#------------------------------------------------------------------------------
#$Date: 2016-08-07 11:20:40 +0300 (Sun, 07 Aug 2016) $
#$Revision: 185218 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/50/7225055.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_7225055
loop_
_publ_author_name
'Xu, Bing'
'Cheng, Yue'
'Hu, Huai-Ming'
'Bai, Chao'
'Wang, Xiaofang'
'Yang, Meng-Lin'
'Xue, Ganglin'
_publ_section_title
;
 Syntheses, crystal structures and luminescence properties of
 lanthanide-based coordination polymers constructed from a functionalized
 terpyridyl carboxylate ligand
;
_journal_issue                   24
_journal_name_full               CrystEngComm
_journal_page_first              4613
_journal_paper_doi               10.1039/C6CE00681G
_journal_volume                  18
_journal_year                    2016
_chemical_formula_sum            'C48 H36 N6 O25 Pr2'
_chemical_formula_weight         1378.65
_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
;
2016-01-04 deposited with the CCDC.
2016-04-29 downloaded from the CCDC.
;
_cell_angle_alpha                80.4890(10)
_cell_angle_beta                 81.3630(10)
_cell_angle_gamma                80.3110(10)
_cell_formula_units_Z            1
_cell_length_a                   8.3992(7)
_cell_length_b                   9.6188(8)
_cell_length_c                   17.1946(14)
_cell_measurement_reflns_used    3551
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      26.14
_cell_measurement_theta_min      2.48
_cell_volume                     1339.78(19)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.986
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω 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  0.0176
_diffrn_reflns_av_sigmaI/netI    0.0370
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            6752
_diffrn_reflns_theta_full        25.05
_diffrn_reflns_theta_max         25.05
_diffrn_reflns_theta_min         2.63
_exptl_absorpt_coefficient_mu    1.889
_exptl_absorpt_correction_T_max  0.805
_exptl_absorpt_correction_T_min  0.734
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.709
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             684
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.481
_refine_diff_density_min         -0.446
_refine_diff_density_rms         0.083
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.059
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     391
_refine_ls_number_reflns         4674
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.059
_refine_ls_R_factor_all          0.0320
_refine_ls_R_factor_gt           0.0291
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0319P)²+1.0504P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0684
_refine_ls_wR_factor_ref         0.0698
_reflns_number_gt                4323
_reflns_number_total             4674
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6ce00681g2.cif
_cod_data_source_block           nw1214_0m
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4268 2015-11-12 08:31:59Z antanas 

 Adding full bibliography for 7225046--7225061.cif.
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7225055
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
Pr1 Pr 0.59157(2) 0.772374(19) 0.375397(11) 0.02593(8) Uani 1 1 d .
N1 N 1.0714(4) 0.4675(4) -0.19755(19) 0.0404(8) Uani 1 1 d .
N2 N 0.7137(4) 0.4155(3) 0.06523(16) 0.0269(6) Uani 1 1 d .
N3 N 0.6019(4) 0.0445(3) 0.29745(19) 0.0361(8) Uani 1 1 d .
O1 O 0.3540(3) 0.8448(3) 0.29696(15) 0.0387(6) Uani 1 1 d .
O2 O 0.5859(3) 0.7826(3) 0.22508(15) 0.0366(6) Uani 1 1 d .
O3 O 0.3744(3) 0.9102(3) 0.46019(15) 0.0379(6) Uani 1 1 d .
O4 O 0.3098(3) 1.0824(3) 0.53693(16) 0.0381(6) Uani 1 1 d .
O5 O 0.3929(3) 0.5999(3) 0.42528(15) 0.0389(6) Uani 1 1 d .
O6 O 0.3520(3) 0.3927(3) 0.50095(15) 0.0404(7) Uani 1 1 d .
C1 C 0.9594(5) 0.5837(5) -0.1960(2) 0.0449(10) Uani 1 1 d .
H1 H 0.9610 0.6537 -0.2404 0.054 Uiso 1 1 calc R
C2 C 0.8424(5) 0.6056(4) -0.1328(2) 0.0374(9) Uani 1 1 d .
H2 H 0.7662 0.6879 -0.1355 0.045 Uiso 1 1 calc R
C3 C 0.8376(4) 0.5049(4) -0.0648(2) 0.0269(7) Uani 1 1 d .
C4 C 0.9509(5) 0.3820(4) -0.0675(2) 0.0345(9) Uani 1 1 d .
H4 H 0.9508 0.3092 -0.0246 0.041 Uiso 1 1 calc R
C5 C 1.0632(5) 0.3683(4) -0.1338(2) 0.0392(9) Uani 1 1 d .
H5 H 1.1376 0.2850 -0.1340 0.047 Uiso 1 1 calc R
C6 C 0.7194(4) 0.5269(4) 0.0070(2) 0.0262(7) Uani 1 1 d .
C7 C 0.6222(4) 0.6572(4) 0.0147(2) 0.0276(8) Uani 1 1 d .
H7 H 0.6301 0.7332 -0.0262 0.033 Uiso 1 1 calc R
C8 C 0.5131(4) 0.6748(3) 0.0831(2) 0.0253(7) Uani 1 1 d .
C9 C 0.5060(4) 0.5580(4) 0.1420(2) 0.0270(8) Uani 1 1 d .
H9 H 0.4334 0.5644 0.1882 0.032 Uiso 1 1 calc R
C10 C 0.6087(4) 0.4309(4) 0.1315(2) 0.0256(7) Uani 1 1 d .
C11 C 0.4873(5) 0.1575(4) 0.3053(2) 0.0435(10) Uani 1 1 d .
H11 H 0.4037 0.1491 0.3471 0.052 Uiso 1 1 calc R
C12 C 0.4847(5) 0.2853(4) 0.2557(2) 0.0402(10) Uani 1 1 d .
H12 H 0.4021 0.3605 0.2649 0.048 Uiso 1 1 calc R
C13 C 0.6056(4) 0.3017(4) 0.1921(2) 0.0282(8) Uani 1 1 d .
C14 C 0.7264(5) 0.1848(4) 0.1843(2) 0.0384(9) Uani 1 1 d .
H14 H 0.8116 0.1900 0.1431 0.046 Uiso 1 1 calc R
C15 C 0.7200(5) 0.0619(4) 0.2372(2) 0.0405(10) Uani 1 1 d .
H15 H 0.8032 -0.0140 0.2306 0.049 Uiso 1 1 calc R
C16 C 0.3993(4) 0.8111(4) 0.0873(2) 0.0273(8) Uani 1 1 d .
C17 C 0.3286(5) 0.8728(4) 0.0192(2) 0.0338(8) Uani 1 1 d .
H17 H 0.3605 0.8326 -0.0273 0.041 Uiso 1 1 calc R
C18 C 0.2117(5) 0.9928(4) 0.0193(2) 0.0388(9) Uani 1 1 d .
H18 H 0.1668 1.0336 -0.0269 0.047 Uiso 1 1 calc R
C19 C 0.1630(5) 1.0507(4) 0.0880(3) 0.0428(10) Uani 1 1 d .
H19 H 0.0822 1.1297 0.0889 0.051 Uiso 1 1 calc R
C20 C 0.2327(5) 0.9930(4) 0.1560(2) 0.0388(9) Uani 1 1 d .
H20 H 0.1986 1.0340 0.2022 0.047 Uiso 1 1 calc R
C21 C 0.3533(4) 0.8745(4) 0.1567(2) 0.0282(8) Uani 1 1 d .
C22 C 0.4375(4) 0.8292(4) 0.2306(2) 0.0288(8) Uani 1 1 d .
C23 C 0.4087(4) 0.9988(4) 0.4990(2) 0.0299(8) Uani 1 1 d .
C24 C 0.4263(5) 0.4977(4) 0.4787(2) 0.0315(8) Uani 1 1 d .
O7 O 0.7200(5) 0.5385(3) 0.3341(2) 0.0646(11) Uani 1 1 d D
H7A H 0.776(6) 0.540(6) 0.2893(18) 0.078 Uiso 1 1 d D
H7B H 0.747(7) 0.462(4) 0.363(3) 0.078 Uiso 1 1 d D
O8 O 0.8857(4) 0.7828(3) 0.3385(2) 0.0507(8) Uani 1 1 d D
H8A H 0.930(6) 0.847(4) 0.350(3) 0.061 Uiso 1 1 d D
H8B H 0.960(4) 0.719(4) 0.326(3) 0.061 Uiso 1 1 d D
O9 O 0.1633(5) 0.5844(5) 0.3179(3) 0.0910(14) Uani 1 1 d .
O10 O 0.0548(6) 0.9943(6) 0.3610(4) 0.138(2) Uani 1 1 d .
O11 O 0.8212(8) 0.2574(6) 0.4131(4) 0.138(2) Uani 1 1 d .
O13 O 0.973(2) 0.1240(18) 0.4847(12) 0.205(7) Uani 0.50 1 d P
O12 O 0.1173(19) 0.332(2) 0.4090(10) 0.170(6) Uani 0.50 1 d P
O14 O 0.0355(15) 0.4065(16) 0.4581(10) 0.140(5) Uani 0.50 1 d P
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'
Pr Pr -0.2180 2.8214 '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
O8 Pr1 O6 90.41(10) . 2_666
O8 Pr1 O7 72.71(12) . .
O6 Pr1 O7 73.20(11) 2_666 .
O8 Pr1 O3 132.61(9) . .
O6 Pr1 O3 86.97(9) 2_666 .
O7 Pr1 O3 148.77(10) . .
O8 Pr1 O5 141.93(10) . .
O6 Pr1 O5 64.40(8) 2_666 .
O7 Pr1 O5 72.83(11) . .
O3 Pr1 O5 76.92(9) . .
O8 Pr1 O1 131.99(10) . .
O6 Pr1 O1 135.52(9) 2_666 .
O7 Pr1 O1 103.52(12) . .
O3 Pr1 O1 73.88(9) . .
O5 Pr1 O1 72.20(9) . .
O8 Pr1 O4 69.51(9) . 2_676
O6 Pr1 O4 73.96(9) 2_666 2_676
O7 Pr1 O4 128.90(12) . 2_676
O3 Pr1 O4 64.33(8) . 2_676
O5 Pr1 O4 123.71(9) . 2_676
O1 Pr1 O4 127.27(9) . 2_676
O8 Pr1 O2 84.91(10) . .
O6 Pr1 O2 143.23(9) 2_666 .
O7 Pr1 O2 70.58(10) . .
O3 Pr1 O2 122.27(9) . .
O5 Pr1 O2 98.46(9) . .
O1 Pr1 O2 51.02(8) . .
O4 Pr1 O2 136.24(9) 2_676 .
O8 Pr1 N3 76.25(10) . 1_565
O6 Pr1 N3 144.64(9) 2_666 1_565
O7 Pr1 N3 130.41(10) . 1_565
O3 Pr1 N3 79.09(9) . 1_565
O5 Pr1 N3 140.39(9) . 1_565
O1 Pr1 N3 71.09(9) . 1_565
O4 Pr1 N3 70.71(9) 2_676 1_565
O2 Pr1 N3 69.01(9) . 1_565
C5 N1 C1 116.4(3) . .
C6 N2 C10 118.6(3) . .
C15 N3 C11 115.7(3) . .
C15 N3 Pr1 116.8(2) . 1_545
C11 N3 Pr1 126.6(2) . 1_545
C22 O1 Pr1 94.9(2) . .
C22 O2 Pr1 92.3(2) . .
C23 O3 Pr1 120.9(2) . .
C23 O4 Pr1 120.2(2) . 2_676
C24 O5 Pr1 119.7(2) . .
C24 O6 Pr1 120.5(2) . 2_666
N1 C1 C2 123.7(4) . .
N1 C1 H1 118.2 . .
C2 C1 H1 118.2 . .
C1 C2 C3 120.0(4) . .
C1 C2 H2 120.0 . .
C3 C2 H2 120.0 . .
C4 C3 C2 116.1(3) . .
C4 C3 C6 121.6(3) . .
C2 C3 C6 122.3(3) . .
C5 C4 C3 119.9(4) . .
C5 C4 H4 120.1 . .
C3 C4 H4 120.1 . .
N1 C5 C4 123.8(4) . .
N1 C5 H5 118.1 . .
C4 C5 H5 118.1 . .
N2 C6 C7 121.5(3) . .
N2 C6 C3 116.6(3) . .
C7 C6 C3 121.9(3) . .
C6 C7 C8 120.6(3) . .
C6 C7 H7 119.7 . .
C8 C7 H7 119.7 . .
C9 C8 C7 117.4(3) . .
C9 C8 C16 122.6(3) . .
C7 C8 C16 119.8(3) . .
C8 C9 C10 119.4(3) . .
C8 C9 H9 120.3 . .
C10 C9 H9 120.3 . .
N2 C10 C9 122.5(3) . .
N2 C10 C13 115.5(3) . .
C9 C10 C13 121.9(3) . .
N3 C11 C12 124.4(4) . .
N3 C11 H11 117.8 . .
C12 C11 H11 117.8 . .
C11 C12 C13 119.7(4) . .
C11 C12 H12 120.2 . .
C13 C12 H12 120.2 . .
C12 C13 C14 116.1(3) . .
C12 C13 C10 124.4(3) . .
C14 C13 C10 119.5(3) . .
C15 C14 C13 120.2(4) . .
C15 C14 H14 119.9 . .
C13 C14 H14 119.9 . .
N3 C15 C14 123.9(4) . .
N3 C15 H15 118.0 . .
C14 C15 H15 118.0 . .
C17 C16 C21 118.9(3) . .
C17 C16 C8 117.3(3) . .
C21 C16 C8 123.7(3) . .
C18 C17 C16 121.4(3) . .
C18 C17 H17 119.3 . .
C16 C17 H17 119.3 . .
C19 C18 C17 119.3(4) . .
C19 C18 H18 120.3 . .
C17 C18 H18 120.3 . .
C18 C19 C20 120.5(4) . .
C18 C19 H19 119.7 . .
C20 C19 H19 119.7 . .
C19 C20 C21 121.1(4) . .
C19 C20 H20 119.5 . .
C21 C20 H20 119.5 . .
C20 C21 C16 118.7(3) . .
C20 C21 C22 117.5(3) . .
C16 C21 C22 123.6(3) . .
O2 C22 O1 121.7(3) . .
O2 C22 C21 120.3(3) . .
O1 C22 C21 117.9(3) . .
O4 C23 O3 126.3(4) . .
O4 C23 C23 117.1(4) . 2_676
O3 C23 C23 116.6(4) . 2_676
O6 C24 O5 126.7(4) . .
O6 C24 C24 116.7(4) . 2_666
O5 C24 C24 116.6(4) . 2_666
Pr1 O7 H7A 117(4) . .
Pr1 O7 H7B 128(4) . .
H7A O7 H7B 110(5) . .
Pr1 O8 H8A 122(3) . .
Pr1 O8 H8B 129(4) . .
H8A O8 H8B 107(5) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pr1 O8 2.471(3) .
Pr1 O6 2.490(3) 2_666
Pr1 O7 2.492(3) .
Pr1 O3 2.497(2) .
Pr1 O5 2.511(3) .
Pr1 O1 2.513(3) .
Pr1 O4 2.524(3) 2_676
Pr1 O2 2.577(2) .
Pr1 N3 2.746(3) 1_565
N1 C5 1.331(5) .
N1 C1 1.335(5) .
N2 C6 1.343(4) .
N2 C10 1.345(4) .
N3 C15 1.333(5) .
N3 C11 1.335(5) .
N3 Pr1 2.746(3) 1_545
O1 C22 1.264(4) .
O2 C22 1.247(4) .
O3 C23 1.258(4) .
O4 C23 1.244(4) .
O4 Pr1 2.524(3) 2_676
O5 C24 1.254(4) .
O6 C24 1.253(4) .
O6 Pr1 2.490(3) 2_666
C1 C2 1.370(5) .
C1 H1 0.9300 .
C2 C3 1.390(5) .
C2 H2 0.9300 .
C3 C4 1.390(5) .
C3 C6 1.483(5) .
C4 C5 1.375(5) .
C4 H4 0.9300 .
C5 H5 0.9300 .
C6 C7 1.390(5) .
C7 C8 1.394(5) .
C7 H7 0.9300 .
C8 C9 1.386(5) .
C8 C16 1.492(5) .
C9 C10 1.394(5) .
C9 H9 0.9300 .
C10 C13 1.485(5) .
C11 C12 1.375(5) .
C11 H11 0.9300 .
C12 C13 1.384(5) .
C12 H12 0.9300 .
C13 C14 1.392(5) .
C14 C15 1.371(5) .
C14 H14 0.9300 .
C15 H15 0.9300 .
C16 C17 1.391(5) .
C16 C21 1.403(5) .
C17 C18 1.383(5) .
C17 H17 0.9300 .
C18 C19 1.368(6) .
C18 H18 0.9300 .
C19 C20 1.378(6) .
C19 H19 0.9300 .
C20 C21 1.391(5) .
C20 H20 0.9300 .
C21 C22 1.513(5) .
C23 C23 1.543(7) 2_676
C24 C24 1.541(8) 2_666
O7 H7A 0.84(2) .
O7 H7B 0.84(2) .
O8 H8A 0.839(19) .
O8 H8B 0.827(19) .
O12 O14 1.248(17) .
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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
O8 Pr1 O1 C22 26.2(3) . .
O6 Pr1 O1 C22 -132.2(2) 2_666 .
O7 Pr1 O1 C22 -52.5(2) . .
O3 Pr1 O1 C22 159.7(2) . .
O5 Pr1 O1 C22 -119.2(2) . .
O4 Pr1 O1 C22 121.6(2) 2_676 .
O2 Pr1 O1 C22 -1.90(19) . .
N3 Pr1 O1 C22 76.0(2) 1_565 .
O8 Pr1 O2 C22 -157.5(2) . .
O6 Pr1 O2 C22 118.7(2) 2_666 .
O7 Pr1 O2 C22 129.1(2) . .
O3 Pr1 O2 C22 -19.1(2) . .
O5 Pr1 O2 C22 60.7(2) . .
O1 Pr1 O2 C22 1.92(19) . .
O4 Pr1 O2 C22 -104.4(2) 2_676 .
N3 Pr1 O2 C22 -80.3(2) 1_565 .
O8 Pr1 O3 C23 -5.8(3) . .
O6 Pr1 O3 C23 82.0(3) 2_666 .
O7 Pr1 O3 C23 131.8(3) . .
O5 Pr1 O3 C23 146.4(3) . .
O1 Pr1 O3 C23 -138.6(3) . .
O4 Pr1 O3 C23 8.4(3) 2_676 .
O2 Pr1 O3 C23 -121.7(3) . .
N3 Pr1 O3 C23 -65.3(3) 1_565 .
O8 Pr1 O5 C24 41.1(3) . .
O6 Pr1 O5 C24 -12.1(3) 2_666 .
O7 Pr1 O5 C24 67.1(3) . .
O3 Pr1 O5 C24 -105.1(3) . .
O1 Pr1 O5 C24 177.9(3) . .
O4 Pr1 O5 C24 -58.7(3) 2_676 .
O2 Pr1 O5 C24 133.6(3) . .
N3 Pr1 O5 C24 -159.2(2) 1_565 .
C5 N1 C1 C2 1.4(6) . .
N1 C1 C2 C3 1.2(7) . .
C1 C2 C3 C4 -3.1(6) . .
C1 C2 C3 C6 176.5(4) . .
C2 C3 C4 C5 2.5(5) . .
C6 C3 C4 C5 -177.1(3) . .
C1 N1 C5 C4 -2.0(6) . .
C3 C4 C5 N1 0.0(6) . .
C10 N2 C6 C7 1.3(5) . .
C10 N2 C6 C3 179.7(3) . .
C4 C3 C6 N2 -8.0(5) . .
C2 C3 C6 N2 172.4(3) . .
C4 C3 C6 C7 170.4(3) . .
C2 C3 C6 C7 -9.2(5) . .
N2 C6 C7 C8 -1.2(5) . .
C3 C6 C7 C8 -179.5(3) . .
C6 C7 C8 C9 -0.1(5) . .
C6 C7 C8 C16 -174.5(3) . .
C7 C8 C9 C10 1.3(5) . .
C16 C8 C9 C10 175.5(3) . .
C6 N2 C10 C9 -0.1(5) . .
C6 N2 C10 C13 178.1(3) . .
C8 C9 C10 N2 -1.2(5) . .
C8 C9 C10 C13 -179.3(3) . .
C15 N3 C11 C12 0.6(6) . .
Pr1 N3 C11 C12 -168.4(3) 1_545 .
N3 C11 C12 C13 0.9(7) . .
C11 C12 C13 C14 -1.6(6) . .
C11 C12 C13 C10 175.4(4) . .
N2 C10 C13 C12 -165.6(4) . .
C9 C10 C13 C12 12.7(6) . .
N2 C10 C13 C14 11.3(5) . .
C9 C10 C13 C14 -170.4(3) . .
C12 C13 C14 C15 0.9(6) . .
C10 C13 C14 C15 -176.3(4) . .
C11 N3 C15 C14 -1.3(6) . .
Pr1 N3 C15 C14 168.8(3) 1_545 .
C13 C14 C15 N3 0.6(7) . .
C9 C8 C16 C17 -133.8(4) . .
C7 C8 C16 C17 40.2(5) . .
C9 C8 C16 C21 42.3(5) . .
C7 C8 C16 C21 -143.6(4) . .
C21 C16 C17 C18 -1.6(6) . .
C8 C16 C17 C18 174.7(3) . .
C16 C17 C18 C19 -0.9(6) . .
C17 C18 C19 C20 1.9(6) . .
C18 C19 C20 C21 -0.3(6) . .
C19 C20 C21 C16 -2.2(6) . .
C19 C20 C21 C22 172.7(4) . .
C17 C16 C21 C20 3.1(5) . .
C8 C16 C21 C20 -173.0(3) . .
C17 C16 C21 C22 -171.5(3) . .
C8 C16 C21 C22 12.5(5) . .
Pr1 O2 C22 O1 -3.5(3) . .
Pr1 O2 C22 C21 174.0(3) . .
Pr1 O1 C22 O2 3.6(4) . .
Pr1 O1 C22 C21 -174.0(3) . .
C20 C21 C22 O2 -142.7(4) . .
C16 C21 C22 O2 31.9(5) . .
C20 C21 C22 O1 34.9(5) . .
C16 C21 C22 O1 -150.5(3) . .
Pr1 O4 C23 O3 172.1(3) 2_676 .
Pr1 O4 C23 C23 -6.6(5) 2_676 2_676
Pr1 O3 C23 O4 172.8(3) . .
Pr1 O3 C23 C23 -8.6(5) . 2_676
Pr1 O6 C24 O5 -168.4(3) 2_666 .
Pr1 O6 C24 C24 11.5(5) 2_666 2_666
Pr1 O5 C24 O6 -168.7(3) . .
Pr1 O5 C24 C24 11.5(5) . 2_666
