#------------------------------------------------------------------------------
#$Date: 2025-10-06 12:04:23 +0200 (Mon 06 de Oct de 2025) $
#$Revision: 302709 $
#$URL: svn://www.crystallography.net/cod/cif/1/57/49/1574913.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_1574913
loop_
_publ_author_name
'Peter, Blessing D.'
'Yi, Qiuhao'
'Luo, Zhixun'
_publ_section_title
;
 Studying how small silver clusters grow and their optical properties.
;
_journal_issue                   34
_journal_name_full               Nanoscale
_journal_page_first              19821
_journal_page_last               19827
_journal_paper_doi               10.1039/d5nr01269d
_journal_volume                  17
_journal_year                    2025
_chemical_formula_moiety         'C51 H42 Ag2 N5 O6 P3, 2(C H2 Cl2)'
_chemical_formula_sum            'C53 H46 Ag2 Cl4 N5 O6 P3'
_chemical_formula_weight         1299.40
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2023-12-05
_audit_creation_method
;
Olex2 1.5
(compiled 2023.08.24 svn.re1ec1418 for OlexSys, GUI svn.r6817)
;
_audit_update_record
;
2024-12-26 deposited with the CCDC.	2025-06-19 downloaded from the CCDC.
;
_cell_angle_alpha                96.679(2)
_cell_angle_beta                 92.826(2)
_cell_angle_gamma                116.357(2)
_cell_formula_units_Z            2
_cell_length_a                   12.0794(2)
_cell_length_b                   12.6498(2)
_cell_length_c                   19.7666(4)
_cell_measurement_reflns_used    26923
_cell_measurement_temperature    170.00(10)
_cell_measurement_theta_max      30.6200
_cell_measurement_theta_min      1.8020
_cell_volume                     2670.68(10)
_computing_cell_refinement       'CrysAlisPro 1.171.39.45i (Rigaku OD, 2018)'
_computing_data_collection       'CrysAlisPro 1.171.39.45i (Rigaku OD, 2018)'
_computing_data_reduction        'CrysAlisPro 1.171.39.45i (Rigaku OD, 2018)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      170.00(10)
_diffrn_detector                 'CCD plate'
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.841
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -54.00 -28.00   0.50    0.50    --    5.00  45.00 168.38   52
  2  ω     10.00  78.00   0.50    0.50    --  -10.80  45.00 175.12  136
  3  ω   -100.00  71.00   0.50    0.50    --  -10.80  45.00  48.28  342
  4  ω   -100.00  53.00   0.50    0.50    --  -10.80  45.00 150.00  306
  5  ω     12.00  78.00   0.50    0.50    --  -10.80  45.00 -18.80  132
  6  ω    -65.00  25.00   0.50    0.50    --  -10.80  45.00  90.00  180
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB AFC10 (RCD3): fixed-chi single'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0592083000
_diffrn_orient_matrix_UB_12      -0.0117022000
_diffrn_orient_matrix_UB_13      0.0103850000
_diffrn_orient_matrix_UB_21      -0.0053070000
_diffrn_orient_matrix_UB_22      0.0382295000
_diffrn_orient_matrix_UB_23      -0.0221205000
_diffrn_orient_matrix_UB_31      -0.0285764000
_diffrn_orient_matrix_UB_32      -0.0491236000
_diffrn_orient_matrix_UB_33      -0.0269284000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0244
_diffrn_reflns_av_unetI/netI     0.0279
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.841
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            45683
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.841
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         31.036
_diffrn_reflns_theta_min         1.818
_diffrn_source                   'Rotating-anode X-ray tube'
_diffrn_source_type              'Rigaku (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    1.078
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.90049
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.45i (Rigaku Oxford Diffraction, 2018)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            black
_exptl_crystal_colour_primary    black
_exptl_crystal_density_diffrn    1.616
_exptl_crystal_description       block
_exptl_crystal_F_000             1308
_exptl_crystal_size_max          0.1
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_refine_diff_density_max         1.049
_refine_diff_density_min         -1.045
_refine_diff_density_rms         0.069
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     658
_refine_ls_number_reflns         14366
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.051
_refine_ls_R_factor_all          0.0366
_refine_ls_R_factor_gt           0.0294
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0257P)²+2.0354P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0672
_refine_ls_wR_factor_ref         0.0700
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12311
_reflns_number_total             14366
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d5nr01269d2.cif
_cod_data_source_block           mx11321
_cod_depositor_comments
'Adding full bibliography for 1574898--1574913.cif.'
_cod_original_cell_volume        2670.68(9)
_cod_database_code               1574913
_shelx_shelxl_version_number     2018/3
_chemical_oxdiff_formula         CHAgNOCl
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C52(H52A,H52B), C53(H53A,H53B)
2.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C7(H7), C8(H8), C9(H9), C10(H10), C11(H11),
 C13(H13), C14(H14), C15(H15), C16(H16), C17(H17), C19(H19), C20(H20), C21(H21),
  C22(H22), C24(H24), C25(H25), C26(H26), C27(H27), C28(H28), C30(H30),
 C31(H31), C32(H32), C33(H33), C34(H34), C36(H36), C37(H37), C38(H38), C39(H39),
  C41(H41), C42(H42), C43(H43), C44(H44), C45(H45), C47(H47), C48(H48),
 C49(H49), C50(H50), C51(H51)
;
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.217
_oxdiff_exptl_absorpt_empirical_full_min 0.852
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ag1 Ag 0.27759(2) 0.67269(2) 0.35081(2) 0.02214(4) Uani 1 1 d . . . . .
Ag2 Ag 0.24310(2) 0.71479(2) 0.20274(2) 0.02351(4) Uani 1 1 d . . . . .
P1 P 0.49182(4) 0.77077(4) 0.31193(2) 0.01996(9) Uani 1 1 d . . . . .
P2 P 0.15682(5) 0.46151(4) 0.29902(2) 0.02100(10) Uani 1 1 d . . . . .
P3 P 0.12828(5) 0.79924(4) 0.26362(2) 0.02058(9) Uani 1 1 d . . . . .
O1 O 0.33711(19) 0.70930(15) 0.47489(8) 0.0447(4) Uani 1 1 d . . . . .
O2 O 0.3930(2) 0.63978(17) 0.55703(8) 0.0539(5) Uani 1 1 d . . . . .
O3 O 0.29035(19) 0.52336(15) 0.46441(9) 0.0502(5) Uani 1 1 d . . . . .
O4 O 0.19583(17) 0.72543(15) 0.07785(8) 0.0417(4) Uani 1 1 d . . . . .
O5 O 0.2533(2) 0.86229(18) 0.01465(10) 0.0673(7) Uani 1 1 d . . . . .
O6 O 0.36738(17) 0.88414(18) 0.10658(10) 0.0528(5) Uani 1 1 d . . . . .
N1 N 0.40307(15) 0.67054(15) 0.18240(8) 0.0239(3) Uani 1 1 d . . . . .
N2 N 0.09292(15) 0.50009(14) 0.17518(8) 0.0239(3) Uani 1 1 d . . . . .
N3 N 0.26178(15) 0.85710(14) 0.38610(8) 0.0225(3) Uani 1 1 d . . . . .
N4 N 0.33824(17) 0.62400(15) 0.49885(8) 0.0269(4) Uani 1 1 d . . . . .
N5 N 0.27226(19) 0.82294(18) 0.06635(9) 0.0353(4) Uani 1 1 d . . . . .
C1 C 0.49550(18) 0.68920(17) 0.23002(10) 0.0229(4) Uani 1 1 d . . . . .
C2 C 0.5840(2) 0.6503(2) 0.21708(12) 0.0336(5) Uani 1 1 d . . . . .
H2 H 0.647712 0.663527 0.251970 0.040 Uiso 1 1 calc R U . . .
C3 C 0.5778(3) 0.5916(3) 0.15204(13) 0.0453(6) Uani 1 1 d . . . . .
H3 H 0.636953 0.563432 0.141743 0.054 Uiso 1 1 calc R U . . .
C4 C 0.4846(3) 0.5748(3) 0.10280(12) 0.0462(6) Uani 1 1 d . . . . .
H4 H 0.479073 0.535700 0.057811 0.055 Uiso 1 1 calc R U . . .
C5 C 0.3992(2) 0.6155(2) 0.11961(11) 0.0348(5) Uani 1 1 d . . . . .
H5 H 0.335355 0.604080 0.085314 0.042 Uiso 1 1 calc R U . . .
C6 C 0.61209(18) 0.76906(17) 0.36964(9) 0.0225(4) Uani 1 1 d . . . . .
C7 C 0.5755(2) 0.67670(18) 0.40869(11) 0.0287(4) Uani 1 1 d . . . . .
H7 H 0.491147 0.617719 0.403300 0.034 Uiso 1 1 calc R U . . .
C8 C 0.6603(2) 0.6698(2) 0.45504(11) 0.0348(5) Uani 1 1 d . . . . .
H8 H 0.634743 0.605668 0.480801 0.042 Uiso 1 1 calc R U . . .
C9 C 0.7818(2) 0.7562(2) 0.46380(12) 0.0392(5) Uani 1 1 d . . . . .
H9 H 0.840015 0.752583 0.496378 0.047 Uiso 1 1 calc R U . . .
C10 C 0.8199(2) 0.8484(2) 0.42555(13) 0.0394(5) Uani 1 1 d . . . . .
H10 H 0.904209 0.907534 0.431760 0.047 Uiso 1 1 calc R U . . .
C11 C 0.73563(19) 0.85495(19) 0.37810(11) 0.0309(4) Uani 1 1 d . . . . .
H11 H 0.762297 0.917974 0.351477 0.037 Uiso 1 1 calc R U . . .
C12 C 0.55486(18) 0.92374(17) 0.29444(10) 0.0234(4) Uani 1 1 d . . . . .
C13 C 0.5726(2) 0.9536(2) 0.22927(12) 0.0383(5) Uani 1 1 d . . . . .
H13 H 0.555765 0.893365 0.191175 0.046 Uiso 1 1 calc R U . . .
C14 C 0.6150(3) 1.0716(2) 0.21974(15) 0.0544(7) Uani 1 1 d . . . . .
H14 H 0.626599 1.091630 0.174901 0.065 Uiso 1 1 calc R U . . .
C15 C 0.6404(2) 1.1595(2) 0.27404(16) 0.0491(7) Uani 1 1 d . . . . .
H15 H 0.670465 1.240130 0.266838 0.059 Uiso 1 1 calc R U . . .
C16 C 0.6225(2) 1.1313(2) 0.33899(15) 0.0445(6) Uani 1 1 d . . . . .
H16 H 0.639902 1.192253 0.376767 0.053 Uiso 1 1 calc R U . . .
C17 C 0.5790(2) 1.0135(2) 0.34909(12) 0.0346(5) Uani 1 1 d . . . . .
H17 H 0.565415 0.993909 0.393909 0.042 Uiso 1 1 calc R U . . .
C18 C 0.05262(18) 0.42116(17) 0.21928(9) 0.0225(4) Uani 1 1 d . . . . .
C19 C -0.0549(2) 0.31425(19) 0.20294(11) 0.0315(4) Uani 1 1 d . . . . .
H19 H -0.082481 0.260209 0.235109 0.038 Uiso 1 1 calc R U . . .
C20 C -0.1213(2) 0.2874(2) 0.13920(12) 0.0379(5) Uani 1 1 d . . . . .
H20 H -0.195107 0.214271 0.126972 0.045 Uiso 1 1 calc R U . . .
C21 C -0.0802(2) 0.3667(2) 0.09374(11) 0.0339(5) Uani 1 1 d . . . . .
H21 H -0.124277 0.349619 0.049496 0.041 Uiso 1 1 calc R U . . .
C22 C 0.0268(2) 0.47214(18) 0.11381(10) 0.0287(4) Uani 1 1 d . . . . .
H22 H 0.054874 0.527678 0.082481 0.034 Uiso 1 1 calc R U . . .
C23 C 0.06255(18) 0.35589(18) 0.35282(10) 0.0255(4) Uani 1 1 d . . . . .
C24 C 0.0445(2) 0.23800(19) 0.34416(12) 0.0326(5) Uani 1 1 d . . . . .
H24 H 0.082907 0.211547 0.309848 0.039 Uiso 1 1 calc R U . . .
C25 C -0.0290(2) 0.1596(2) 0.38540(14) 0.0443(6) Uani 1 1 d . . . . .
H25 H -0.039837 0.079837 0.379736 0.053 Uiso 1 1 calc R U . . .
C26 C -0.0861(2) 0.1961(3) 0.43416(14) 0.0496(7) Uani 1 1 d . . . . .
H26 H -0.137251 0.141459 0.461876 0.059 Uiso 1 1 calc R U . . .
C27 C -0.0697(2) 0.3116(3) 0.44328(13) 0.0501(7) Uani 1 1 d . . . . .
H27 H -0.109916 0.336382 0.477201 0.060 Uiso 1 1 calc R U . . .
C28 C 0.0057(2) 0.3928(2) 0.40301(12) 0.0363(5) Uani 1 1 d . . . . .
H28 H 0.017904 0.472952 0.410006 0.044 Uiso 1 1 calc R U . . .
C29 C 0.26189(18) 0.39993(17) 0.27226(10) 0.0243(4) Uani 1 1 d . . . . .
C30 C 0.2693(2) 0.3649(2) 0.20431(11) 0.0325(5) Uani 1 1 d . . . . .
H30 H 0.219027 0.374009 0.169186 0.039 Uiso 1 1 calc R U . . .
C31 C 0.3488(2) 0.3168(2) 0.18685(13) 0.0414(6) Uani 1 1 d . . . . .
H31 H 0.352773 0.293050 0.139998 0.050 Uiso 1 1 calc R U . . .
C32 C 0.4221(2) 0.3033(2) 0.23712(14) 0.0413(6) Uani 1 1 d . . . . .
H32 H 0.476128 0.269605 0.225053 0.050 Uiso 1 1 calc R U . . .
C33 C 0.4172(2) 0.3386(2) 0.30518(13) 0.0389(5) Uani 1 1 d . . . . .
H33 H 0.468201 0.329525 0.339855 0.047 Uiso 1 1 calc R U . . .
C34 C 0.3380(2) 0.38734(19) 0.32327(11) 0.0303(4) Uani 1 1 d . . . . .
H34 H 0.335467 0.412124 0.370171 0.036 Uiso 1 1 calc R U . . .
C35 C 0.21369(18) 0.90272(17) 0.34163(10) 0.0229(4) Uani 1 1 d . . . . .
C36 C 0.2364(2) 1.02121(19) 0.35186(11) 0.0320(5) Uani 1 1 d . . . . .
H36 H 0.200821 1.050539 0.319426 0.038 Uiso 1 1 calc R U . . .
C37 C 0.3111(2) 1.09618(19) 0.40971(11) 0.0364(5) Uani 1 1 d . . . . .
H37 H 0.330257 1.178319 0.417015 0.044 Uiso 1 1 calc R U . . .
C38 C 0.3574(2) 1.04907(19) 0.45656(11) 0.0335(5) Uani 1 1 d . . . . .
H38 H 0.407115 1.097801 0.497481 0.040 Uiso 1 1 calc R U . . .
C39 C 0.3304(2) 0.93002(18) 0.44323(10) 0.0280(4) Uani 1 1 d . . . . .
H39 H 0.361901 0.898211 0.476124 0.034 Uiso 1 1 calc R U . . .
C40 C 0.0677(2) 0.88317(17) 0.21853(10) 0.0257(4) Uani 1 1 d . . . . .
C41 C -0.0436(2) 0.8853(2) 0.23123(12) 0.0345(5) Uani 1 1 d . . . . .
H41 H -0.091199 0.841201 0.264191 0.041 Uiso 1 1 calc R U . . .
C42 C -0.0853(3) 0.9516(2) 0.19586(14) 0.0458(6) Uani 1 1 d . . . . .
H42 H -0.161501 0.952639 0.204503 0.055 Uiso 1 1 calc R U . . .
C43 C -0.0163(3) 1.0160(2) 0.14817(14) 0.0478(6) Uani 1 1 d . . . . .
H43 H -0.045155 1.061119 0.123838 0.057 Uiso 1 1 calc R U . . .
C44 C 0.0939(3) 1.0150(2) 0.13585(13) 0.0429(6) Uani 1 1 d . . . . .
H44 H 0.141227 1.059811 0.103049 0.052 Uiso 1 1 calc R U . . .
C45 C 0.1372(2) 0.94922(19) 0.17074(11) 0.0323(5) Uani 1 1 d . . . . .
H45 H 0.213890 0.949295 0.162040 0.039 Uiso 1 1 calc R U . . .
C46 C -0.00998(18) 0.68365(17) 0.29047(10) 0.0234(4) Uani 1 1 d . . . . .
C47 C -0.0303(2) 0.67053(19) 0.35826(11) 0.0291(4) Uani 1 1 d . . . . .
H47 H 0.029485 0.725403 0.394406 0.035 Uiso 1 1 calc R U . . .
C48 C -0.1379(2) 0.5773(2) 0.37311(12) 0.0358(5) Uani 1 1 d . . . . .
H48 H -0.151242 0.567851 0.419466 0.043 Uiso 1 1 calc R U . . .
C49 C -0.2256(2) 0.4982(2) 0.32087(13) 0.0377(5) Uani 1 1 d . . . . .
H49 H -0.299724 0.435315 0.331378 0.045 Uiso 1 1 calc R U . . .
C50 C -0.2061(2) 0.5100(2) 0.25351(13) 0.0361(5) Uani 1 1 d . . . . .
H50 H -0.266746 0.455132 0.217673 0.043 Uiso 1 1 calc R U . . .
C51 C -0.0985(2) 0.60148(19) 0.23800(11) 0.0300(4) Uani 1 1 d . . . . .
H51 H -0.084610 0.608550 0.191481 0.036 Uiso 1 1 calc R U . . .
Cl1 Cl -0.18957(7) 0.56718(6) 0.03952(3) 0.05072(16) Uani 1 1 d . . . . .
Cl2 Cl -0.10716(11) 0.77379(9) -0.02975(4) 0.0812(3) Uani 1 1 d . . . . .
C52 C -0.0841(3) 0.7192(2) 0.04370(13) 0.0473(6) Uani 1 1 d . . . . .
H52A H -0.094977 0.765930 0.084332 0.057 Uiso 1 1 calc R U . . .
H52B H 0.001984 0.729049 0.049045 0.057 Uiso 1 1 calc R U . . .
Cl3 Cl 0.33801(12) 1.14000(14) -0.03448(11) 0.1487(7) Uani 1 1 d . . . . .
Cl4 Cl 0.56124(12) 1.26995(9) 0.06178(6) 0.0990(4) Uani 1 1 d . . . . .
C53 C 0.4562(3) 1.1322(3) 0.0135(2) 0.0695(9) Uani 1 1 d . . . . .
H53A H 0.502133 1.103259 -0.017538 0.083 Uiso 1 1 calc R U . . .
H53B H 0.419682 1.073286 0.044985 0.083 Uiso 1 1 calc R U . . .
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'
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'
P P 0.1023 0.0942 '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
P1 Ag1 Ag2 72.977(12) . . ?
P2 Ag1 Ag2 82.763(12) . . ?
P2 Ag1 P1 113.120(17) . . ?
O1 Ag1 Ag2 161.56(4) . . ?
O1 Ag1 P1 99.06(5) . . ?
O1 Ag1 P2 115.64(4) . . ?
N3 Ag1 Ag2 86.24(4) . . ?
N3 Ag1 P1 96.49(4) . . ?
N3 Ag1 P2 143.48(4) . . ?
N3 Ag1 O1 78.04(5) . . ?
P3 Ag2 Ag1 76.321(12) . . ?
P3 Ag2 O4 104.61(4) . . ?
P3 Ag2 N2 103.04(4) . . ?
O4 Ag2 Ag1 173.57(4) . . ?
N1 Ag2 Ag1 86.88(4) . . ?
N1 Ag2 P3 157.85(4) . . ?
N1 Ag2 O4 93.71(6) . . ?
N1 Ag2 N2 90.34(6) . . ?
N2 Ag2 Ag1 87.50(4) . . ?
N2 Ag2 O4 86.10(5) . . ?
C1 P1 Ag1 110.10(6) . . ?
C6 P1 Ag1 113.46(7) . . ?
C6 P1 C1 104.82(9) . . ?
C6 P1 C12 104.86(9) . . ?
C12 P1 Ag1 119.82(6) . . ?
C12 P1 C1 102.27(9) . . ?
C18 P2 Ag1 119.99(6) . . ?
C23 P2 Ag1 118.16(7) . . ?
C23 P2 C18 103.31(9) . . ?
C23 P2 C29 101.96(9) . . ?
C29 P2 Ag1 109.99(6) . . ?
C29 P2 C18 100.67(9) . . ?
C35 P3 Ag2 114.54(6) . . ?
C40 P3 Ag2 117.80(7) . . ?
C40 P3 C35 103.15(9) . . ?
C40 P3 C46 103.33(9) . . ?
C46 P3 Ag2 111.05(6) . . ?
C46 P3 C35 105.67(9) . . ?
N4 O1 Ag1 114.99(13) . . ?
N5 O4 Ag2 107.23(13) . . ?
C1 N1 Ag2 124.40(12) . . ?
C5 N1 Ag2 117.08(14) . . ?
C5 N1 C1 118.39(18) . . ?
C18 N2 Ag2 127.00(12) . . ?
C22 N2 Ag2 112.84(13) . . ?
C22 N2 C18 118.07(17) . . ?
C35 N3 Ag1 121.04(12) . . ?
C39 N3 Ag1 119.21(13) . . ?
C39 N3 C35 117.36(16) . . ?
O1 N4 O2 120.11(18) . . ?
O1 N4 O3 120.50(18) . . ?
O3 N4 O2 119.31(18) . . ?
O4 N5 O5 120.0(2) . . ?
O4 N5 O6 120.6(2) . . ?
O6 N5 O5 119.4(2) . . ?
N1 C1 P1 113.20(13) . . ?
N1 C1 C2 122.38(18) . . ?
C2 C1 P1 124.42(16) . . ?
C1 C2 H2 120.7 . . ?
C1 C2 C3 118.6(2) . . ?
C3 C2 H2 120.7 . . ?
C2 C3 H3 120.5 . . ?
C4 C3 C2 118.9(2) . . ?
C4 C3 H3 120.5 . . ?
C3 C4 H4 120.4 . . ?
C3 C4 C5 119.1(2) . . ?
C5 C4 H4 120.4 . . ?
N1 C5 C4 122.5(2) . . ?
N1 C5 H5 118.8 . . ?
C4 C5 H5 118.8 . . ?
C7 C6 P1 116.85(15) . . ?
C11 C6 P1 124.06(15) . . ?
C11 C6 C7 119.07(18) . . ?
C6 C7 H7 119.6 . . ?
C8 C7 C6 120.8(2) . . ?
C8 C7 H7 119.6 . . ?
C7 C8 H8 120.2 . . ?
C9 C8 C7 119.7(2) . . ?
C9 C8 H8 120.2 . . ?
C8 C9 H9 119.8 . . ?
C8 C9 C10 120.4(2) . . ?
C10 C9 H9 119.8 . . ?
C9 C10 H10 119.8 . . ?
C9 C10 C11 120.3(2) . . ?
C11 C10 H10 119.8 . . ?
C6 C11 H11 120.1 . . ?
C10 C11 C6 119.7(2) . . ?
C10 C11 H11 120.1 . . ?
C13 C12 P1 123.30(16) . . ?
C13 C12 C17 118.82(19) . . ?
C17 C12 P1 117.76(16) . . ?
C12 C13 H13 120.1 . . ?
C12 C13 C14 119.8(2) . . ?
C14 C13 H13 120.1 . . ?
C13 C14 H14 119.6 . . ?
C15 C14 C13 120.9(2) . . ?
C15 C14 H14 119.6 . . ?
C14 C15 H15 120.0 . . ?
C14 C15 C16 120.1(2) . . ?
C16 C15 H15 120.0 . . ?
C15 C16 H16 120.2 . . ?
C15 C16 C17 119.6(2) . . ?
C17 C16 H16 120.2 . . ?
C12 C17 H17 119.6 . . ?
C16 C17 C12 120.8(2) . . ?
C16 C17 H17 119.6 . . ?
N2 C18 P2 114.78(14) . . ?
N2 C18 C19 121.79(18) . . ?
C19 C18 P2 123.28(15) . . ?
C18 C19 H19 120.5 . . ?
C20 C19 C18 119.0(2) . . ?
C20 C19 H19 120.5 . . ?
C19 C20 H20 120.2 . . ?
C21 C20 C19 119.5(2) . . ?
C21 C20 H20 120.2 . . ?
C20 C21 H21 120.9 . . ?
C20 C21 C22 118.3(2) . . ?
C22 C21 H21 120.9 . . ?
N2 C22 C21 123.3(2) . . ?
N2 C22 H22 118.4 . . ?
C21 C22 H22 118.4 . . ?
C24 C23 P2 121.68(16) . . ?
C28 C23 P2 119.24(17) . . ?
C28 C23 C24 119.1(2) . . ?
C23 C24 H24 119.9 . . ?
C25 C24 C23 120.2(2) . . ?
C25 C24 H24 119.9 . . ?
C24 C25 H25 119.8 . . ?
C26 C25 C24 120.4(2) . . ?
C26 C25 H25 119.8 . . ?
C25 C26 H26 119.9 . . ?
C25 C26 C27 120.2(2) . . ?
C27 C26 H26 119.9 . . ?
C26 C27 H27 119.8 . . ?
C26 C27 C28 120.4(2) . . ?
C28 C27 H27 119.8 . . ?
C23 C28 C27 119.7(2) . . ?
C23 C28 H28 120.1 . . ?
C27 C28 H28 120.1 . . ?
C30 C29 P2 123.19(15) . . ?
C30 C29 C34 118.69(19) . . ?
C34 C29 P2 118.12(16) . . ?
C29 C30 H30 119.6 . . ?
C29 C30 C31 120.9(2) . . ?
C31 C30 H30 119.6 . . ?
C30 C31 H31 119.9 . . ?
C32 C31 C30 120.2(2) . . ?
C32 C31 H31 119.9 . . ?
C31 C32 H32 120.0 . . ?
C31 C32 C33 120.0(2) . . ?
C33 C32 H32 120.0 . . ?
C32 C33 H33 119.8 . . ?
C32 C33 C34 120.4(2) . . ?
C34 C33 H33 119.8 . . ?
C29 C34 H34 120.0 . . ?
C33 C34 C29 119.9(2) . . ?
C33 C34 H34 120.0 . . ?
N3 C35 P3 114.23(13) . . ?
N3 C35 C36 122.51(18) . . ?
C36 C35 P3 123.05(15) . . ?
C35 C36 H36 120.3 . . ?
C37 C36 C35 119.31(19) . . ?
C37 C36 H36 120.3 . . ?
C36 C37 H37 120.8 . . ?
C38 C37 C36 118.45(19) . . ?
C38 C37 H37 120.8 . . ?
C37 C38 H38 120.5 . . ?
C37 C38 C39 119.1(2) . . ?
C39 C38 H38 120.5 . . ?
N3 C39 C38 123.22(19) . . ?
N3 C39 H39 118.4 . . ?
C38 C39 H39 118.4 . . ?
C41 C40 P3 122.36(16) . . ?
C45 C40 P3 118.22(16) . . ?
C45 C40 C41 119.40(19) . . ?
C40 C41 H41 119.9 . . ?
C42 C41 C40 120.1(2) . . ?
C42 C41 H41 119.9 . . ?
C41 C42 H42 120.0 . . ?
C43 C42 C41 120.1(2) . . ?
C43 C42 H42 120.0 . . ?
C42 C43 H43 120.0 . . ?
C44 C43 C42 120.0(2) . . ?
C44 C43 H43 120.0 . . ?
C43 C44 H44 119.6 . . ?
C43 C44 C45 120.7(2) . . ?
C45 C44 H44 119.6 . . ?
C40 C45 H45 120.2 . . ?
C44 C45 C40 119.6(2) . . ?
C44 C45 H45 120.2 . . ?
C47 C46 P3 124.62(16) . . ?
C47 C46 C51 119.19(19) . . ?
C51 C46 P3 116.15(15) . . ?
C46 C47 H47 120.0 . . ?
C48 C47 C46 120.0(2) . . ?
C48 C47 H47 120.0 . . ?
C47 C48 H48 119.9 . . ?
C49 C48 C47 120.2(2) . . ?
C49 C48 H48 119.9 . . ?
C48 C49 H49 119.9 . . ?
C50 C49 C48 120.3(2) . . ?
C50 C49 H49 119.9 . . ?
C49 C50 H50 120.0 . . ?
C49 C50 C51 120.0(2) . . ?
C51 C50 H50 120.0 . . ?
C46 C51 H51 119.9 . . ?
C50 C51 C46 120.3(2) . . ?
C50 C51 H51 119.9 . . ?
Cl1 C52 H52A 109.4 . . ?
Cl1 C52 H52B 109.4 . . ?
Cl2 C52 Cl1 111.25(15) . . ?
Cl2 C52 H52A 109.4 . . ?
Cl2 C52 H52B 109.4 . . ?
H52A C52 H52B 108.0 . . ?
Cl3 C53 Cl4 113.13(19) . . ?
Cl3 C53 H53A 109.0 . . ?
Cl3 C53 H53B 109.0 . . ?
Cl4 C53 H53A 109.0 . . ?
Cl4 C53 H53B 109.0 . . ?
H53A C53 H53B 107.8 . . ?
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
Ag1 Ag2 3.0761(2) . ?
Ag1 P1 2.5286(5) . ?
Ag1 P2 2.4635(5) . ?
Ag1 O1 2.4523(16) . ?
Ag1 N3 2.4484(15) . ?
Ag2 P3 2.3863(5) . ?
Ag2 O4 2.5386(16) . ?
Ag2 N1 2.2789(16) . ?
Ag2 N2 2.4794(16) . ?
P1 C1 1.8295(19) . ?
P1 C6 1.8118(19) . ?
P1 C12 1.8212(19) . ?
P2 C18 1.8372(19) . ?
P2 C23 1.820(2) . ?
P2 C29 1.829(2) . ?
P3 C35 1.825(2) . ?
P3 C40 1.8175(19) . ?
P3 C46 1.819(2) . ?
O1 N4 1.233(2) . ?
O2 N4 1.247(2) . ?
O3 N4 1.235(2) . ?
O4 N5 1.225(3) . ?
O5 N5 1.242(2) . ?
O6 N5 1.236(2) . ?
N1 C1 1.341(2) . ?
N1 C5 1.339(3) . ?
N2 C18 1.344(2) . ?
N2 C22 1.337(3) . ?
N3 C35 1.345(2) . ?
N3 C39 1.341(2) . ?
C1 C2 1.384(3) . ?
C2 H2 0.9500 . ?
C2 C3 1.389(3) . ?
C3 H3 0.9500 . ?
C3 C4 1.375(4) . ?
C4 H4 0.9500 . ?
C4 C5 1.380(3) . ?
C5 H5 0.9500 . ?
C6 C7 1.393(3) . ?
C6 C11 1.389(3) . ?
C7 H7 0.9500 . ?
C7 C8 1.378(3) . ?
C8 H8 0.9500 . ?
C8 C9 1.373(4) . ?
C9 H9 0.9500 . ?
C9 C10 1.380(4) . ?
C10 H10 0.9500 . ?
C10 C11 1.386(3) . ?
C11 H11 0.9500 . ?
C12 C13 1.384(3) . ?
C12 C17 1.390(3) . ?
C13 H13 0.9500 . ?
C13 C14 1.386(3) . ?
C14 H14 0.9500 . ?
C14 C15 1.367(4) . ?
C15 H15 0.9500 . ?
C15 C16 1.374(4) . ?
C16 H16 0.9500 . ?
C16 C17 1.386(3) . ?
C17 H17 0.9500 . ?
C18 C19 1.385(3) . ?
C19 H19 0.9500 . ?
C19 C20 1.381(3) . ?
C20 H20 0.9500 . ?
C20 C21 1.368(3) . ?
C21 H21 0.9500 . ?
C21 C22 1.379(3) . ?
C22 H22 0.9500 . ?
C23 C24 1.396(3) . ?
C23 C28 1.385(3) . ?
C24 H24 0.9500 . ?
C24 C25 1.384(3) . ?
C25 H25 0.9500 . ?
C25 C26 1.365(4) . ?
C26 H26 0.9500 . ?
C26 C27 1.372(4) . ?
C27 H27 0.9500 . ?
C27 C28 1.396(4) . ?
C28 H28 0.9500 . ?
C29 C30 1.384(3) . ?
C29 C34 1.401(3) . ?
C30 H30 0.9500 . ?
C30 C31 1.385(3) . ?
C31 H31 0.9500 . ?
C31 C32 1.374(3) . ?
C32 H32 0.9500 . ?
C32 C33 1.380(4) . ?
C33 H33 0.9500 . ?
C33 C34 1.388(3) . ?
C34 H34 0.9500 . ?
C35 C36 1.386(3) . ?
C36 H36 0.9500 . ?
C36 C37 1.381(3) . ?
C37 H37 0.9500 . ?
C37 C38 1.377(3) . ?
C38 H38 0.9500 . ?
C38 C39 1.381(3) . ?
C39 H39 0.9500 . ?
C40 C41 1.391(3) . ?
C40 C45 1.391(3) . ?
C41 H41 0.9500 . ?
C41 C42 1.386(3) . ?
C42 H42 0.9500 . ?
C42 C43 1.379(4) . ?
C43 H43 0.9500 . ?
C43 C44 1.371(4) . ?
C44 H44 0.9500 . ?
C44 C45 1.388(3) . ?
C45 H45 0.9500 . ?
C46 C47 1.390(3) . ?
C46 C51 1.397(3) . ?
C47 H47 0.9500 . ?
C47 C48 1.387(3) . ?
C48 H48 0.9500 . ?
C48 C49 1.378(3) . ?
C49 H49 0.9500 . ?
C49 C50 1.377(3) . ?
C50 H50 0.9500 . ?
C50 C51 1.382(3) . ?
C51 H51 0.9500 . ?
Cl1 C52 1.762(3) . ?
Cl2 C52 1.740(3) . ?
C52 H52A 0.9900 . ?
C52 H52B 0.9900 . ?
Cl3 C53 1.721(4) . ?
Cl4 C53 1.757(4) . ?
C53 H53A 0.9900 . ?
C53 H53B 0.9900 . ?
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
Ag1 P1 C1 N1 51.08(15) . . . . ?
Ag1 P1 C1 C2 -129.26(17) . . . . ?
Ag1 P1 C6 C7 27.21(17) . . . . ?
Ag1 P1 C6 C11 -151.09(16) . . . . ?
Ag1 P1 C12 C13 -110.71(18) . . . . ?
Ag1 P1 C12 C17 65.29(18) . . . . ?
Ag1 P2 C18 N2 34.55(16) . . . . ?
Ag1 P2 C18 C19 -149.87(15) . . . . ?
Ag1 P2 C23 C24 -146.26(15) . . . . ?
Ag1 P2 C23 C28 34.70(19) . . . . ?
Ag1 P2 C29 C30 -112.98(17) . . . . ?
Ag1 P2 C29 C34 67.31(17) . . . . ?
Ag1 O1 N4 O2 163.76(16) . . . . ?
Ag1 O1 N4 O3 -12.9(3) . . . . ?
Ag1 N3 C35 P3 14.86(19) . . . . ?
Ag1 N3 C35 C36 -159.95(16) . . . . ?
Ag1 N3 C39 C38 159.88(17) . . . . ?
Ag2 P3 C35 N3 -54.52(16) . . . . ?
Ag2 P3 C35 C36 120.26(17) . . . . ?
Ag2 P3 C40 C41 147.11(16) . . . . ?
Ag2 P3 C40 C45 -34.21(19) . . . . ?
Ag2 P3 C46 C47 114.99(16) . . . . ?
Ag2 P3 C46 C51 -62.96(16) . . . . ?
Ag2 O4 N5 O5 -163.20(19) . . . . ?
Ag2 O4 N5 O6 15.3(3) . . . . ?
Ag2 N1 C1 P1 -6.8(2) . . . . ?
Ag2 N1 C1 C2 173.51(16) . . . . ?
Ag2 N1 C5 C4 -174.2(2) . . . . ?
Ag2 N2 C18 P2 -22.9(2) . . . . ?
Ag2 N2 C18 C19 161.48(15) . . . . ?
Ag2 N2 C22 C21 -164.75(17) . . . . ?
P1 C1 C2 C3 -178.56(19) . . . . ?
P1 C6 C7 C8 -178.56(16) . . . . ?
P1 C6 C11 C10 177.49(17) . . . . ?
P1 C12 C13 C14 176.7(2) . . . . ?
P1 C12 C17 C16 -177.54(18) . . . . ?
P2 C18 C19 C20 -174.30(18) . . . . ?
P2 C23 C24 C25 -179.18(17) . . . . ?
P2 C23 C28 C27 178.19(18) . . . . ?
P2 C29 C30 C31 -178.82(18) . . . . ?
P2 C29 C34 C33 178.63(17) . . . . ?
P3 C35 C36 C37 -174.28(18) . . . . ?
P3 C40 C41 C42 179.43(19) . . . . ?
P3 C40 C45 C44 -179.51(18) . . . . ?
P3 C46 C47 C48 -178.42(16) . . . . ?
P3 C46 C51 C50 179.52(16) . . . . ?
N1 C1 C2 C3 1.1(3) . . . . ?
N2 C18 C19 C20 1.0(3) . . . . ?
N3 C35 C36 C37 0.1(3) . . . . ?
C1 P1 C6 C7 -92.94(16) . . . . ?
C1 P1 C6 C11 88.77(19) . . . . ?
C1 P1 C12 C13 11.3(2) . . . . ?
C1 P1 C12 C17 -172.71(16) . . . . ?
C1 N1 C5 C4 1.8(3) . . . . ?
C1 C2 C3 C4 0.4(4) . . . . ?
C2 C3 C4 C5 -0.7(4) . . . . ?
C3 C4 C5 N1 -0.3(4) . . . . ?
C5 N1 C1 P1 177.54(16) . . . . ?
C5 N1 C1 C2 -2.1(3) . . . . ?
C6 P1 C1 N1 173.44(14) . . . . ?
C6 P1 C1 C2 -6.9(2) . . . . ?
C6 P1 C12 C13 120.48(19) . . . . ?
C6 P1 C12 C17 -63.53(18) . . . . ?
C6 C7 C8 C9 1.2(3) . . . . ?
C7 C6 C11 C10 -0.8(3) . . . . ?
C7 C8 C9 C10 -1.3(3) . . . . ?
C8 C9 C10 C11 0.3(4) . . . . ?
C9 C10 C11 C6 0.7(4) . . . . ?
C11 C6 C7 C8 -0.2(3) . . . . ?
C12 P1 C1 N1 -77.35(16) . . . . ?
C12 P1 C1 C2 102.31(19) . . . . ?
C12 P1 C6 C7 159.74(15) . . . . ?
C12 P1 C6 C11 -18.6(2) . . . . ?
C12 C13 C14 C15 0.4(4) . . . . ?
C13 C12 C17 C16 -1.4(3) . . . . ?
C13 C14 C15 C16 -0.8(4) . . . . ?
C14 C15 C16 C17 0.2(4) . . . . ?
C15 C16 C17 C12 0.9(4) . . . . ?
C17 C12 C13 C14 0.7(4) . . . . ?
C18 P2 C23 C24 78.56(18) . . . . ?
C18 P2 C23 C28 -100.49(18) . . . . ?
C18 P2 C29 C30 14.6(2) . . . . ?
C18 P2 C29 C34 -165.11(16) . . . . ?
C18 N2 C22 C21 0.0(3) . . . . ?
C18 C19 C20 C21 -0.3(4) . . . . ?
C19 C20 C21 C22 -0.5(4) . . . . ?
C20 C21 C22 N2 0.7(3) . . . . ?
C22 N2 C18 P2 174.84(14) . . . . ?
C22 N2 C18 C19 -0.8(3) . . . . ?
C23 P2 C18 N2 168.70(14) . . . . ?
C23 P2 C18 C19 -15.7(2) . . . . ?
C23 P2 C29 C30 120.83(19) . . . . ?
C23 P2 C29 C34 -58.88(17) . . . . ?
C23 C24 C25 C26 1.0(4) . . . . ?
C24 C23 C28 C27 -0.9(3) . . . . ?
C24 C25 C26 C27 -0.8(4) . . . . ?
C25 C26 C27 C28 -0.2(4) . . . . ?
C26 C27 C28 C23 1.1(4) . . . . ?
C28 C23 C24 C25 -0.1(3) . . . . ?
C29 P2 C18 N2 -86.15(15) . . . . ?
C29 P2 C18 C19 89.43(19) . . . . ?
C29 P2 C23 C24 -25.60(19) . . . . ?
C29 P2 C23 C28 155.35(17) . . . . ?
C29 C30 C31 C32 -0.1(4) . . . . ?
C30 C29 C34 C33 -1.1(3) . . . . ?
C30 C31 C32 C33 -0.5(4) . . . . ?
C31 C32 C33 C34 0.3(4) . . . . ?
C32 C33 C34 C29 0.5(3) . . . . ?
C34 C29 C30 C31 0.9(3) . . . . ?
C35 P3 C40 C41 -85.62(19) . . . . ?
C35 P3 C40 C45 93.06(18) . . . . ?
C35 P3 C46 C47 -9.78(19) . . . . ?
C35 P3 C46 C51 172.27(15) . . . . ?
C35 N3 C39 C38 -2.8(3) . . . . ?
C35 C36 C37 C38 -2.2(4) . . . . ?
C36 C37 C38 C39 1.8(4) . . . . ?
C37 C38 C39 N3 0.7(4) . . . . ?
C39 N3 C35 P3 177.17(15) . . . . ?
C39 N3 C35 C36 2.4(3) . . . . ?
C40 P3 C35 N3 176.19(15) . . . . ?
C40 P3 C35 C36 -9.0(2) . . . . ?
C40 P3 C46 C47 -117.80(17) . . . . ?
C40 P3 C46 C51 64.25(16) . . . . ?
C40 C41 C42 C43 -0.2(4) . . . . ?
C41 C40 C45 C44 -0.8(3) . . . . ?
C41 C42 C43 C44 -0.3(4) . . . . ?
C42 C43 C44 C45 0.2(4) . . . . ?
C43 C44 C45 C40 0.3(4) . . . . ?
C45 C40 C41 C42 0.8(3) . . . . ?
C46 P3 C35 N3 68.05(16) . . . . ?
C46 P3 C35 C36 -117.18(18) . . . . ?
C46 P3 C40 C41 24.3(2) . . . . ?
C46 P3 C40 C45 -157.04(17) . . . . ?
C46 C47 C48 C49 -0.7(3) . . . . ?
C47 C46 C51 C50 1.5(3) . . . . ?
C47 C48 C49 C50 1.1(3) . . . . ?
C48 C49 C50 C51 -0.1(3) . . . . ?
C49 C50 C51 C46 -1.1(3) . . . . ?
C51 C46 C47 C48 -0.5(3) . . . . ?
