
C6 C5 H5 119.4 . .
C7 C6 C5 120.1(4) . .
C7 C6 H6 119.9 . .
C5 C6 H6 119.9 . .
C6 C7 C8 120.4(4) . .
C6 C7 H7 119.8 . .
C8 C7 H7 119.8 . .
N1 C8 C7 117.1(3) . .
N1 C8 C3 123.4(3) . .
C7 C8 C3 119.5(4) . .
C2 C9 C10 120.4(3) . .
C2 C9 H9 119.8 . .
C10 C9 H9 119.8 . .
N1 C10 C9 123.0(3) . .
N1 C10 C11 117.7(3) . .
C9 C10 C11 119.3(3) . .
C16 C11 C12 119.5(4) . .
C16 C11 C10 119.9(3) . .
C12 C11 C10 120.6(3) . .
C11 C16 C15 119.8(4) . .
C11 C16 H16 120.1 . .
C15 C16 H16 120.1 . .
C14 C15 C16 120.8(4) . .
C14 C15 H15 119.6 . .
C16 C15 H15 119.6 . .
C15 C14 C13 119.6(4) . .
C15 C14 H14 120.2 . .
C13 C14 H14 120.2 . .
C12 C13 C14 120.2(4) . .
C12 C13 H13 119.9 . .
C14 C13 H13 119.9 . .
C13 C12 C11 120.1(4) . .
C13 C12 H12 120.0 . .
C11 C12 H12 120.0 . .
O3 C17 O4 127.1(3) . .
O3 C17 C18 117.8(3) . .
O4 C17 C18 115.0(4) . .
C25 C18 C19 120.5(3) . .
C25 C18 C17 117.0(3) . .
C19 C18 C17 122.5(3) . .
C24 C19 C20 117.8(4) . .
C24 C19 C18 117.2(3) . .
C20 C19 C18 125.0(4) . .
C21 C20 C19 120.2(4) . .
C21 C20 H20 119.9 . .
C19 C20 H20 119.9 . .
C20 C21 C22 120.4(4) . .
C20 C21 H21 119.8 . .
C22 C21 H21 119.8 . .
C23 C22 C21 121.3(4) . .
C23 C22 H22 119.3 . .
C21 C22 H22 119.3 . .
C22 C23 C24 118.6(4) . .
C22 C23 H23 120.7 . .
C24 C23 H23 120.7 . .
N2 C24 C23 119.5(4) . .
N2 C24 C19 118.8(3) . .
C23 C24 C19 121.7(4) . .
C18 C25 C26 121.4(4) . .
C18 C25 H25 119.3 . .
C26 C25 H25 119.3 . .
N2 C26 C25 117.2(3) . .
N2 C26 C27 120.7(3) . .
C25 C26 C27 122.1(4) . .
C28 C27 C32 119.2(4) . .
C28 C27 C26 121.7(4) . .
C32 C27 C26 119.1(3) . .
C31 C32 C27 119.6(4) . .
C31 C32 H32 120.2 . .
C27 C32 H32 120.2 . .
C30 C31 C32 120.6(4) . .
C30 C31 H31 119.7 . .
C32 C31 H31 119.7 . .
C29 C30 C31 119.0(4) . .
C29 C30 H30 120.5 . .
C31 C30 H30 120.5 . .
C28 C29 C30 121.2(4) . .
C28 C29 H29 119.4 . .
C30 C29 H29 119.4 . .
C29 C28 C27 120.4(4) . .
C29 C28 H28 119.8 . .
C27 C28 H28 119.8 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Tm1 O2 2.203(3) 3
Tm1 O3 2.238(3) .
Tm1 O4 2.263(2) 3_655
Tm1 O1 2.264(3) .
Tm1 O8 2.399(3) .
Tm1 O9 2.423(3) .
Tm1 O6 2.438(3) .
Tm1 O5 2.450(3) .
Tm1 N4 2.847(4) .
Tm1 N3 2.858(4) .
O1 C1 1.259(4) .
O2 C1 1.252(4) .
O2 Tm1 2.203(3) 3
O4 C17 1.260(5) .
O4 Tm1 2.263(2) 3_655
O3 C17 1.239(5) .
O6 N3 1.255(4) .
O5 N3 1.278(5) .
O7 N3 1.232(5) .
O8 N4 1.293(5) .
O9 N4 1.280(4) .
O10 N4 1.207(5) .
N1 C10 1.322(5) .
N1 C8 1.380(5) .
N2 C26 1.338(5) .
N2 C24 1.378(5) .
N2 HN2 0.85(5) .
C1 C2 1.509(5) .
C2 C9 1.371(5) .
C2 C3 1.421(5) .
C3 C4 1.423(5) .
C3 C8 1.427(5) .
C4 C5 1.365(5) .
C4 H4 0.9500 .
C5 C6 1.400(6) .
C5 H5 0.9500 .
C6 C7 1.372(6) .
C6 H6 0.9500 .
C7 C8 1.410(5) .
C7 H7 0.9500 .
C9 C10 1.416(5) .
C9 H9 0.9500 .
C10 C11 1.494(5) .
C11 C16 1.389(5) .
C11 C12 1.405(5) .
C16 C15 1.392(5) .
C16 H16 0.9500 .
C15 C14 1.386(6) .
C15 H15 0.9500 .
C14 C13 1.391(6) .
C14 H14 0.9500 .
C13 C12 1.388(5) .
C13 H13 0.9500 .
C12 H12 0.9500 .
C17 C18 1.521(5) .
C18 C25 1.372(5) .
C18 C19 1.421(5) .
C19 C24 1.408(5) .
C19 C20 1.416(5) .
C20 C21 1.372(5) .
C20 H20 0.9500 .
C21 C22 1.403(6) .
C21 H21 0.9500 .
C22 C23 1.363(6) .
C22 H22 0.9500 .
C23 C24 1.401(5) .
C23 H23 0.9500 .
C25 C26 1.394(5) .
C25 H25 0.9500 .
C26 C27 1.473(5) .
C27 C28 1.383(5) .
C27 C32 1.402(6) .
C32 C31 1.396(6) .
C32 H32 0.9500 .
C31 C30 1.385(6) .
C31 H31 0.9500 .
C30 C29 1.379(7) .
C30 H30 0.9500 .
C29 C28 1.379(6) .
C29 H29 0.9500 .
C28 H28 0.9500 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
N2 HN2 O7 0.85(5) 2.15(5) 2.983(4) 167(4) 4
