#------------------------------------------------------------------------------
#$Date: 2016-03-26 16:21:16 +0100 (Sat 26 de Mar de 2016) $
#$Revision: 180389 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/58/7205866.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_7205866
loop_
_publ_author_name
'Chen, Min'
'Chen, Man-Sheng'
'Okamura, Taka-aki'
'Lv, Mei-Fang'
'Sun, Wei-Yin'
'Ueyama, Norikazu'
_publ_section_title
;
 A series of silver(i)--lanthanide(iii) heterometallic coordination
 polymers: syntheses, structures and photoluminescent properties
;
_journal_issue                   11
_journal_name_full               CrystEngComm
_journal_page_first              3801
_journal_paper_doi               10.1039/c0ce00921k
_journal_volume                  13
_journal_year                    2011
_chemical_formula_moiety         'C20 H14 Ag Er N6 O10'
_chemical_formula_sum            'C20 H14 Ag Er N6 O10'
_chemical_formula_weight         773.50
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_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_date             2011-03-03
_audit_creation_method           SHELXL-97
_cell_angle_alpha                92.161(14)
_cell_angle_beta                 92.420(13)
_cell_angle_gamma                109.510(12)
_cell_formula_units_Z            2
_cell_length_a                   7.580(2)
_cell_length_b                   9.975(3)
_cell_length_c                   14.591(6)
_cell_measurement_reflns_used    9640
_cell_measurement_temperature    200
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.1
_cell_volume                     1037.4(6)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SIR92 (Altomare et al., 1994)'
_diffrn_ambient_temperature      200
_diffrn_detector_area_resol_mean 10.000
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID II'
_diffrn_measurement_method       ω
_diffrn_radiation_source
;
MicroMax-007HF microfocus rotating anode X-ray generator
;
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0221
_diffrn_reflns_av_sigmaI/netI    0.0236
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            9743
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.11
_exptl_absorpt_coefficient_mu    5.040
_exptl_absorpt_correction_T_max  0.7867
_exptl_absorpt_correction_T_min  0.5185
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'ABSCOR (Rigaku, 1995)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.477
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             742
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.402
_refine_diff_density_min         -0.564
_refine_diff_density_rms         0.161
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.159
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     356
_refine_ls_number_reflns         4654
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.159
_refine_ls_R_factor_all          0.0205
_refine_ls_R_factor_gt           0.0192
_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)+(0.0258P)²+0.6693P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0474
_refine_ls_wR_factor_ref         0.0477
_reflns_number_gt                4521
_reflns_number_total             4654
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c0ce00921k.txt
_cod_data_source_block           7
_cod_original_cell_volume        1037.3(6)
_cod_database_code               7205866
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Er1 Er 0.467328(13) 0.516862(10) 0.282746(6) 0.00887(4) Uani 1 1 d . . .
Ag1 Ag -0.04190(3) 0.01656(3) 0.878315(14) 0.02643(6) Uani 1 1 d . . .
O1 O 0.3258(3) 0.3482(2) 0.39428(12) 0.0193(4) Uani 1 1 d . . .
O2 O 0.4542(3) 0.27387(19) 0.27941(12) 0.0174(4) Uani 1 1 d . . .
O3 O 0.4637(2) -0.24021(19) 0.27627(11) 0.0142(3) Uani 1 1 d . . .
O4 O 0.3352(2) -0.36766(19) 0.39073(12) 0.0151(3) Uani 1 1 d . . .
O5 O 0.2659(2) 0.4241(2) -0.21279(13) 0.0249(4) Uani 1 1 d . . .
O6 O -0.0133(3) 0.2836(2) -0.27100(12) 0.0240(4) Uani 1 1 d . . .
O7 O 0.3826(2) 0.4847(2) 0.12521(12) 0.0232(4) Uani 1 1 d . . .
O8 O 0.1507(2) 0.4270(2) 0.21656(12) 0.0186(4) Uani 1 1 d . . .
O9 O 0.6932(3) 0.5796(2) 0.40779(13) 0.0246(4) Uani 1 1 d D . .
H11 H 0.787(3) 0.557(4) 0.401(2) 0.030 Uiso 1 1 d D . .
H12 H 0.685(5) 0.590(4) 0.4634(8) 0.030 Uiso 1 1 d D . .
O10 O 0.9563(3) 0.4541(3) 0.39073(17) 0.0343(5) Uani 1 1 d D . .
H13 H 1.059(4) 0.498(4) 0.423(2) 0.041 Uiso 1 1 d D . .
H14 H 0.986(5) 0.436(4) 0.3352(16) 0.041 Uiso 1 1 d D . .
N112 N -0.7047(3) 0.0931(2) 0.05303(14) 0.0157(4) Uani 1 1 d . . .
N113 N -0.7339(3) 0.0972(2) -0.04074(14) 0.0168(4) Uani 1 1 d . . .
N111 N -0.4324(3) 0.1943(2) -0.00372(13) 0.0125(4) Uani 1 1 d . . .
N12 N 0.1030(3) -0.0021(3) 0.75397(15) 0.0201(4) Uani 1 1 d . . .
N13 N 0.1754(3) -0.1133(3) 0.75910(15) 0.0232(5) Uani 1 1 d . . .
N11 N 0.1821(3) -0.0451(2) 0.61733(13) 0.0137(4) Uani 1 1 d . . .
C1 C 0.2309(3) -0.0319(3) 0.52416(15) 0.0117(4) Uani 1 1 d . . .
C2 C 0.2623(3) 0.0960(3) 0.48276(16) 0.0125(4) Uani 1 1 d . . .
H1 H 0.2415 0.1738 0.5145 0.015 Uiso 1 1 calc R . .
C3 C 0.3247(3) 0.1091(2) 0.39397(16) 0.0116(4) Uani 1 1 d . . .
C4 C 0.3582(3) -0.0044(3) 0.34796(15) 0.0120(4) Uani 1 1 d . . .
H2 H 0.4013 0.0049 0.2876 0.014 Uiso 1 1 calc R . .
C5 C 0.3279(3) -0.1314(2) 0.39116(15) 0.0111(4) Uani 1 1 d . . .
C6 C 0.2596(3) -0.1470(3) 0.47837(16) 0.0128(4) Uani 1 1 d . . .
H3 H 0.2328 -0.2355 0.5065 0.015 Uiso 1 1 calc R . .
C11 C 0.1107(3) 0.0382(3) 0.67011(16) 0.0161(5) Uani 1 1 d . . .
H4 H 0.0726 0.1138 0.6489 0.019 Uiso 1 1 calc R . .
C12 C 0.2190(4) -0.1365(3) 0.67666(17) 0.0198(5) Uani 1 1 d . . .
H5 H 0.2703 -0.2080 0.6595 0.024 Uiso 1 1 calc R . .
C31 C 0.3691(3) 0.2512(3) 0.35304(16) 0.0128(4) Uani 1 1 d . . .
C51 C 0.3754(3) -0.2538(2) 0.34904(15) 0.0112(4) Uani 1 1 d . . .
C101 C -0.2342(3) 0.2572(3) -0.01236(15) 0.0116(4) Uani 1 1 d . . .
C102 C -0.1141(3) 0.3098(3) 0.06503(16) 0.0130(4) Uani 1 1 d . . .
H6 H -0.1619 0.3038 0.1245 0.016 Uiso 1 1 calc R . .
C103 C 0.0771(3) 0.3714(3) 0.05434(16) 0.0121(4) Uani 1 1 d . . .
C104 C 0.1487(3) 0.3833(2) -0.03271(16) 0.0121(4) Uani 1 1 d . . .
H7 H 0.2794 0.4267 -0.0392 0.015 Uiso 1 1 calc R . .
C105 C 0.0274(3) 0.3312(3) -0.10998(15) 0.0116(4) Uani 1 1 d . . .
C106 C -0.1644(3) 0.2661(3) -0.09980(16) 0.0122(4) Uani 1 1 d . . .
H8 H -0.2471 0.2280 -0.1523 0.015 Uiso 1 1 calc R . .
C111 C -0.5246(3) 0.1518(3) 0.07335(16) 0.0169(5) Uani 1 1 d . . .
H9 H -0.4668 0.1630 0.1335 0.020 Uiso 1 1 calc R . .
C112 C -0.5701(3) 0.1585(3) -0.07285(16) 0.0168(5) Uani 1 1 d . . .
H10 H -0.5492 0.1759 -0.1357 0.020 Uiso 1 1 calc R . .
C131 C 0.0966(3) 0.3462(3) -0.20632(16) 0.0142(5) Uani 1 1 d . . .
C151 C 0.2099(3) 0.4307(3) 0.13692(16) 0.0128(4) Uani 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'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ag Ag -0.8971 1.1015 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Er Er -0.2586 4.9576 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O5 Er1 O7 74.23(7) 2_665 . ?
O5 Er1 O4 135.10(7) 2_665 1_565 ?
O7 Er1 O4 124.65(7) . 1_565 ?
O5 Er1 O9 77.75(7) 2_665 . ?
O7 Er1 O9 151.98(7) . . ?
O4 Er1 O9 76.75(7) 1_565 . ?
O5 Er1 O2 90.15(7) 2_665 . ?
O7 Er1 O2 87.94(7) . . ?
O4 Er1 O2 126.90(6) 1_565 . ?
O9 Er1 O2 91.93(7) . . ?
O5 Er1 O1 134.94(7) 2_665 . ?
O7 Er1 O1 124.33(7) . . ?
O4 Er1 O1 72.38(6) 1_565 . ?
O9 Er1 O1 76.69(8) . . ?
O2 Er1 O1 54.57(6) . . ?
O5 Er1 O8 128.95(7) 2_665 . ?
O7 Er1 O8 54.78(6) . . ?
O4 Er1 O8 83.07(6) 1_565 . ?
O9 Er1 O8 153.17(7) . . ?
O2 Er1 O8 86.15(7) . . ?
O1 Er1 O8 80.49(7) . . ?
O5 Er1 O3 90.66(7) 2_665 1_565 ?
O7 Er1 O3 88.21(7) . 1_565 ?
O4 Er1 O3 54.44(6) 1_565 1_565 ?
O9 Er1 O3 92.37(7) . 1_565 ?
O2 Er1 O3 175.70(6) . 1_565 ?
O1 Er1 O3 126.75(6) . 1_565 ?
O8 Er1 O3 90.07(7) . 1_565 ?
O5 Er1 C151 101.47(7) 2_665 . ?
O7 Er1 C151 27.39(7) . . ?
O4 Er1 C151 105.67(7) 1_565 . ?
O9 Er1 C151 176.89(7) . . ?
O2 Er1 C151 85.05(7) . . ?
O1 Er1 C151 102.06(8) . . ?
O8 Er1 C151 27.48(7) . . ?
O3 Er1 C151 90.66(7) 1_565 . ?
O5 Er1 C31 113.40(8) 2_665 . ?
O7 Er1 C31 107.51(7) . . ?
O4 Er1 C31 99.60(7) 1_565 . ?
O9 Er1 C31 83.38(8) . . ?
O2 Er1 C31 27.34(6) . . ?
O1 Er1 C31 27.23(6) . . ?
O8 Er1 C31 82.75(7) . . ?
O3 Er1 C31 153.84(6) 1_565 . ?
C151 Er1 C31 94.23(7) . . ?
O5 Er1 C51 114.20(8) 2_665 1_565 ?
O7 Er1 C51 107.34(7) . 1_565 ?
O4 Er1 C51 27.11(7) 1_565 1_565 ?
O9 Er1 C51 84.32(7) . 1_565 ?
O2 Er1 C51 153.75(7) . 1_565 ?
O1 Er1 C51 99.44(7) . 1_565 ?
O8 Er1 C51 85.70(7) . 1_565 ?
O3 Er1 C51 27.33(6) 1_565 1_565 ?
C151 Er1 C51 98.72(7) . 1_565 ?
C31 Er1 C51 126.61(7) . 1_565 ?
N112 Ag1 N12 140.91(8) 2_456 . ?
N112 Ag1 N113 121.85(8) 2_456 1_656 ?
N12 Ag1 N113 86.69(8) . 1_656 ?
C31 O1 Er1 91.99(15) . . ?
C31 O2 Er1 92.47(14) . . ?
C51 O3 Er1 90.57(14) . 1_545 ?
C51 O4 Er1 94.24(14) . 1_545 ?
C131 O5 Er1 151.44(17) . 2_665 ?
C151 O7 Er1 93.85(14) . . ?
C151 O8 Er1 90.71(14) . . ?
Er1 O9 H11 116(3) . . ?
Er1 O9 H12 133(3) . . ?
H11 O9 H12 107(3) . . ?
H13 O10 H14 107(4) . . ?
C111 N112 N113 107.6(2) . . ?
C111 N112 Ag1 138.58(17) . 2_456 ?
N113 N112 Ag1 113.64(15) . 2_456 ?
C112 N113 N112 106.8(2) . . ?
C112 N113 Ag1 129.01(17) . 1_454 ?
N112 N113 Ag1 124.12(15) . 1_454 ?
C111 N111 C112 104.55(19) . . ?
C111 N111 C101 128.2(2) . . ?
C112 N111 C101 127.2(2) . . ?
C11 N12 N13 108.8(2) . . ?
C11 N12 Ag1 138.75(19) . . ?
N13 N12 Ag1 110.62(16) . . ?
C12 N13 N12 105.8(2) . . ?
C11 N11 C12 104.8(2) . . ?
C11 N11 C1 128.9(2) . . ?
C12 N11 C1 125.9(2) . . ?
C2 C1 C6 121.0(2) . . ?
C2 C1 N11 120.6(2) . . ?
C6 C1 N11 118.2(2) . . ?
C1 C2 C3 119.2(2) . . ?
C1 C2 H1 120.4 . . ?
C3 C2 H1 120.4 . . ?
C2 C3 C4 120.4(2) . . ?
C2 C3 C31 118.1(2) . . ?
C4 C3 C31 121.3(2) . . ?
C5 C4 C3 119.5(2) . . ?
C5 C4 H2 120.2 . . ?
C3 C4 H2 120.2 . . ?
C6 C5 C4 120.4(2) . . ?
C6 C5 C51 117.0(2) . . ?
C4 C5 C51 122.4(2) . . ?
C5 C6 C1 119.3(2) . . ?
C5 C6 H3 120.3 . . ?
C1 C6 H3 120.3 . . ?
N12 C11 N11 109.2(2) . . ?
N12 C11 H4 125.4 . . ?
N11 C11 H4 125.4 . . ?
N13 C12 N11 111.4(2) . . ?
N13 C12 H5 124.3 . . ?
N11 C12 H5 124.3 . . ?
O1 C31 O2 121.0(2) . . ?
O1 C31 C3 119.2(2) . . ?
O2 C31 C3 119.8(2) . . ?
O1 C31 Er1 60.78(13) . . ?
O2 C31 Er1 60.20(13) . . ?
C3 C31 Er1 177.17(16) . . ?
O4 C51 O3 120.7(2) . . ?
O4 C51 C5 118.4(2) . . ?
O3 C51 C5 120.7(2) . . ?
O4 C51 Er1 58.64(12) . 1_545 ?
O3 C51 Er1 62.11(12) . 1_545 ?
C5 C51 Er1 176.38(16) . 1_545 ?
C102 C101 C106 120.6(2) . . ?
C102 C101 N111 120.4(2) . . ?
C106 C101 N111 119.0(2) . . ?
C101 C102 C103 119.1(2) . . ?
C101 C102 H6 120.5 . . ?
C103 C102 H6 120.5 . . ?
C102 C103 C104 121.0(2) . . ?
C102 C103 C151 120.2(2) . . ?
C104 C103 C151 118.8(2) . . ?
C105 C104 C103 119.6(2) . . ?
C105 C104 H7 120.2 . . ?
C103 C104 H7 120.2 . . ?
C104 C105 C106 119.8(2) . . ?
C104 C105 C131 121.8(2) . . ?
C106 C105 C131 118.4(2) . . ?
C101 C106 C105 119.9(2) . . ?
C101 C106 H8 120.1 . . ?
C105 C106 H8 120.1 . . ?
N112 C111 N111 110.3(2) . . ?
N112 C111 H9 124.9 . . ?
N111 C111 H9 124.9 . . ?
N113 C112 N111 110.8(2) . . ?
N113 C112 H10 124.6 . . ?
N111 C112 H10 124.6 . . ?
O6 C131 O5 125.6(2) . . ?
O6 C131 C105 118.5(2) . . ?
O5 C131 C105 116.0(2) . . ?
O7 C151 O8 120.3(2) . . ?
O7 C151 C103 118.7(2) . . ?
O8 C151 C103 121.0(2) . . ?
O7 C151 Er1 58.77(12) . . ?
O8 C151 Er1 61.81(12) . . ?
C103 C151 Er1 173.99(16) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Er1 O5 2.2138(19) 2_665 ?
Er1 O7 2.341(2) . ?
Er1 O4 2.3618(17) 1_565 ?
Er1 O9 2.363(2) . ?
Er1 O2 2.3910(19) . ?
Er1 O1 2.404(2) . ?
Er1 O8 2.4081(19) . ?
Er1 O3 2.4378(19) 1_565 ?
Er1 C151 2.732(2) . ?
Er1 C31 2.753(3) . ?
Er1 C51 2.758(2) 1_565 ?
Ag1 N112 2.175(2) 2_456 ?
Ag1 N12 2.194(2) . ?
Ag1 N113 2.436(2) 1_656 ?
O1 C31 1.261(3) . ?
O2 C31 1.265(3) . ?
O3 C51 1.266(3) . ?
O3 Er1 2.4378(19) 1_545 ?
O4 C51 1.261(3) . ?
O4 Er1 2.3618(17) 1_545 ?
O5 C131 1.268(3) . ?
O5 Er1 2.2138(18) 2_665 ?
O6 C131 1.232(3) . ?
O7 C151 1.259(3) . ?
O8 C151 1.261(3) . ?
O9 H11 0.821(10) . ?
O9 H12 0.822(10) . ?
O10 H13 0.862(19) . ?
O10 H14 0.878(19) . ?
N112 C111 1.309(3) . ?
N112 N113 1.381(3) . ?
N112 Ag1 2.175(2) 2_456 ?
N113 C112 1.303(3) . ?
N113 Ag1 2.436(2) 1_454 ?
N111 C111 1.355(3) . ?
N111 C112 1.367(3) . ?
N111 C101 1.435(3) . ?
N12 C11 1.300(3) . ?
N12 N13 1.394(3) . ?
N13 C12 1.294(3) . ?
N11 C11 1.366(3) . ?
N11 C12 1.367(3) . ?
N11 C1 1.423(3) . ?
C1 C2 1.384(3) . ?
C1 C6 1.391(3) . ?
C2 C3 1.394(3) . ?
C2 H1 0.9500 . ?
C3 C4 1.395(3) . ?
C3 C31 1.497(3) . ?
C4 C5 1.390(3) . ?
C4 H2 0.9500 . ?
C5 C6 1.389(3) . ?
C5 C51 1.502(3) . ?
C6 H3 0.9500 . ?
C11 H4 0.9500 . ?
C12 H5 0.9500 . ?
C51 Er1 2.758(2) 1_545 ?
C101 C102 1.389(3) . ?
C101 C106 1.396(3) . ?
C102 C103 1.390(3) . ?
C102 H6 0.9500 . ?
C103 C104 1.396(3) . ?
C103 C151 1.504(3) . ?
C104 C105 1.391(3) . ?
C104 H7 0.9500 . ?
C105 C106 1.397(3) . ?
C105 C131 1.516(3) . ?
C106 H8 0.9500 . ?
C111 H9 0.9500 . ?
C112 H10 0.9500 . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O5 Er1 O1 C31 -44.55(18) 2_665 . . . ?
O7 Er1 O1 C31 57.96(16) . . . . ?
O4 Er1 O1 C31 178.31(16) 1_565 . . . ?
O9 Er1 O1 C31 -101.59(15) . . . . ?
O2 Er1 O1 C31 0.59(13) . . . . ?
O8 Er1 O1 C31 92.63(15) . . . . ?
O3 Er1 O1 C31 175.52(13) 1_565 . . . ?
C151 Er1 O1 C31 75.49(15) . . . . ?
C51 Er1 O1 C31 176.61(14) 1_565 . . . ?
O5 Er1 O2 C31 149.30(15) 2_665 . . . ?
O7 Er1 O2 C31 -136.48(15) . . . . ?
O4 Er1 O2 C31 -3.29(17) 1_565 . . . ?
O9 Er1 O2 C31 71.55(15) . . . . ?
O1 Er1 O2 C31 -0.58(13) . . . . ?
O8 Er1 O2 C31 -81.65(15) . . . . ?
C151 Er1 O2 C31 -109.19(15) . . . . ?
C51 Er1 O2 C31 -9.5(2) 1_565 . . . ?
O5 Er1 O7 C151 173.93(18) 2_665 . . . ?
O4 Er1 O7 C151 -51.67(18) 1_565 . . . ?
O9 Er1 O7 C151 173.44(15) . . . . ?
O2 Er1 O7 C151 83.20(16) . . . . ?
O1 Er1 O7 C151 39.83(18) . . . . ?
O8 Er1 O7 C151 -3.54(14) . . . . ?
O3 Er1 O7 C151 -94.88(16) 1_565 . . . ?
C31 Er1 O7 C151 63.83(17) . . . . ?
C51 Er1 O7 C151 -75.08(17) 1_565 . . . ?
O5 Er1 O8 C151 0.40(19) 2_665 . . . ?
O7 Er1 O8 C151 3.53(14) . . . . ?
O4 Er1 O8 C151 145.42(15) 1_565 . . . ?
O9 Er1 O8 C151 -173.33(16) . . . . ?
O2 Er1 O8 C151 -86.67(15) . . . . ?
O1 Er1 O8 C151 -141.37(16) . . . . ?
O3 Er1 O8 C151 91.29(15) 1_565 . . . ?
C31 Er1 O8 C151 -113.93(16) . . . . ?
C51 Er1 O8 C151 118.30(15) 1_565 . . . ?
C111 N112 N113 C112 -0.1(3) . . . . ?
Ag1 N112 N113 C112 -176.60(17) 2_456 . . . ?
C111 N112 N113 Ag1 -176.46(17) . . . 1_454 ?
Ag1 N112 N113 Ag1 7.0(2) 2_456 . . 1_454 ?
N112 Ag1 N12 C11 90.7(3) 2_456 . . . ?
N113 Ag1 N12 C11 -129.2(3) 1_656 . . . ?
N112 Ag1 N12 N13 -71.1(2) 2_456 . . . ?
N113 Ag1 N12 N13 69.02(18) 1_656 . . . ?
C11 N12 N13 C12 -1.5(3) . . . . ?
Ag1 N12 N13 C12 165.93(18) . . . . ?
C11 N11 C1 C2 19.5(4) . . . . ?
C12 N11 C1 C2 -152.0(2) . . . . ?
C11 N11 C1 C6 -165.2(2) . . . . ?
C12 N11 C1 C6 23.3(4) . . . . ?
C6 C1 C2 C3 -0.4(3) . . . . ?
N11 C1 C2 C3 174.8(2) . . . . ?
C1 C2 C3 C4 -1.1(3) . . . . ?
C1 C2 C3 C31 -176.2(2) . . . . ?
C2 C3 C4 C5 0.3(3) . . . . ?
C31 C3 C4 C5 175.3(2) . . . . ?
C3 C4 C5 C6 1.9(3) . . . . ?
C3 C4 C5 C51 -175.0(2) . . . . ?
C4 C5 C6 C1 -3.3(3) . . . . ?
C51 C5 C6 C1 173.7(2) . . . . ?
C2 C1 C6 C5 2.5(3) . . . . ?
N11 C1 C6 C5 -172.7(2) . . . . ?
N13 N12 C11 N11 1.5(3) . . . . ?
Ag1 N12 C11 N11 -160.5(2) . . . . ?
C12 N11 C11 N12 -1.0(3) . . . . ?
C1 N11 C11 N12 -173.9(2) . . . . ?
N12 N13 C12 N11 0.9(3) . . . . ?
C11 N11 C12 N13 0.0(3) . . . . ?
C1 N11 C12 N13 173.2(2) . . . . ?
Er1 O1 C31 O2 -1.1(2) . . . . ?
Er1 O1 C31 C3 176.76(19) . . . . ?
Er1 O2 C31 O1 1.1(2) . . . . ?
Er1 O2 C31 C3 -176.74(19) . . . . ?
C2 C3 C31 O1 -9.3(3) . . . . ?
C4 C3 C31 O1 175.6(2) . . . . ?
C2 C3 C31 O2 168.6(2) . . . . ?
C4 C3 C31 O2 -6.6(3) . . . . ?
O5 Er1 C31 O1 147.24(14) 2_665 . . . ?
O7 Er1 C31 O1 -132.77(14) . . . . ?
O4 Er1 C31 O1 -1.63(15) 1_565 . . . ?
O9 Er1 C31 O1 73.68(15) . . . . ?
O2 Er1 C31 O1 -179.0(2) . . . . ?
O8 Er1 C31 O1 -83.30(15) . . . . ?
O3 Er1 C31 O1 -8.2(2) 1_565 . . . ?
C151 Er1 C31 O1 -108.32(15) . . . . ?
C51 Er1 C31 O1 -4.17(17) 1_565 . . . ?
O5 Er1 C31 O2 -33.80(16) 2_665 . . . ?
O7 Er1 C31 O2 46.19(15) . . . . ?
O4 Er1 C31 O2 177.33(14) 1_565 . . . ?
O9 Er1 C31 O2 -107.36(15) . . . . ?
O1 Er1 C31 O2 179.0(2) . . . . ?
O8 Er1 C31 O2 95.66(14) . . . . ?
O3 Er1 C31 O2 170.81(13) 1_565 . . . ?
C151 Er1 C31 O2 70.64(15) . . . . ?
C51 Er1 C31 O2 174.79(13) 1_565 . . . ?
Er1 O4 C51 O3 -1.7(2) 1_545 . . . ?
Er1 O4 C51 C5 -177.59(17) 1_545 . . . ?
Er1 O3 C51 O4 1.7(2) 1_545 . . . ?
Er1 O3 C51 C5 177.44(18) 1_545 . . . ?
C6 C5 C51 O4 6.4(3) . . . . ?
C4 C5 C51 O4 -176.6(2) . . . . ?
C6 C5 C51 O3 -169.5(2) . . . . ?
C4 C5 C51 O3 7.5(3) . . . . ?
C111 N111 C101 C102 -14.0(4) . . . . ?
C112 N111 C101 C102 169.0(2) . . . . ?
C111 N111 C101 C106 166.7(2) . . . . ?
C112 N111 C101 C106 -10.3(4) . . . . ?
C106 C101 C102 C103 -0.1(4) . . . . ?
N111 C101 C102 C103 -179.4(2) . . . . ?
C101 C102 C103 C104 1.2(4) . . . . ?
C101 C102 C103 C151 179.3(2) . . . . ?
C102 C103 C104 C105 -0.8(4) . . . . ?
C151 C103 C104 C105 -178.9(2) . . . . ?
C103 C104 C105 C106 -0.7(3) . . . . ?
C103 C104 C105 C131 177.7(2) . . . . ?
C102 C101 C106 C105 -1.4(4) . . . . ?
N111 C101 C106 C105 177.9(2) . . . . ?
C104 C105 C106 C101 1.8(4) . . . . ?
C131 C105 C106 C101 -176.7(2) . . . . ?
N113 N112 C111 N111 -0.3(3) . . . . ?
Ag1 N112 C111 N111 174.83(19) 2_456 . . . ?
C112 N111 C111 N112 0.6(3) . . . . ?
C101 N111 C111 N112 -176.9(2) . . . . ?
N112 N113 C112 N111 0.5(3) . . . . ?
Ag1 N113 C112 N111 176.61(16) 1_454 . . . ?
C111 N111 C112 N113 -0.7(3) . . . . ?
C101 N111 C112 N113 176.9(2) . . . . ?
Er1 O5 C131 O6 -28.7(6) 2_665 . . . ?
Er1 O5 C131 C105 151.5(3) 2_665 . . . ?
C104 C105 C131 O6 171.7(2) . . . . ?
C106 C105 C131 O6 -9.9(3) . . . . ?
C104 C105 C131 O5 -8.6(4) . . . . ?
C106 C105 C131 O5 169.9(2) . . . . ?
Er1 O7 C151 O8 6.4(3) . . . . ?
Er1 O7 C151 C103 -173.69(19) . . . . ?
Er1 O8 C151 O7 -6.2(3) . . . . ?
Er1 O8 C151 C103 173.9(2) . . . . ?
C102 C103 C151 O7 179.4(2) . . . . ?
C104 C103 C151 O7 -2.5(3) . . . . ?
C102 C103 C151 O8 -0.7(4) . . . . ?
C104 C103 C151 O8 177.4(2) . . . . ?
O5 Er1 C151 O7 -5.96(17) 2_665 . . . ?
O4 Er1 C151 O7 137.91(16) 1_565 . . . ?
O2 Er1 C151 O7 -95.10(16) . . . . ?
O1 Er1 C151 O7 -147.25(16) . . . . ?
O8 Er1 C151 O7 173.7(3) . . . . ?
O3 Er1 C151 O7 84.84(16) 1_565 . . . ?
C31 Er1 C151 O7 -120.88(16) . . . . ?
C51 Er1 C151 O7 111.07(16) 1_565 . . . ?
O5 Er1 C151 O8 -179.68(15) 2_665 . . . ?
O7 Er1 C151 O8 -173.7(3) . . . . ?
O4 Er1 C151 O8 -35.82(16) 1_565 . . . ?
O2 Er1 C151 O8 91.17(15) . . . . ?
O1 Er1 C151 O8 39.02(16) . . . . ?
O3 Er1 C151 O8 -88.88(15) 1_565 . . . ?
C31 Er1 C151 O8 65.39(15) . . . . ?
C51 Er1 C151 O8 -62.66(16) 1_565 . . . ?
