#------------------------------------------------------------------------------
#$Date: 2021-02-04 04:50:49 +0200 (Thu, 04 Feb 2021) $
#$Revision: 261492 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/02/1560268.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_1560268
loop_
_publ_author_name
'Lin, Xinzhang'
'Sun, Keju'
'Fu, Xuemei'
'Ren, Xiuqing'
'Yang, Yang'
'Liu, Chao'
'Huang, Jiahui'
_publ_section_title
;
 Correlating Kernel--Shell Structures with Optical Properties of Pt1Ag24
 and Pt1Ag14 Nanoclusters
;
_journal_issue                   3
_journal_name_full               'The Journal of Physical Chemistry C'
_journal_page_first              2194
_journal_page_last               2201
_journal_paper_doi               10.1021/acs.jpcc.0c10481
_journal_volume                  125
_journal_year                    2021
_chemical_formula_moiety         'C180 H138 Ag14 Cl6 F6 P8 Pt S6'
_chemical_formula_sum            'C180 H138 Ag14 Cl6 F6 P8 Pt S6'
_chemical_formula_weight         4772.98
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2020-05-29
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_cell_angle_alpha                90
_cell_angle_beta                 127.9950(10)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   47.8113(13)
_cell_length_b                   34.9302(10)
_cell_length_c                   30.1732(8)
_cell_measurement_reflns_used    9159
_cell_measurement_temperature    173.0
_cell_measurement_theta_max      68.226
_cell_measurement_theta_min      3.019
_cell_volume                     39711(2)
_computing_cell_refinement       'SAINT V8.38A (?, 2016)'
_computing_data_reduction        'SAINT V8.38A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      173.0
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0756
_diffrn_reflns_av_unetI/netI     0.0492
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       55
_diffrn_reflns_limit_h_min       -57
_diffrn_reflns_limit_k_max       40
_diffrn_reflns_limit_k_min       -42
_diffrn_reflns_limit_l_max       36
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_number            193329
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         68.326
_diffrn_reflns_theta_min         2.530
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    14.419
_exptl_absorpt_correction_T_max  0.7531
_exptl_absorpt_correction_T_min  0.4993
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1228 before and 0.0837 after correction. The Ratio of minimum to maximum transmission is 0.6630. The λ/2 correction factor is Not present.'
_exptl_crystal_colour            red
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.597
_exptl_crystal_description       block
_exptl_crystal_F_000             18608
_exptl_crystal_size_max          0.13
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.1
_refine_diff_density_max         2.009
_refine_diff_density_min         -2.290
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.023
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1990
_refine_ls_number_reflns         36370
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.023
_refine_ls_R_factor_all          0.0582
_refine_ls_R_factor_gt           0.0436
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0734P)²+30.6268P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1128
_refine_ls_wR_factor_ref         0.1234
_reflns_Friedel_coverage         0.000
_reflns_number_gt                28318
_reflns_number_total             36370
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            jp0c10481_si_004.cif
_cod_data_source_block           lxz200529_sq
_cod_original_cell_volume        39711.3(19)
_cod_database_code               1560268
_shelx_shelxl_version_number     2018/3
_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.
;
_shelx_estimated_absorpt_t_max   0.327
_shelx_estimated_absorpt_t_min   0.256
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2. Rigid bond restraints
 C165
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.002
3.a Aromatic/amide H refined with riding coordinates:
 C3(H3), C5(H5), C6(H6), C9(H9), C11(H11), C12(H12), C15(H15), C17(H17),
 C18(H18), C21(H21), C23(H23), C24(H24), C27(H27), C29(H29), C30(H30), C33(H33),
  C35(H35), C36(H36), C38(H38), C39(H39), C40(H40), C41(H41), C42(H42),
 C44(H44), C45(H45), C46(H46), C47(H47), C48(H48), C50(H50), C51(H51), C52(H52),
  C53(H53), C54(H54), C56(H56), C57(H57), C58(H58), C59(H59), C60(H60),
 C62(H62), C63(H63), C64(H64), C65(H65), C66(H66), C68(H68), C69(H69), C70(H70),
  C71(H71), C72(H72), C74(H74), C75(H75), C76(H76), C77(H77), C78(H78),
 C80(H80), C81(H81), C82(H82), C83(H83), C84(H84), C86(H86), C87(H87), C88(H88),
  C89(H89), C90(H90), C92(H92), C93(H93), C94(H94), C95(H95), C96(H96),
 C98(H98), C99(H99), C100(H100), C101(H101), C102(H102), C104(H104), C105(H105),
  C106(H106), C107(H107), C108(H108), C110(H110), C111(H111), C112(H112),
 C113(H113), C114(H114), C116(H116), C117(H117), C118(H118), C119(H119),
 C120(H120), C122(H122), C123(H123), C124(H124), C125(H125), C126(H126),
 C128(H128), C129(H129), C130(H130), C131(H131), C132(H132), C134(H134),
 C135(H135), C136(H136), C137(H137), C138(H138), C140(H140), C141(H141),
 C142(H142), C143(H143), C144(H144), C146(H146), C147(H147), C148(H148),
 C149(H149), C150(H150), C152(H152), C153(H153), C154(H154), C155(H155),
 C156(H156), C158(H158), C159(H159), C160(H160), C161(H161), C162(H162),
 C164(H164), C165(H165), C166(H166), C167(H167), C168(H168), C170(H170),
 C171(H171), C172(H172), C173(H173), C174(H174), C176(H176), C177(H177),
 C178(H178), C179(H179), C180(H180)
;
_platon_squeeze_void_probe_radius 1.20
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -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_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
Pt1 Pt 0.71584(2) 0.62512(2) 0.71363(2) 0.02416(6) Uani 1 1 d . . . . .
Ag1 Ag 0.60277(2) 0.70695(2) 0.60633(2) 0.04174(11) Uani 1 1 d . . . . .
Ag2 Ag 0.65384(2) 0.64090(2) 0.60763(2) 0.03106(9) Uani 1 1 d . . . . .
Ag3 Ag 0.69233(2) 0.69928(2) 0.69304(2) 0.03052(9) Uani 1 1 d . . . . .
Ag4 Ag 0.65507(2) 0.64104(2) 0.70284(2) 0.03206(9) Uani 1 1 d . . . . .
Ag5 Ag 0.70538(2) 0.58510(2) 0.62616(2) 0.02980(9) Uani 1 1 d . . . . .
Ag6 Ag 0.72342(2) 0.66565(2) 0.64387(2) 0.02914(9) Uani 1 1 d . . . . .
Ag7 Ag 0.76790(2) 0.68025(2) 0.76321(2) 0.02889(9) Uani 1 1 d . . . . .
Ag8 Ag 0.72773(2) 0.66552(2) 0.80277(2) 0.03013(9) Uani 1 1 d . . . . .
Ag9 Ag 0.70665(2) 0.58656(2) 0.78198(2) 0.03058(9) Uani 1 1 d . . . . .
Ag10 Ag 0.66505(2) 0.56824(2) 0.66430(2) 0.03046(9) Uani 1 1 d . . . . .
Ag11 Ag 0.77555(2) 0.60839(2) 0.72215(2) 0.03052(9) Uani 1 1 d . . . . .
Ag12 Ag 0.77731(2) 0.60851(2) 0.81934(2) 0.03062(9) Uani 1 1 d . . . . .
Ag13 Ag 0.74020(2) 0.55048(2) 0.73706(2) 0.03104(9) Uani 1 1 d . . . . .
Ag14 Ag 0.83026(2) 0.54554(2) 0.82230(2) 0.04286(11) Uani 1 1 d . . . . .
Cl1 Cl 0.52486(5) 0.65286(7) 0.40072(8) 0.0735(6) Uani 1 1 d . . . . .
Cl3 Cl 0.53625(6) 0.67625(7) 0.68580(11) 0.0833(7) Uani 1 1 d . . . . .
Cl4 Cl 0.90333(5) 0.58496(6) 0.76098(10) 0.0699(5) Uani 1 1 d . . . . .
Cl5 Cl 0.89200(6) 0.56119(7) 1.03024(9) 0.0861(7) Uani 1 1 d . . . . .
Cl6 Cl 0.79666(5) 0.40577(4) 0.77627(7) 0.0500(4) Uani 1 1 d . . . . .
Cl18 Cl 0.63253(5) 0.84308(5) 0.62655(8) 0.0609(5) Uani 1 1 d . . . . .
S1 S 0.59175(4) 0.65640(4) 0.53138(6) 0.0382(3) Uani 1 1 d . . . . .
S2 S 0.65610(4) 0.75573(4) 0.64878(6) 0.0375(3) Uani 1 1 d . . . . .
S3 S 0.60323(4) 0.67157(5) 0.68549(7) 0.0432(3) Uani 1 1 d . . . . .
S4 S 0.83559(4) 0.59208(4) 0.75835(6) 0.0384(3) Uani 1 1 d . . . . .
S5 S 0.82774(4) 0.57527(4) 0.90073(6) 0.0394(3) Uani 1 1 d . . . . .
S6 S 0.77807(4) 0.49519(4) 0.75990(6) 0.0361(3) Uani 1 1 d . . . . .
P1 P 0.54948(4) 0.75177(5) 0.55858(7) 0.0451(4) Uani 1 1 d . . . . .
P2 P 0.69767(4) 0.54788(4) 0.55054(6) 0.0344(3) Uani 1 1 d . . . . .
P3 P 0.73334(4) 0.70256(4) 0.58567(6) 0.0342(3) Uani 1 1 d . . . . .
P4 P 0.81121(4) 0.73244(4) 0.80124(6) 0.0336(3) Uani 1 1 d . . . . .
P5 P 0.73940(4) 0.70092(4) 0.88332(6) 0.0349(3) Uani 1 1 d . . . . .
P6 P 0.69724(4) 0.55584(4) 0.84394(6) 0.0370(3) Uani 1 1 d . . . . .
P7 P 0.62320(4) 0.51464(4) 0.61601(6) 0.0372(3) Uani 1 1 d . . . . .
P8 P 0.88824(5) 0.50841(5) 0.87739(8) 0.0501(4) Uani 1 1 d . . . . .
F1 F 0.58497(18) 0.74929(18) 0.3611(2) 0.106(2) Uani 1 1 d . . . . .
F2 F 0.63270(16) 0.84017(16) 0.7928(2) 0.0974(19) Uani 1 1 d . . . . .
F3 F 0.47181(15) 0.5819(2) 0.5261(3) 0.119(2) Uani 1 1 d . . . . .
F4 F 0.84846(15) 0.46977(15) 0.6368(2) 0.0880(16) Uani 1 1 d . . . . .
F5 F 0.95395(15) 0.67483(19) 1.0267(3) 0.124(3) Uani 1 1 d . . . . .
F6 F 0.80394(15) 0.40785(12) 0.9495(2) 0.0743(14) Uani 1 1 d . . . . .
C1 C 0.58963(16) 0.68383(17) 0.4803(2) 0.0370(13) Uani 1 1 d . . . . .
C2 C 0.56053(19) 0.6826(2) 0.4237(3) 0.0507(17) Uani 1 1 d . . . . .
C3 C 0.5591(3) 0.7043(3) 0.3834(3) 0.070(2) Uani 1 1 d . . . . .
H3 H 0.539107 0.702703 0.344793 0.084 Uiso 1 1 calc R . . . .
C4 C 0.5865(2) 0.7276(2) 0.4003(3) 0.064(2) Uani 1 1 d . . . . .
C5 C 0.6158(2) 0.7309(2) 0.4553(3) 0.0564(18) Uani 1 1 d . . . . .
H5 H 0.634674 0.747598 0.466143 0.068 Uiso 1 1 calc R . . . .
C6 C 0.61706(17) 0.70904(18) 0.4950(3) 0.0414(14) Uani 1 1 d . . . . .
H6 H 0.637180 0.711230 0.533441 0.050 Uiso 1 1 calc R . . . .
C7 C 0.64986(17) 0.78016(17) 0.6929(3) 0.0421(14) Uani 1 1 d . . . . .
C8 C 0.6401(2) 0.8191(2) 0.6835(3) 0.0553(18) Uani 1 1 d . . . . .
C9 C 0.6346(2) 0.8390(2) 0.7167(3) 0.066(2) Uani 1 1 d . . . . .
H9 H 0.628147 0.865305 0.709609 0.080 Uiso 1 1 calc R . . . .
C10 C 0.6384(2) 0.8207(2) 0.7597(3) 0.067(2) Uani 1 1 d . . . . .
C11 C 0.6471(2) 0.7821(2) 0.7709(3) 0.0573(19) Uani 1 1 d . . . . .
H11 H 0.648906 0.769475 0.800466 0.069 Uiso 1 1 calc R . . . .
C12 C 0.65297(19) 0.7629(2) 0.7370(3) 0.0497(16) Uani 1 1 d . . . . .
H12 H 0.659429 0.736611 0.744520 0.060 Uiso 1 1 calc R . . . .
C13 C 0.56490(19) 0.6430(2) 0.6406(3) 0.0499(16) Uani 1 1 d . . . . .
C14 C 0.5355(2) 0.6453(3) 0.6388(4) 0.065(2) Uani 1 1 d . . . . .
C15 C 0.5044(2) 0.6252(3) 0.6014(5) 0.086(3) Uani 1 1 d . . . . .
H15 H 0.484662 0.627656 0.601530 0.103 Uiso 1 1 calc R . . . .
C16 C 0.5032(2) 0.6016(3) 0.5641(4) 0.080(3) Uani 1 1 d . . . . .
C17 C 0.5312(2) 0.5969(2) 0.5632(4) 0.066(2) Uani 1 1 d . . . . .
H17 H 0.529807 0.580205 0.537019 0.079 Uiso 1 1 calc R . . . .
C18 C 0.5615(2) 0.6173(2) 0.6015(3) 0.0549(18) Uani 1 1 d . . . . .
H18 H 0.581253 0.613948 0.601713 0.066 Uiso 1 1 calc R . . . .
C19 C 0.83811(17) 0.55617(18) 0.7200(3) 0.0389(13) Uani 1 1 d . . . . .
C20 C 0.86827(19) 0.55324(19) 0.7221(3) 0.0476(15) Uani 1 1 d . . . . .
C21 C 0.8720(2) 0.5242(2) 0.6940(3) 0.0590(19) Uani 1 1 d . . . . .
H21 H 0.892450 0.522701 0.695572 0.071 Uiso 1 1 calc R . . . .
C22 C 0.8453(2) 0.4982(2) 0.6644(3) 0.060(2) Uani 1 1 d . . . . .
C23 C 0.8147(2) 0.4995(2) 0.6606(3) 0.0529(17) Uani 1 1 d . . . . .
H23 H 0.796546 0.480728 0.639874 0.063 Uiso 1 1 calc R . . . .
C24 C 0.81172(19) 0.52849(18) 0.6877(3) 0.0482(16) Uani 1 1 d . . . . .
H24 H 0.790719 0.530025 0.684524 0.058 Uiso 1 1 calc R . . . .
C25 C 0.86509(17) 0.60611(19) 0.9383(3) 0.0430(14) Uani 1 1 d . . . . .
C26 C 0.8935(2) 0.5989(2) 0.9942(3) 0.0555(18) Uani 1 1 d . . . . .
C27 C 0.9234(2) 0.6217(3) 1.0241(3) 0.071(2) Uani 1 1 d . . . . .
H27 H 0.942456 0.616292 1.062346 0.085 Uiso 1 1 calc R . . . .
C28 C 0.9246(2) 0.6520(3) 0.9973(4) 0.073(2) Uani 1 1 d . . . . .
C29 C 0.8977(2) 0.6609(2) 0.9421(4) 0.071(2) Uani 1 1 d . . . . .
H29 H 0.899227 0.682552 0.924619 0.086 Uiso 1 1 calc R . . . .
C30 C 0.86834(17) 0.63726(19) 0.9129(3) 0.0471(15) Uani 1 1 d . . . . .
H30 H 0.849796 0.642367 0.874294 0.057 Uiso 1 1 calc R . . . .
C31 C 0.78415(16) 0.46884(16) 0.8151(3) 0.0366(13) Uani 1 1 d . . . . .
C32 C 0.79352(17) 0.43048(17) 0.8231(3) 0.0409(14) Uani 1 1 d . . . . .
C33 C 0.80015(18) 0.40984(18) 0.8679(3) 0.0443(15) Uani 1 1 d . . . . .
H33 H 0.806610 0.383575 0.872732 0.053 Uiso 1 1 calc R . . . .
C34 C 0.7972(2) 0.4281(2) 0.9048(3) 0.0516(17) Uani 1 1 d . . . . .
C35 C 0.7872(2) 0.46552(19) 0.8987(3) 0.0494(16) Uani 1 1 d . . . . .
H35 H 0.784630 0.477378 0.924379 0.059 Uiso 1 1 calc R . . . .
C36 C 0.78084(17) 0.48541(18) 0.8542(3) 0.0422(14) Uani 1 1 d . . . . .
H36 H 0.773925 0.511502 0.849502 0.051 Uiso 1 1 calc R . . . .
C37 C 0.50686(18) 0.7272(2) 0.5230(3) 0.0480(16) Uani 1 1 d . . . . .
C38 C 0.5017(2) 0.6943(2) 0.4932(3) 0.063(2) Uani 1 1 d . . . . .
H38 H 0.519775 0.685674 0.491266 0.075 Uiso 1 1 calc R . . . .
C39 C 0.4701(2) 0.6737(3) 0.4661(4) 0.077(3) Uani 1 1 d . . . . .
H39 H 0.466870 0.650883 0.446194 0.092 Uiso 1 1 calc R . . . .
C40 C 0.4439(2) 0.6862(3) 0.4681(4) 0.074(3) Uani 1 1 d . . . . .
H40 H 0.422240 0.672412 0.448940 0.089 Uiso 1 1 calc R . . . .
C41 C 0.4485(2) 0.7185(3) 0.4975(4) 0.070(2) Uani 1 1 d . . . . .
H41 H 0.430245 0.726892 0.499131 0.084 Uiso 1 1 calc R . . . .
C42 C 0.4800(2) 0.7392(2) 0.5250(3) 0.0608(19) Uani 1 1 d . . . . .
H42 H 0.483134 0.761629 0.545402 0.073 Uiso 1 1 calc R . . . .
C43 C 0.54386(18) 0.7816(2) 0.5035(3) 0.0509(16) Uani 1 1 d . . . . .
C44 C 0.5721(2) 0.7852(2) 0.5025(3) 0.0501(16) Uani 1 1 d . . . . .
H44 H 0.593445 0.771799 0.529430 0.060 Uiso 1 1 calc R . . . .
C45 C 0.5700(2) 0.8080(2) 0.4633(3) 0.062(2) Uani 1 1 d . . . . .
H45 H 0.589760 0.809734 0.463077 0.074 Uiso 1 1 calc R . . . .
C46 C 0.5401(2) 0.8281(3) 0.4252(3) 0.071(2) Uani 1 1 d . . . . .
H46 H 0.538514 0.842960 0.397351 0.086 Uiso 1 1 calc R . . . .
C47 C 0.5112(2) 0.8267(3) 0.4268(4) 0.072(2) Uani 1 1 d . . . . .
H47 H 0.490781 0.842020 0.401897 0.087 Uiso 1 1 calc R . . . .
C48 C 0.5131(2) 0.8028(2) 0.4652(4) 0.068(2) Uani 1 1 d . . . . .
H48 H 0.493415 0.800859 0.465580 0.081 Uiso 1 1 calc R . . . .
C49 C 0.54850(18) 0.7860(2) 0.6034(3) 0.0547(18) Uani 1 1 d . . . . .
C50 C 0.5437(2) 0.8254(2) 0.5938(4) 0.072(2) Uani 1 1 d . . . . .
H50 H 0.541414 0.836266 0.562824 0.086 Uiso 1 1 calc R . . . .
C51 C 0.5424(3) 0.8492(3) 0.6305(5) 0.088(3) Uani 1 1 d . . . . .
H51 H 0.539373 0.876053 0.624323 0.106 Uiso 1 1 calc R . . . .
C52 C 0.5454(3) 0.8336(3) 0.6742(5) 0.093(3) Uani 1 1 d . . . . .
H52 H 0.543086 0.849228 0.697542 0.112 Uiso 1 1 calc R . . . .
C53 C 0.5518(3) 0.7958(3) 0.6848(4) 0.083(3) Uani 1 1 d . . . . .
H53 H 0.555180 0.785452 0.716931 0.100 Uiso 1 1 calc R . . . .
C54 C 0.5535(2) 0.7717(3) 0.6505(3) 0.066(2) Uani 1 1 d . . . . .
H54 H 0.558153 0.745244 0.659157 0.080 Uiso 1 1 calc R . . . .
C55 C 0.65987(17) 0.56169(17) 0.4801(2) 0.0385(13) Uani 1 1 d . . . . .
C56 C 0.65770(19) 0.55183(19) 0.4330(3) 0.0457(15) Uani 1 1 d . . . . .
H56 H 0.676691 0.538384 0.437847 0.055 Uiso 1 1 calc R . . . .
C57 C 0.6281(2) 0.5616(2) 0.3795(3) 0.0552(18) Uani 1 1 d . . . . .
H57 H 0.626654 0.554444 0.347773 0.066 Uiso 1 1 calc R . . . .
C58 C 0.6006(2) 0.5816(2) 0.3720(3) 0.0576(19) Uani 1 1 d . . . . .
H58 H 0.580364 0.588309 0.335156 0.069 Uiso 1 1 calc R . . . .
C59 C 0.60239(19) 0.5918(2) 0.4175(3) 0.0556(18) Uani 1 1 d . . . . .
H59 H 0.583440 0.605687 0.412153 0.067 Uiso 1 1 calc R . . . .
C60 C 0.63226(18) 0.5818(2) 0.4721(3) 0.0458(15) Uani 1 1 d . . . . .
H60 H 0.633416 0.588993 0.503546 0.055 Uiso 1 1 calc R . . . .
C61 C 0.73547(17) 0.55267(16) 0.5503(2) 0.0381(13) Uani 1 1 d . . . . .
C62 C 0.74620(18) 0.52358(18) 0.5318(3) 0.0422(14) Uani 1 1 d . . . . .
H62 H 0.733577 0.500042 0.518830 0.051 Uiso 1 1 calc R . . . .
C63 C 0.77517(19) 0.5289(2) 0.5324(3) 0.0489(16) Uani 1 1 d . . . . .
H63 H 0.782214 0.509105 0.519595 0.059 Uiso 1 1 calc R . . . .
C64 C 0.7938(2) 0.5628(2) 0.5516(3) 0.0550(18) Uani 1 1 d . . . . .
H64 H 0.813724 0.566312 0.552217 0.066 Uiso 1 1 calc R . . . .
C65 C 0.7835(2) 0.5916(2) 0.5697(3) 0.0542(17) Uani 1 1 d . . . . .
H65 H 0.795974 0.615237 0.582097 0.065 Uiso 1 1 calc R . . . .
C66 C 0.75514(18) 0.58634(18) 0.5699(3) 0.0443(15) Uani 1 1 d . . . . .
H66 H 0.748791 0.606153 0.583768 0.053 Uiso 1 1 calc R . . . .
C67 C 0.69446(17) 0.49594(17) 0.5530(3) 0.0384(13) Uani 1 1 d . . . . .
C68 C 0.7202(2) 0.47738(19) 0.6030(3) 0.0503(17) Uani 1 1 d . . . . .
H68 H 0.737649 0.491941 0.635208 0.060 Uiso 1 1 calc R . . . .
C69 C 0.7205(3) 0.4377(2) 0.6064(4) 0.062(2) Uani 1 1 d . . . . .
H69 H 0.738284 0.425144 0.640691 0.075 Uiso 1 1 calc R . . . .
C70 C 0.6954(3) 0.4169(2) 0.5604(4) 0.068(2) Uani 1 1 d . . . . .
H70 H 0.695979 0.389812 0.563016 0.081 Uiso 1 1 calc R . . . .
C71 C 0.6697(2) 0.4338(2) 0.5112(4) 0.067(2) Uani 1 1 d . . . . .
H71 H 0.652016 0.418676 0.479930 0.080 Uiso 1 1 calc R . . . .
C72 C 0.6690(2) 0.4738(2) 0.5063(3) 0.0541(17) Uani 1 1 d . . . . .
H72 H 0.651324 0.485725 0.471359 0.065 Uiso 1 1 calc R . . . .
C73 C 0.71696(17) 0.67980(16) 0.5194(2) 0.0361(13) Uani 1 1 d . . . . .
C74 C 0.68234(19) 0.66723(18) 0.4854(3) 0.0462(15) Uani 1 1 d . . . . .
H74 H 0.668626 0.668682 0.498382 0.055 Uiso 1 1 calc R . . . .
C75 C 0.6671(2) 0.6524(2) 0.4320(3) 0.0531(17) Uani 1 1 d . . . . .
H75 H 0.642856 0.645000 0.407961 0.064 Uiso 1 1 calc R . . . .
C76 C 0.6878(2) 0.6485(2) 0.4146(3) 0.0563(19) Uani 1 1 d . . . . .
H76 H 0.677741 0.638071 0.378498 0.068 Uiso 1 1 calc R . . . .
C77 C 0.7226(2) 0.65944(19) 0.4486(3) 0.0504(17) Uani 1 1 d . . . . .
H77 H 0.736636 0.656182 0.436399 0.060 Uiso 1 1 calc R . . . .
C78 C 0.7376(2) 0.67541(18) 0.5012(3) 0.0450(15) Uani 1 1 d . . . . .
H78 H 0.761747 0.683285 0.524693 0.054 Uiso 1 1 calc R . . . .
C79 C 0.77978(17) 0.71101(17) 0.6185(2) 0.0378(13) Uani 1 1 d . . . . .
C80 C 0.80315(18) 0.68089(19) 0.6485(3) 0.0438(15) Uani 1 1 d . . . . .
H80 H 0.794953 0.658449 0.655043 0.053 Uiso 1 1 calc R . . . .
C81 C 0.8387(2) 0.6831(2) 0.6693(3) 0.0530(17) Uani 1 1 d . . . . .
H81 H 0.854304 0.662005 0.688739 0.064 Uiso 1 1 calc R . . . .
C82 C 0.8506(2) 0.7163(2) 0.6612(3) 0.0596(19) Uani 1 1 d . . . . .
H82 H 0.874546 0.718032 0.675113 0.071 Uiso 1 1 calc R . . . .
C83 C 0.8283(2) 0.7469(2) 0.6332(3) 0.0574(19) Uani 1 1 d . . . . .
H83 H 0.836923 0.769749 0.628451 0.069 Uiso 1 1 calc R . . . .
C84 C 0.79274(19) 0.74427(19) 0.6118(3) 0.0453(15) Uani 1 1 d . . . . .
H84 H 0.777327 0.765470 0.592436 0.054 Uiso 1 1 calc R . . . .
C85 C 0.71079(17) 0.74883(16) 0.5601(2) 0.0372(13) Uani 1 1 d . . . . .
C86 C 0.70532(19) 0.76745(18) 0.5143(3) 0.0467(15) Uani 1 1 d . . . . .
H86 H 0.714361 0.756561 0.496588 0.056 Uiso 1 1 calc R . . . .
C87 C 0.68678(19) 0.8017(2) 0.4947(3) 0.0509(17) Uani 1 1 d . . . . .
H87 H 0.683208 0.814305 0.463612 0.061 Uiso 1 1 calc R . . . .
C88 C 0.67354(19) 0.81750(19) 0.5203(3) 0.0470(15) Uani 1 1 d . . . . .
H88 H 0.661167 0.841185 0.507278 0.056 Uiso 1 1 calc R . . . .
C89 C 0.67832(19) 0.79865(18) 0.5653(3) 0.0466(15) Uani 1 1 d . . . . .
H89 H 0.668464 0.808935 0.582080 0.056 Uiso 1 1 calc R . . . .
C90 C 0.69734(17) 0.76521(17) 0.5851(3) 0.0401(14) Uani 1 1 d . . . . .
H90 H 0.701349 0.753037 0.616718 0.048 Uiso 1 1 calc R . . . .
C91 C 0.79330(17) 0.77224(16) 0.7522(2) 0.0368(13) Uani 1 1 d . . . . .
C92 C 0.76105(17) 0.78793(19) 0.7343(3) 0.0429(14) Uani 1 1 d . . . . .
H92 H 0.748392 0.776324 0.745653 0.051 Uiso 1 1 calc R . . . .
C93 C 0.74717(19) 0.8200(2) 0.7005(3) 0.0494(16) Uani 1 1 d . . . . .
H93 H 0.725708 0.831020 0.689964 0.059 Uiso 1 1 calc R . . . .
C94 C 0.76476(19) 0.8358(2) 0.6820(3) 0.0517(17) Uani 1 1 d . . . . .
H94 H 0.755515 0.858097 0.659135 0.062 Uiso 1 1 calc R . . . .
C95 C 0.7955(2) 0.8196(2) 0.6963(3) 0.0570(19) Uani 1 1 d . . . . .
H95 H 0.806921 0.830003 0.682036 0.068 Uiso 1 1 calc R . . . .
C96 C 0.80985(19) 0.78824(19) 0.7315(3) 0.0487(16) Uani 1 1 d . . . . .
H96 H 0.831327 0.777391 0.741796 0.058 Uiso 1 1 calc R . . . .
C97 C 0.85410(16) 0.72217(17) 0.8179(2) 0.0373(13) Uani 1 1 d . . . . .
C98 C 0.85823(18) 0.68817(19) 0.7986(3) 0.0461(15) Uani 1 1 d . . . . .
H98 H 0.838888 0.670949 0.776557 0.055 Uiso 1 1 calc R . . . .
C99 C 0.8908(2) 0.6798(2) 0.8120(4) 0.064(2) Uani 1 1 d . . . . .
H99 H 0.894044 0.656062 0.800242 0.077 Uiso 1 1 calc R . . . .
C100 C 0.9186(2) 0.7049(2) 0.8420(3) 0.062(2) Uani 1 1 d . . . . .
H100 H 0.940398 0.699316 0.848739 0.074 Uiso 1 1 calc R . . . .
C101 C 0.9151(2) 0.7381(2) 0.8621(3) 0.0564(18) Uani 1 1 d . . . . .
H101 H 0.934714 0.754908 0.884389 0.068 Uiso 1 1 calc R . . . .
C102 C 0.88301(17) 0.7471(2) 0.8502(3) 0.0473(15) Uani 1 1 d . . . . .
H102 H 0.880523 0.770254 0.863935 0.057 Uiso 1 1 calc R . . . .
C103 C 0.82447(17) 0.75553(18) 0.8655(3) 0.0385(13) Uani 1 1 d . . . . .
C104 C 0.8293(2) 0.79544(19) 0.8740(3) 0.0525(17) Uani 1 1 d . . . . .
H104 H 0.823332 0.811885 0.844193 0.063 Uiso 1 1 calc R . . . .
C105 C 0.8428(2) 0.8104(3) 0.9263(4) 0.069(2) Uani 1 1 d . . . . .
H105 H 0.846056 0.837282 0.932144 0.083 Uiso 1 1 calc R . . . .
C106 C 0.8514(3) 0.7874(3) 0.9689(4) 0.076(3) Uani 1 1 d . . . . .
H106 H 0.860518 0.798150 1.004391 0.092 Uiso 1 1 calc R . . . .
C107 C 0.8471(2) 0.7484(3) 0.9612(3) 0.067(2) Uani 1 1 d . . . . .
H107 H 0.853453 0.732299 0.991529 0.080 Uiso 1 1 calc R . . . .
C108 C 0.8336(2) 0.7324(2) 0.9096(3) 0.0532(17) Uani 1 1 d . . . . .
H108 H 0.830599 0.705463 0.904537 0.064 Uiso 1 1 calc R . . . .
C109 C 0.78235(18) 0.69307(19) 0.9524(3) 0.0425(14) Uani 1 1 d . . . . .
C110 C 0.79532(18) 0.7178(2) 0.9972(3) 0.0466(15) Uani 1 1 d . . . . .
H110 H 0.782552 0.740289 0.992236 0.056 Uiso 1 1 calc R . . . .
C111 C 0.8273(2) 0.7092(2) 1.0495(3) 0.0555(18) Uani 1 1 d . . . . .
H111 H 0.835944 0.725890 1.080385 0.067 Uiso 1 1 calc R . . . .
C112 C 0.8462(2) 0.6773(2) 1.0570(3) 0.0595(19) Uani 1 1 d . . . . .
H112 H 0.867637 0.671645 1.093039 0.071 Uiso 1 1 calc R . . . .
C113 C 0.8341(2) 0.6532(2) 1.0119(3) 0.063(2) Uani 1 1 d . . . . .
H113 H 0.847624 0.631453 1.016711 0.076 Uiso 1 1 calc R . . . .
C114 C 0.80174(19) 0.66106(19) 0.9592(3) 0.0472(15) Uani 1 1 d . . . . .
H114 H 0.793167 0.644466 0.928351 0.057 Uiso 1 1 calc R . . . .
C115 C 0.73616(17) 0.75318(17) 0.8756(2) 0.0375(13) Uani 1 1 d . . . . .
C116 C 0.7264(2) 0.7764(2) 0.9017(3) 0.0493(16) Uani 1 1 d . . . . .
H116 H 0.721878 0.765228 0.925396 0.059 Uiso 1 1 calc R . . . .
C117 C 0.7233(2) 0.8156(2) 0.8932(3) 0.0531(17) Uani 1 1 d . . . . .
H117 H 0.715663 0.831188 0.909774 0.064 Uiso 1 1 calc R . . . .
C118 C 0.7312(2) 0.8319(2) 0.8607(3) 0.061(2) Uani 1 1 d . . . . .
H118 H 0.730379 0.858980 0.856677 0.073 Uiso 1 1 calc R . . . .
C119 C 0.7403(2) 0.8092(2) 0.8338(3) 0.0544(18) Uani 1 1 d . . . . .
H119 H 0.744601 0.820510 0.809922 0.065 Uiso 1 1 calc R . . . .
C120 C 0.74307(19) 0.77031(19) 0.8418(3) 0.0450(15) Uani 1 1 d . . . . .
H120 H 0.749833 0.754880 0.823858 0.054 Uiso 1 1 calc R . . . .
C121 C 0.70694(19) 0.69025(17) 0.8948(3) 0.0411(14) Uani 1 1 d . . . . .
C122 C 0.7164(2) 0.6821(2) 0.9477(3) 0.0518(17) Uani 1 1 d . . . . .
H122 H 0.740618 0.680216 0.979663 0.062 Uiso 1 1 calc R . . . .
C123 C 0.6893(2) 0.6768(2) 0.9528(3) 0.064(2) Uani 1 1 d . . . . .
H123 H 0.695511 0.671334 0.988702 0.077 Uiso 1 1 calc R . . . .
C124 C 0.6543(2) 0.6793(2) 0.9072(4) 0.065(2) Uani 1 1 d . . . . .
H124 H 0.636442 0.675788 0.911570 0.078 Uiso 1 1 calc R . . . .
C125 C 0.6448(2) 0.6871(3) 0.8542(4) 0.069(2) Uani 1 1 d . . . . .
H125 H 0.620559 0.689027 0.822285 0.083 Uiso 1 1 calc R . . . .
C126 C 0.6714(2) 0.6921(2) 0.8486(3) 0.0550(18) Uani 1 1 d . . . . .
H126 H 0.665074 0.696774 0.812451 0.066 Uiso 1 1 calc R . . . .
C127 C 0.73100(18) 0.56735(17) 0.9179(2) 0.0400(14) Uani 1 1 d . . . . .
C128 C 0.76625(19) 0.56269(19) 0.9404(3) 0.0474(15) Uani 1 1 d . . . . .
H128 H 0.771759 0.554751 0.916435 0.057 Uiso 1 1 calc R . . . .
C129 C 0.7937(2) 0.5693(2) 0.9967(3) 0.0603(19) Uani 1 1 d . . . . .
H129 H 0.817643 0.565527 1.011383 0.072 Uiso 1 1 calc R . . . .
C130 C 0.7856(3) 0.5814(2) 1.0310(3) 0.064(2) Uani 1 1 d . . . . .
H130 H 0.804193 0.585763 1.069768 0.076 Uiso 1 1 calc R . . . .
C131 C 0.7515(3) 0.5871(2) 1.0104(3) 0.065(2) Uani 1 1 d . . . . .
H131 H 0.746427 0.595915 1.034595 0.078 Uiso 1 1 calc R . . . .
C132 C 0.7235(2) 0.5800(2) 0.9533(3) 0.0531(17) Uani 1 1 d . . . . .
H132 H 0.699592 0.583754 0.939046 0.064 Uiso 1 1 calc R . . . .
C133 C 0.69950(17) 0.50408(17) 0.8432(3) 0.0381(13) Uani 1 1 d . . . . .
C134 C 0.71281(19) 0.48129(18) 0.8906(3) 0.0465(15) Uani 1 1 d . . . . .
H134 H 0.722325 0.493225 0.925601 0.056 Uiso 1 1 calc R . . . .
C135 C 0.7123(2) 0.44207(19) 0.8875(3) 0.0551(18) Uani 1 1 d . . . . .
H135 H 0.721449 0.426989 0.919984 0.066 Uiso 1 1 calc R . . . .
C136 C 0.6986(3) 0.4249(2) 0.8370(4) 0.064(2) Uani 1 1 d . . . . .
H136 H 0.698138 0.397721 0.834596 0.077 Uiso 1 1 calc R . . . .
C137 C 0.6855(3) 0.4462(2) 0.7903(4) 0.072(3) Uani 1 1 d . . . . .
H137 H 0.675845 0.433709 0.755691 0.086 Uiso 1 1 calc R . . . .
C138 C 0.6859(2) 0.4859(2) 0.7922(3) 0.0563(19) Uani 1 1 d . . . . .
H138 H 0.677209 0.500547 0.759441 0.068 Uiso 1 1 calc R . . . .
C139 C 0.65518(18) 0.56456(17) 0.8307(3) 0.0425(14) Uani 1 1 d . . . . .
C140 C 0.6420(2) 0.5403(2) 0.8508(3) 0.060(2) Uani 1 1 d . . . . .
H140 H 0.655126 0.518074 0.871468 0.073 Uiso 1 1 calc R . . . .
C141 C 0.6109(3) 0.5479(3) 0.8413(4) 0.071(2) Uani 1 1 d . . . . .
H141 H 0.602751 0.531181 0.856081 0.085 Uiso 1 1 calc R . . . .
C142 C 0.5911(2) 0.5792(3) 0.8109(4) 0.069(2) Uani 1 1 d . . . . .
H142 H 0.569338 0.584261 0.804428 0.083 Uiso 1 1 calc R . . . .
C143 C 0.6031(2) 0.6039(2) 0.7893(4) 0.070(2) Uani 1 1 d . . . . .
H143 H 0.589649 0.625736 0.768008 0.084 Uiso 1 1 calc R . . . .
C144 C 0.6354(2) 0.5957(2) 0.7996(3) 0.0523(17) Uani 1 1 d . . . . .
H144 H 0.643630 0.612128 0.784637 0.063 Uiso 1 1 calc R . . . .
C145 C 0.64341(19) 0.46738(18) 0.6385(3) 0.0446(15) Uani 1 1 d . . . . .
C146 C 0.67987(19) 0.46468(19) 0.6690(3) 0.0490(16) Uani 1 1 d . . . . .
H146 H 0.693267 0.487307 0.677091 0.059 Uiso 1 1 calc R . . . .
C147 C 0.6975(2) 0.4294(2) 0.6884(3) 0.0595(19) Uani 1 1 d . . . . .
H147 H 0.722463 0.427838 0.708967 0.071 Uiso 1 1 calc R . . . .
C148 C 0.6774(2) 0.3967(2) 0.6766(3) 0.061(2) Uani 1 1 d . . . . .
H148 H 0.688938 0.372578 0.690014 0.074 Uiso 1 1 calc R . . . .
C149 C 0.6415(2) 0.3986(2) 0.6463(3) 0.064(2) Uani 1 1 d . . . . .
H149 H 0.628205 0.375782 0.638003 0.076 Uiso 1 1 calc R . . . .
C150 C 0.6241(2) 0.4339(2) 0.6273(3) 0.0559(18) Uani 1 1 d . . . . .
H150 H 0.599066 0.435128 0.606867 0.067 Uiso 1 1 calc R . . . .
C151 C 0.58779(17) 0.51337(18) 0.6222(3) 0.0422(14) Uani 1 1 d . . . . .
C152 C 0.5943(2) 0.5306(2) 0.6699(3) 0.0589(19) Uani 1 1 d . . . . .
H152 H 0.616548 0.542326 0.697404 0.071 Uiso 1 1 calc R . . . .
C153 C 0.5679(2) 0.5302(3) 0.6764(4) 0.071(2) Uani 1 1 d . . . . .
H153 H 0.572300 0.541704 0.708718 0.085 Uiso 1 1 calc R . . . .
C154 C 0.5353(3) 0.5134(3) 0.6364(4) 0.083(3) Uani 1 1 d . . . . .
H154 H 0.517608 0.513061 0.641521 0.100 Uiso 1 1 calc R . . . .
C155 C 0.5285(2) 0.4971(3) 0.5887(3) 0.064(2) Uani 1 1 d . . . . .
H155 H 0.505849 0.486212 0.560710 0.077 Uiso 1 1 calc R . . . .
C156 C 0.55457(18) 0.4965(2) 0.5818(3) 0.0481(16) Uani 1 1 d . . . . .
H156 H 0.549966 0.484639 0.549580 0.058 Uiso 1 1 calc R . . . .
C157 C 0.59848(17) 0.51407(19) 0.5403(3) 0.0446(15) Uani 1 1 d . . . . .
C158 C 0.5974(2) 0.4835(2) 0.5104(3) 0.0601(19) Uani 1 1 d . . . . .
H158 H 0.611481 0.461461 0.529903 0.072 Uiso 1 1 calc R . . . .
C159 C 0.5760(3) 0.4845(3) 0.4516(4) 0.078(3) Uani 1 1 d . . . . .
H159 H 0.575254 0.463037 0.431494 0.094 Uiso 1 1 calc R . . . .
C160 C 0.5563(2) 0.5159(3) 0.4234(4) 0.075(3) Uani 1 1 d . . . . .
H160 H 0.541931 0.516542 0.383539 0.090 Uiso 1 1 calc R . . . .
C161 C 0.5570(2) 0.5463(3) 0.4516(3) 0.069(2) Uani 1 1 d . . . . .
H161 H 0.542944 0.568174 0.431281 0.082 Uiso 1 1 calc R . . . .
C162 C 0.5779(2) 0.5461(2) 0.5097(3) 0.0544(17) Uani 1 1 d . . . . .
H162 H 0.578286 0.567830 0.528973 0.065 Uiso 1 1 calc R . . . .
C163 C 0.8989(2) 0.4829(2) 0.8371(3) 0.0549(18) Uani 1 1 d . . . . .
C164 C 0.9310(3) 0.4849(3) 0.8464(4) 0.081(3) Uani 1 1 d . . . . .
H164 H 0.948827 0.502068 0.873958 0.097 Uiso 1 1 calc R . . . .
C165 C 0.9375(3) 0.4622(3) 0.8160(5) 0.098(4) Uani 1 1 d . U . . .
H165 H 0.959882 0.463275 0.823233 0.118 Uiso 1 1 calc R . . . .
C166 C 0.9115(4) 0.4382(3) 0.7754(5) 0.096(4) Uani 1 1 d . . . . .
H166 H 0.916197 0.422000 0.755324 0.115 Uiso 1 1 calc R . . . .
C167 C 0.8793(3) 0.4371(3) 0.7635(4) 0.080(3) Uani 1 1 d . . . . .
H167 H 0.861116 0.421280 0.733963 0.096 Uiso 1 1 calc R . . . .
C168 C 0.8729(3) 0.4591(2) 0.7942(3) 0.062(2) Uani 1 1 d . . . . .
H168 H 0.850316 0.457995 0.786003 0.074 Uiso 1 1 calc R . . . .
C169 C 0.89332(19) 0.4704(2) 0.9241(3) 0.0531(18) Uani 1 1 d . . . . .
C170 C 0.8777(2) 0.4764(2) 0.9497(4) 0.066(2) Uani 1 1 d . . . . .
H170 H 0.863943 0.498742 0.941472 0.079 Uiso 1 1 calc R . . . .
C171 C 0.8823(3) 0.4494(3) 0.9878(4) 0.078(3) Uani 1 1 d . . . . .
H171 H 0.872257 0.453840 1.006400 0.094 Uiso 1 1 calc R . . . .
C172 C 0.9009(3) 0.4171(3) 0.9982(4) 0.073(2) Uani 1 1 d . . . . .
H172 H 0.903360 0.398683 1.023527 0.088 Uiso 1 1 calc R . . . .
C173 C 0.9163(3) 0.4105(2) 0.9729(3) 0.075(3) Uani 1 1 d . . . . .
H173 H 0.929729 0.387815 0.981231 0.090 Uiso 1 1 calc R . . . .
C174 C 0.9124(2) 0.4368(2) 0.9354(3) 0.069(2) Uani 1 1 d . . . . .
H174 H 0.922626 0.432006 0.917236 0.083 Uiso 1 1 calc R . . . .
C175 C 0.9273(2) 0.5394(2) 0.9247(3) 0.0577(19) Uani 1 1 d . . . . .
C176 C 0.9561(3) 0.5281(3) 0.9765(4) 0.107(4) Uani 1 1 d . . . . .
H176 H 0.956863 0.503513 0.990535 0.128 Uiso 1 1 calc R . . . .
C177 C 0.9850(3) 0.5534(3) 1.0090(5) 0.125(5) Uani 1 1 d . . . . .
H177 H 1.005316 0.545944 1.045381 0.149 Uiso 1 1 calc R . . . .
C178 C 0.9838(3) 0.5886(3) 0.9885(5) 0.102(4) Uani 1 1 d . . . . .
H178 H 1.003599 0.605325 1.010107 0.122 Uiso 1 1 calc R . . . .
C179 C 0.9544(2) 0.5998(3) 0.9372(4) 0.079(3) Uani 1 1 d . . . . .
H179 H 0.953560 0.624622 0.923500 0.095 Uiso 1 1 calc R . . . .
C180 C 0.9261(2) 0.5757(2) 0.9051(3) 0.0554(18) Uani 1 1 d . . . . .
H180 H 0.905528 0.583826 0.869439 0.066 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 0.0181 0.0091 '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 0.1306 4.2820 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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
Ag2 Pt1 Ag4 61.621(12) . . ?
Ag2 Pt1 Ag8 117.050(14) . . ?
Ag2 Pt1 Ag11 117.372(13) . . ?
Ag3 Pt1 Ag2 63.324(12) . . ?
Ag3 Pt1 Ag4 61.948(13) . . ?
Ag3 Pt1 Ag5 117.188(13) . . ?
Ag3 Pt1 Ag6 64.336(12) . . ?
Ag3 Pt1 Ag7 64.438(13) . . ?
Ag3 Pt1 Ag8 63.157(12) . . ?
Ag3 Pt1 Ag10 117.182(14) . . ?
Ag3 Pt1 Ag11 118.487(14) . . ?
Ag3 Pt1 Ag12 117.236(14) . . ?
Ag3 Pt1 Ag13 178.624(13) . . ?
Ag5 Pt1 Ag2 63.811(13) . . ?
Ag5 Pt1 Ag4 115.551(14) . . ?
Ag5 Pt1 Ag7 116.601(13) . . ?
Ag5 Pt1 Ag8 178.935(15) . . ?
Ag5 Pt1 Ag10 62.349(12) . . ?
Ag5 Pt1 Ag11 63.187(12) . . ?
Ag5 Pt1 Ag12 115.997(14) . . ?
Ag5 Pt1 Ag13 64.186(12) . . ?
Ag6 Pt1 Ag2 64.086(13) . . ?
Ag6 Pt1 Ag4 115.516(14) . . ?
Ag6 Pt1 Ag5 63.685(12) . . ?
Ag6 Pt1 Ag7 63.415(12) . . ?
Ag6 Pt1 Ag8 115.973(13) . . ?
Ag6 Pt1 Ag10 116.520(13) . . ?
Ag6 Pt1 Ag11 64.130(12) . . ?
Ag6 Pt1 Ag12 116.524(14) . . ?
Ag6 Pt1 Ag13 116.729(13) . . ?
Ag7 Pt1 Ag2 117.165(13) . . ?
Ag7 Pt1 Ag4 117.099(14) . . ?
Ag7 Pt1 Ag8 62.531(12) . . ?
Ag7 Pt1 Ag10 178.285(14) . . ?
Ag7 Pt1 Ag11 63.940(12) . . ?
Ag7 Pt1 Ag12 63.563(12) . . ?
Ag7 Pt1 Ag13 115.076(14) . . ?
Ag8 Pt1 Ag4 65.514(13) . . ?
Ag9 Pt1 Ag2 114.695(14) . . ?
Ag9 Pt1 Ag3 113.935(13) . . ?
Ag9 Pt1 Ag4 62.681(13) . . ?
Ag9 Pt1 Ag5 117.278(14) . . ?
Ag9 Pt1 Ag6 178.139(15) . . ?
Ag9 Pt1 Ag7 116.723(13) . . ?
Ag9 Pt1 Ag8 63.096(12) . . ?
Ag9 Pt1 Ag10 63.403(12) . . ?
Ag9 Pt1 Ag11 117.684(14) . . ?
Ag9 Pt1 Ag12 64.705(13) . . ?
Ag9 Pt1 Ag13 65.011(13) . . ?
Ag10 Pt1 Ag2 63.816(13) . . ?
Ag10 Pt1 Ag4 64.560(13) . . ?
Ag10 Pt1 Ag8 118.503(14) . . ?
Ag10 Pt1 Ag11 114.408(13) . . ?
Ag10 Pt1 Ag13 63.319(13) . . ?
Ag11 Pt1 Ag4 178.737(15) . . ?
Ag11 Pt1 Ag8 115.748(14) . . ?
Ag12 Pt1 Ag2 179.271(15) . . ?
Ag12 Pt1 Ag4 118.119(13) . . ?
Ag12 Pt1 Ag8 63.150(13) . . ?
Ag12 Pt1 Ag10 115.456(13) . . ?
Ag12 Pt1 Ag11 62.878(13) . . ?
Ag12 Pt1 Ag13 61.611(12) . . ?
Ag13 Pt1 Ag2 117.822(14) . . ?
Ag13 Pt1 Ag4 117.715(14) . . ?
Ag13 Pt1 Ag8 115.468(13) . . ?
Ag13 Pt1 Ag11 61.881(12) . . ?
Ag4 Ag1 Ag2 50.353(11) . . ?
S1 Ag1 Ag2 46.45(3) . . ?
S1 Ag1 Ag4 86.18(3) . . ?
S1 Ag1 S3 109.96(5) . . ?
S2 Ag1 Ag2 87.68(3) . . ?
S2 Ag1 Ag4 92.33(3) . . ?
S2 Ag1 S1 117.83(5) . . ?
S2 Ag1 S3 112.86(5) . . ?
S3 Ag1 Ag2 93.79(4) . . ?
S3 Ag1 Ag4 46.42(3) . . ?
P1 Ag1 Ag2 154.08(4) . . ?
P1 Ag1 Ag4 150.56(4) . . ?
P1 Ag1 S1 108.78(5) . . ?
P1 Ag1 S2 102.00(5) . . ?
P1 Ag1 S3 104.13(5) . . ?
Pt1 Ag2 Ag1 113.983(15) . . ?
Pt1 Ag2 Ag3 57.886(12) . . ?
Pt1 Ag2 Ag4 59.335(12) . . ?
Pt1 Ag2 Ag5 57.782(11) . . ?
Pt1 Ag2 Ag6 57.524(11) . . ?
Pt1 Ag2 Ag10 57.983(12) . . ?
Ag3 Ag2 Ag1 65.344(14) . . ?
Ag3 Ag2 Ag5 107.577(17) . . ?
Ag3 Ag2 Ag6 60.260(13) . . ?
Ag3 Ag2 Ag10 107.741(16) . . ?
Ag4 Ag2 Ag1 64.546(14) . . ?
Ag4 Ag2 Ag3 59.391(14) . . ?
Ag4 Ag2 Ag5 108.602(16) . . ?
Ag4 Ag2 Ag6 108.156(17) . . ?
Ag4 Ag2 Ag10 61.740(13) . . ?
Ag5 Ag2 Ag1 171.764(18) . . ?
Ag5 Ag2 Ag6 59.487(13) . . ?
Ag5 Ag2 Ag10 58.494(13) . . ?
Ag6 Ag2 Ag1 117.111(17) . . ?
Ag10 Ag2 Ag1 118.444(16) . . ?
Ag10 Ag2 Ag6 106.374(16) . . ?
S1 Ag2 Pt1 161.36(4) . . ?
S1 Ag2 Ag1 51.80(4) . . ?
S1 Ag2 Ag3 114.86(4) . . ?
S1 Ag2 Ag4 102.03(4) . . ?
S1 Ag2 Ag5 136.18(4) . . ?
S1 Ag2 Ag6 136.83(4) . . ?
S1 Ag2 Ag10 114.95(4) . . ?
Pt1 Ag3 Ag2 58.790(12) . . ?
Pt1 Ag3 Ag4 59.635(12) . . ?
Pt1 Ag3 Ag6 57.844(11) . . ?
Pt1 Ag3 Ag7 57.953(11) . . ?
Pt1 Ag3 Ag8 58.935(11) . . ?
Ag2 Ag3 Ag6 60.405(13) . . ?
Ag2 Ag3 Ag7 108.051(16) . . ?
Ag4 Ag3 Ag2 59.393(14) . . ?
Ag4 Ag3 Ag6 108.274(16) . . ?
Ag4 Ag3 Ag7 109.671(16) . . ?
Ag4 Ag3 Ag8 63.221(14) . . ?
Ag6 Ag3 Ag7 59.174(13) . . ?
Ag8 Ag3 Ag2 109.680(16) . . ?
Ag8 Ag3 Ag6 107.255(16) . . ?
Ag8 Ag3 Ag7 59.060(13) . . ?
S2 Ag3 Pt1 162.35(4) . . ?
S2 Ag3 Ag2 103.71(4) . . ?
S2 Ag3 Ag4 111.14(4) . . ?
S2 Ag3 Ag6 117.69(4) . . ?
S2 Ag3 Ag7 137.06(4) . . ?
S2 Ag3 Ag8 133.11(4) . . ?
Pt1 Ag4 Ag1 114.208(15) . . ?
Pt1 Ag4 Ag2 59.044(12) . . ?
Pt1 Ag4 Ag3 58.417(12) . . ?
Pt1 Ag4 Ag8 57.165(11) . . ?
Pt1 Ag4 Ag9 57.674(12) . . ?
Pt1 Ag4 Ag10 57.476(11) . . ?
Ag2 Ag4 Ag1 65.101(14) . . ?
Ag2 Ag4 Ag8 107.916(17) . . ?
Ag2 Ag4 Ag9 108.329(17) . . ?
Ag2 Ag4 Ag10 60.507(13) . . ?
Ag3 Ag4 Ag1 66.071(14) . . ?
Ag3 Ag4 Ag2 61.217(14) . . ?
Ag3 Ag4 Ag8 59.156(13) . . ?
Ag3 Ag4 Ag9 106.892(17) . . ?
Ag3 Ag4 Ag10 108.193(16) . . ?
Ag8 Ag4 Ag1 117.647(17) . . ?
Ag9 Ag4 Ag1 171.868(18) . . ?
Ag9 Ag4 Ag8 58.650(13) . . ?
Ag9 Ag4 Ag10 59.335(13) . . ?
Ag10 Ag4 Ag1 117.876(16) . . ?
Ag10 Ag4 Ag8 105.863(16) . . ?
S3 Ag4 Pt1 164.78(4) . . ?
S3 Ag4 Ag1 52.63(4) . . ?
S3 Ag4 Ag2 113.47(4) . . ?
S3 Ag4 Ag3 106.52(4) . . ?
S3 Ag4 Ag8 119.07(4) . . ?
S3 Ag4 Ag9 135.29(4) . . ?
S3 Ag4 Ag10 132.87(4) . . ?
Pt1 Ag5 Ag2 58.407(11) . . ?
Pt1 Ag5 Ag6 58.034(11) . . ?
Pt1 Ag5 Ag10 59.035(11) . . ?
Pt1 Ag5 Ag11 58.740(12) . . ?
Pt1 Ag5 Ag13 58.195(11) . . ?
Ag2 Ag5 Ag13 108.322(16) . . ?
Ag6 Ag5 Ag2 60.383(14) . . ?
Ag6 Ag5 Ag13 107.177(16) . . ?
Ag10 Ag5 Ag2 60.869(13) . . ?
Ag10 Ag5 Ag6 108.978(16) . . ?
Ag10 Ag5 Ag11 108.073(16) . . ?
Ag10 Ag5 Ag13 60.209(14) . . ?
Ag11 Ag5 Ag2 109.096(16) . . ?
Ag11 Ag5 Ag6 60.726(13) . . ?
Ag11 Ag5 Ag13 58.531(13) . . ?
P2 Ag5 Pt1 178.02(4) . . ?
P2 Ag5 Ag2 123.51(4) . . ?
P2 Ag5 Ag6 123.02(4) . . ?
P2 Ag5 Ag10 121.02(4) . . ?
P2 Ag5 Ag11 119.97(4) . . ?
P2 Ag5 Ag13 119.94(4) . . ?
Pt1 Ag6 Ag2 58.390(11) . . ?
Pt1 Ag6 Ag3 57.820(11) . . ?
Pt1 Ag6 Ag5 58.281(11) . . ?
Pt1 Ag6 Ag7 58.455(11) . . ?
Pt1 Ag6 Ag11 58.384(11) . . ?
Ag2 Ag6 Ag11 107.946(16) . . ?
Ag3 Ag6 Ag2 59.335(13) . . ?
Ag3 Ag6 Ag11 108.218(15) . . ?
Ag5 Ag6 Ag2 60.130(13) . . ?
Ag5 Ag6 Ag3 107.352(16) . . ?
Ag5 Ag6 Ag11 59.535(13) . . ?
Ag7 Ag6 Ag2 108.314(16) . . ?
Ag7 Ag6 Ag3 60.573(13) . . ?
Ag7 Ag6 Ag5 108.017(15) . . ?
Ag7 Ag6 Ag11 60.372(13) . . ?
P3 Ag6 Pt1 177.07(4) . . ?
P3 Ag6 Ag2 124.47(4) . . ?
P3 Ag6 Ag3 122.48(4) . . ?
P3 Ag6 Ag5 123.14(4) . . ?
P3 Ag6 Ag7 118.86(4) . . ?
P3 Ag6 Ag11 119.65(4) . . ?
Pt1 Ag7 Ag3 57.610(12) . . ?
Pt1 Ag7 Ag6 58.130(11) . . ?
Pt1 Ag7 Ag8 59.076(12) . . ?
Pt1 Ag7 Ag11 58.320(12) . . ?
Pt1 Ag7 Ag12 58.369(11) . . ?
Ag6 Ag7 Ag3 60.253(13) . . ?
Ag6 Ag7 Ag11 60.465(13) . . ?
Ag6 Ag7 Ag12 107.835(16) . . ?
Ag8 Ag7 Ag3 59.747(13) . . ?
Ag8 Ag7 Ag6 108.682(17) . . ?
Ag8 Ag7 Ag11 108.276(16) . . ?
Ag8 Ag7 Ag12 60.268(13) . . ?
Ag11 Ag7 Ag3 108.040(16) . . ?
Ag12 Ag7 Ag3 107.302(16) . . ?
Ag12 Ag7 Ag11 59.343(13) . . ?
P4 Ag7 Pt1 175.69(4) . . ?
P4 Ag7 Ag3 118.76(4) . . ?
P4 Ag7 Ag6 118.51(4) . . ?
P4 Ag7 Ag8 121.93(4) . . ?
P4 Ag7 Ag11 123.22(4) . . ?
P4 Ag7 Ag12 125.93(4) . . ?
Pt1 Ag8 Ag3 57.908(11) . . ?
Pt1 Ag8 Ag4 57.320(11) . . ?
Pt1 Ag8 Ag7 58.393(11) . . ?
Pt1 Ag8 Ag9 57.557(11) . . ?
Pt1 Ag8 Ag12 58.240(11) . . ?
Ag3 Ag8 Ag4 57.623(13) . . ?
Ag3 Ag8 Ag12 108.604(16) . . ?
Ag7 Ag8 Ag3 61.192(13) . . ?
Ag7 Ag8 Ag4 106.927(16) . . ?
Ag7 Ag8 Ag9 108.477(16) . . ?
Ag7 Ag8 Ag12 60.492(13) . . ?
Ag9 Ag8 Ag3 105.257(16) . . ?
Ag9 Ag8 Ag4 58.183(13) . . ?
Ag9 Ag8 Ag12 61.092(14) . . ?
Ag12 Ag8 Ag4 107.229(16) . . ?
P5 Ag8 Pt1 178.93(5) . . ?
P5 Ag8 Ag3 122.91(4) . . ?
P5 Ag8 Ag4 123.60(4) . . ?
P5 Ag8 Ag7 121.19(4) . . ?
P5 Ag8 Ag9 122.24(4) . . ?
P5 Ag8 Ag12 120.70(4) . . ?
Pt1 Ag9 Ag4 59.644(12) . . ?
Pt1 Ag9 Ag8 59.348(11) . . ?
Pt1 Ag9 Ag10 59.020(12) . . ?
Pt1 Ag9 Ag12 58.336(11) . . ?
Pt1 Ag9 Ag13 58.278(11) . . ?
Ag4 Ag9 Ag8 63.166(14) . . ?
Ag4 Ag9 Ag10 62.042(14) . . ?
Ag4 Ag9 Ag12 110.177(16) . . ?
Ag4 Ag9 Ag13 109.565(16) . . ?
Ag8 Ag9 Ag10 111.490(16) . . ?
Ag8 Ag9 Ag12 59.853(13) . . ?
Ag8 Ag9 Ag13 107.115(16) . . ?
Ag10 Ag9 Ag12 106.883(16) . . ?
Ag10 Ag9 Ag13 59.701(13) . . ?
Ag12 Ag9 Ag13 57.548(13) . . ?
P6 Ag9 Pt1 176.42(4) . . ?
P6 Ag9 Ag4 117.70(4) . . ?
P6 Ag9 Ag8 117.60(4) . . ?
P6 Ag9 Ag10 122.51(4) . . ?
P6 Ag9 Ag12 122.43(4) . . ?
P6 Ag9 Ag13 125.27(4) . . ?
Pt1 Ag10 Ag2 58.201(12) . . ?
Pt1 Ag10 Ag4 57.965(12) . . ?
Pt1 Ag10 Ag5 58.616(11) . . ?
Pt1 Ag10 Ag9 57.577(11) . . ?
Pt1 Ag10 Ag13 58.428(12) . . ?
Ag2 Ag10 Ag4 57.753(13) . . ?
Ag5 Ag10 Ag2 60.637(13) . . ?
Ag5 Ag10 Ag4 107.119(16) . . ?
Ag5 Ag10 Ag9 109.074(17) . . ?
Ag5 Ag10 Ag13 61.228(14) . . ?
Ag9 Ag10 Ag2 105.523(16) . . ?
Ag9 Ag10 Ag4 58.622(13) . . ?
Ag9 Ag10 Ag13 61.314(14) . . ?
Ag13 Ag10 Ag2 108.937(16) . . ?
Ag13 Ag10 Ag4 108.134(16) . . ?
P7 Ag10 Pt1 173.40(4) . . ?
P7 Ag10 Ag2 121.74(4) . . ?
P7 Ag10 Ag4 128.24(4) . . ?
P7 Ag10 Ag5 115.11(4) . . ?
P7 Ag10 Ag9 126.36(4) . . ?
P7 Ag10 Ag13 117.59(4) . . ?
Pt1 Ag11 Ag5 58.073(12) . . ?
Pt1 Ag11 Ag6 57.486(11) . . ?
Pt1 Ag11 Ag7 57.740(11) . . ?
Pt1 Ag11 Ag12 58.418(12) . . ?
Pt1 Ag11 Ag13 59.019(12) . . ?
Pt1 Ag11 Ag14 114.424(15) . . ?
Ag5 Ag11 Ag6 59.740(13) . . ?
Ag5 Ag11 Ag7 107.215(16) . . ?
Ag5 Ag11 Ag14 120.246(17) . . ?
Ag6 Ag11 Ag14 171.260(18) . . ?
Ag7 Ag11 Ag6 59.163(13) . . ?
Ag7 Ag11 Ag14 114.572(16) . . ?
Ag12 Ag11 Ag5 108.011(17) . . ?
Ag12 Ag11 Ag6 107.309(16) . . ?
Ag12 Ag11 Ag7 59.985(13) . . ?
Ag12 Ag11 Ag14 64.056(13) . . ?
Ag13 Ag11 Ag5 61.430(14) . . ?
Ag13 Ag11 Ag6 108.687(17) . . ?
Ag13 Ag11 Ag7 107.609(16) . . ?
Ag13 Ag11 Ag12 59.200(13) . . ?
Ag13 Ag11 Ag14 66.327(14) . . ?
S4 Ag11 Pt1 163.30(4) . . ?
S4 Ag11 Ag5 134.96(4) . . ?
S4 Ag11 Ag6 135.05(4) . . ?
S4 Ag11 Ag7 115.65(4) . . ?
S4 Ag11 Ag12 104.88(4) . . ?
S4 Ag11 Ag13 114.53(4) . . ?
S4 Ag11 Ag14 52.10(4) . . ?
Pt1 Ag12 Ag7 58.067(11) . . ?
Pt1 Ag12 Ag8 58.610(12) . . ?
Pt1 Ag12 Ag9 56.959(11) . . ?
Pt1 Ag12 Ag11 58.704(12) . . ?
Pt1 Ag12 Ag13 59.301(12) . . ?
Pt1 Ag12 Ag14 115.048(15) . . ?
Ag7 Ag12 Ag9 105.899(16) . . ?
Ag7 Ag12 Ag14 115.505(16) . . ?
Ag8 Ag12 Ag7 59.240(13) . . ?
Ag8 Ag12 Ag9 59.055(14) . . ?
Ag8 Ag12 Ag14 172.981(17) . . ?
Ag9 Ag12 Ag14 121.171(17) . . ?
Ag11 Ag12 Ag7 60.672(13) . . ?
Ag11 Ag12 Ag8 108.519(16) . . ?
Ag11 Ag12 Ag9 107.681(16) . . ?
Ag11 Ag12 Ag14 64.502(13) . . ?
Ag13 Ag12 Ag7 108.583(16) . . ?
Ag13 Ag12 Ag8 109.696(17) . . ?
Ag13 Ag12 Ag9 61.505(14) . . ?
Ag13 Ag12 Ag11 59.731(13) . . ?
Ag13 Ag12 Ag14 66.663(14) . . ?
S5 Ag12 Pt1 163.23(4) . . ?
S5 Ag12 Ag7 134.74(4) . . ?
S5 Ag12 Ag8 134.52(4) . . ?
S5 Ag12 Ag9 117.10(4) . . ?
S5 Ag12 Ag11 114.64(4) . . ?
S5 Ag12 Ag13 103.93(4) . . ?
S5 Ag12 Ag14 52.34(4) . . ?
Pt1 Ag13 Ag5 57.619(11) . . ?
Pt1 Ag13 Ag9 56.711(11) . . ?
Pt1 Ag13 Ag10 58.253(12) . . ?
Pt1 Ag13 Ag11 59.100(12) . . ?
Pt1 Ag13 Ag12 59.088(12) . . ?
Ag5 Ag13 Ag9 105.171(16) . . ?
Ag10 Ag13 Ag5 58.563(13) . . ?
Ag10 Ag13 Ag9 58.985(14) . . ?
Ag11 Ag13 Ag5 60.038(13) . . ?
Ag11 Ag13 Ag9 108.277(16) . . ?
Ag11 Ag13 Ag10 107.960(16) . . ?
Ag12 Ag13 Ag5 108.380(16) . . ?
Ag12 Ag13 Ag9 60.948(14) . . ?
Ag12 Ag13 Ag10 109.075(17) . . ?
Ag12 Ag13 Ag11 61.069(14) . . ?
S6 Ag13 Pt1 160.38(4) . . ?
S6 Ag13 Ag5 116.81(4) . . ?
S6 Ag13 Ag9 136.78(4) . . ?
S6 Ag13 Ag10 137.90(4) . . ?
S6 Ag13 Ag11 101.41(4) . . ?
S6 Ag13 Ag12 111.36(4) . . ?
Ag12 Ag14 Ag11 51.442(12) . . ?
S4 Ag14 Ag11 46.26(3) . . ?
S4 Ag14 Ag12 89.29(3) . . ?
S4 Ag14 S5 119.10(5) . . ?
S4 Ag14 S6 111.01(5) . . ?
S5 Ag14 Ag11 96.30(3) . . ?
S5 Ag14 Ag12 46.44(3) . . ?
S5 Ag14 S6 110.60(5) . . ?
S6 Ag14 Ag11 85.57(3) . . ?
S6 Ag14 Ag12 92.95(3) . . ?
P8 Ag14 Ag11 149.59(5) . . ?
P8 Ag14 Ag12 149.81(5) . . ?
P8 Ag14 S4 103.53(6) . . ?
P8 Ag14 S5 104.28(6) . . ?
P8 Ag14 S6 107.20(5) . . ?
Ag2 S1 Ag1 81.75(4) . . ?
C1 S1 Ag1 104.9(2) . . ?
C1 S1 Ag2 109.0(2) . . ?
Ag3 S2 Ag1 83.77(5) . . ?
C7 S2 Ag1 96.7(2) . . ?
C7 S2 Ag3 112.2(2) . . ?
Ag4 S3 Ag1 80.94(5) . . ?
C13 S3 Ag1 98.1(2) . . ?
C13 S3 Ag4 110.7(2) . . ?
Ag11 S4 Ag14 81.63(5) . . ?
C19 S4 Ag11 114.3(2) . . ?
C19 S4 Ag14 96.8(2) . . ?
Ag12 S5 Ag14 81.22(4) . . ?
C25 S5 Ag12 109.8(2) . . ?
C25 S5 Ag14 103.1(2) . . ?
Ag13 S6 Ag14 83.47(4) . . ?
C31 S6 Ag13 110.0(2) . . ?
C31 S6 Ag14 98.0(2) . . ?
C37 P1 Ag1 114.1(2) . . ?
C37 P1 C43 104.2(3) . . ?
C43 P1 Ag1 113.5(2) . . ?
C49 P1 Ag1 117.1(2) . . ?
C49 P1 C37 102.4(3) . . ?
C49 P1 C43 104.0(3) . . ?
C55 P2 Ag5 114.9(2) . . ?
C55 P2 C61 104.3(3) . . ?
C55 P2 C67 105.3(3) . . ?
C61 P2 Ag5 112.04(19) . . ?
C61 P2 C67 101.5(3) . . ?
C67 P2 Ag5 117.28(19) . . ?
C73 P3 Ag6 114.52(19) . . ?
C73 P3 C85 100.3(3) . . ?
C79 P3 Ag6 113.99(19) . . ?
C79 P3 C73 103.0(3) . . ?
C79 P3 C85 107.0(3) . . ?
C85 P3 Ag6 116.33(19) . . ?
C91 P4 Ag7 110.5(2) . . ?
C91 P4 C97 105.2(3) . . ?
C91 P4 C103 102.1(3) . . ?
C97 P4 Ag7 117.8(2) . . ?
C103 P4 Ag7 118.0(2) . . ?
C103 P4 C97 101.5(3) . . ?
C109 P5 Ag8 117.4(2) . . ?
C109 P5 C115 103.9(3) . . ?
C115 P5 Ag8 115.06(18) . . ?
C121 P5 Ag8 112.4(2) . . ?
C121 P5 C109 104.0(3) . . ?
C121 P5 C115 102.3(3) . . ?
C127 P6 Ag9 113.7(2) . . ?
C133 P6 Ag9 113.01(19) . . ?
C133 P6 C127 102.8(3) . . ?
C133 P6 C139 103.3(3) . . ?
C139 P6 Ag9 117.5(2) . . ?
C139 P6 C127 104.9(3) . . ?
C145 P7 Ag10 114.7(2) . . ?
C151 P7 Ag10 115.3(2) . . ?
C151 P7 C145 104.8(3) . . ?
C157 P7 Ag10 114.6(2) . . ?
C157 P7 C145 104.1(3) . . ?
C157 P7 C151 101.8(3) . . ?
C163 P8 Ag14 117.1(2) . . ?
C163 P8 C169 101.6(3) . . ?
C163 P8 C175 103.8(4) . . ?
C169 P8 Ag14 116.4(3) . . ?
C169 P8 C175 103.6(3) . . ?
C175 P8 Ag14 112.5(2) . . ?
C2 C1 S1 122.2(5) . . ?
C2 C1 C6 116.2(6) . . ?
C6 C1 S1 121.6(5) . . ?
C1 C2 Cl1 120.2(5) . . ?
C1 C2 C3 121.9(7) . . ?
C3 C2 Cl1 117.9(6) . . ?
C2 C3 H3 120.5 . . ?
C4 C3 C2 118.9(7) . . ?
C4 C3 H3 120.5 . . ?
C3 C4 F1 119.1(7) . . ?
C3 C4 C5 122.6(7) . . ?
C5 C4 F1 118.3(8) . . ?
C4 C5 H5 120.9 . . ?
C4 C5 C6 118.1(7) . . ?
C6 C5 H5 120.9 . . ?
C1 C6 H6 118.8 . . ?
C5 C6 C1 122.3(6) . . ?
C5 C6 H6 118.8 . . ?
C8 C7 S2 120.5(5) . . ?
C12 C7 S2 123.4(5) . . ?
C12 C7 C8 116.1(6) . . ?
C7 C8 Cl18 120.3(6) . . ?
C9 C8 Cl18 117.4(6) . . ?
C9 C8 C7 122.2(8) . . ?
C8 C9 H9 120.5 . . ?
C10 C9 C8 119.1(7) . . ?
C10 C9 H9 120.5 . . ?
F2 C10 C11 117.9(8) . . ?
C9 C10 F2 119.7(7) . . ?
C9 C10 C11 122.4(7) . . ?
C10 C11 H11 121.4 . . ?
C10 C11 C12 117.1(7) . . ?
C12 C11 H11 121.4 . . ?
C7 C12 C11 123.1(7) . . ?
C7 C12 H12 118.4 . . ?
C11 C12 H12 118.4 . . ?
C14 C13 S3 123.2(6) . . ?
C14 C13 C18 114.5(7) . . ?
C18 C13 S3 122.2(5) . . ?
C13 C14 Cl3 119.2(7) . . ?
C13 C14 C15 124.1(9) . . ?
C15 C14 Cl3 116.7(7) . . ?
C14 C15 H15 121.3 . . ?
C16 C15 C14 117.3(8) . . ?
C16 C15 H15 121.3 . . ?
C15 C16 F3 117.2(9) . . ?
C15 C16 C17 122.8(8) . . ?
C17 C16 F3 120.0(10) . . ?
C16 C17 H17 121.3 . . ?
C16 C17 C18 117.4(9) . . ?
C18 C17 H17 121.3 . . ?
C13 C18 H18 118.1 . . ?
C17 C18 C13 123.9(7) . . ?
C17 C18 H18 118.1 . . ?
C20 C19 S4 120.3(5) . . ?
C24 C19 S4 123.5(5) . . ?
C24 C19 C20 116.1(6) . . ?
C19 C20 Cl4 121.5(5) . . ?
C21 C20 Cl4 116.3(6) . . ?
C21 C20 C19 122.2(7) . . ?
C20 C21 H21 121.3 . . ?
C22 C21 C20 117.5(7) . . ?
C22 C21 H21 121.3 . . ?
F4 C22 C23 118.5(8) . . ?
C21 C22 F4 118.3(8) . . ?
C21 C22 C23 123.2(7) . . ?
C22 C23 H23 121.2 . . ?
C24 C23 C22 117.6(7) . . ?
C24 C23 H23 121.2 . . ?
C19 C24 H24 118.3 . . ?
C23 C24 C19 123.3(7) . . ?
C23 C24 H24 118.3 . . ?
C26 C25 S5 120.9(5) . . ?
C26 C25 C30 116.9(6) . . ?
C30 C25 S5 122.1(5) . . ?
C25 C26 Cl5 120.8(6) . . ?
C27 C26 Cl5 116.9(6) . . ?
C27 C26 C25 122.3(7) . . ?
C26 C27 H27 121.1 . . ?
C28 C27 C26 117.9(7) . . ?
C28 C27 H27 121.1 . . ?
F5 C28 C29 118.4(8) . . ?
C27 C28 F5 118.3(8) . . ?
C27 C28 C29 123.2(7) . . ?
C28 C29 H29 121.2 . . ?
C28 C29 C30 117.6(7) . . ?
C30 C29 H29 121.2 . . ?
C25 C30 H30 119.0 . . ?
C29 C30 C25 122.0(7) . . ?
C29 C30 H30 119.0 . . ?
C32 C31 S6 121.2(5) . . ?
C32 C31 C36 116.2(5) . . ?
C36 C31 S6 122.6(4) . . ?
C31 C32 Cl6 121.2(5) . . ?
C33 C32 Cl6 116.8(5) . . ?
C33 C32 C31 121.9(6) . . ?
C32 C33 H33 120.7 . . ?
C34 C33 C32 118.5(6) . . ?
C34 C33 H33 120.7 . . ?
C33 C34 F6 118.8(6) . . ?
C33 C34 C35 122.7(6) . . ?
C35 C34 F6 118.5(6) . . ?
C34 C35 H35 121.1 . . ?
C34 C35 C36 117.8(6) . . ?
C36 C35 H35 121.1 . . ?
C31 C36 H36 118.6 . . ?
C35 C36 C31 122.9(6) . . ?
C35 C36 H36 118.6 . . ?
C38 C37 P1 117.4(6) . . ?
C38 C37 C42 118.6(7) . . ?
C42 C37 P1 124.0(6) . . ?
C37 C38 H38 119.8 . . ?
C37 C38 C39 120.4(8) . . ?
C39 C38 H38 119.8 . . ?
C38 C39 H39 120.0 . . ?
C40 C39 C38 120.0(8) . . ?
C40 C39 H39 120.0 . . ?
C39 C40 H40 119.7 . . ?
C39 C40 C41 120.6(8) . . ?
C41 C40 H40 119.7 . . ?
C40 C41 H41 120.1 . . ?
C40 C41 C42 119.9(8) . . ?
C42 C41 H41 120.1 . . ?
C37 C42 C41 120.6(8) . . ?
C37 C42 H42 119.7 . . ?
C41 C42 H42 119.7 . . ?
C44 C43 P1 118.3(5) . . ?
C44 C43 C48 118.8(7) . . ?
C48 C43 P1 122.8(6) . . ?
C43 C44 H44 119.3 . . ?
C43 C44 C45 121.3(7) . . ?
C45 C44 H44 119.3 . . ?
C44 C45 H45 119.7 . . ?
C46 C45 C44 120.5(8) . . ?
C46 C45 H45 119.7 . . ?
C45 C46 H46 120.1 . . ?
C45 C46 C47 119.8(8) . . ?
C47 C46 H46 120.1 . . ?
C46 C47 H47 120.4 . . ?
C48 C47 C46 119.3(8) . . ?
C48 C47 H47 120.4 . . ?
C43 C48 H48 119.9 . . ?
C47 C48 C43 120.2(8) . . ?
C47 C48 H48 119.9 . . ?
C50 C49 P1 124.6(7) . . ?
C54 C49 P1 117.2(6) . . ?
C54 C49 C50 118.2(8) . . ?
C49 C50 H50 120.1 . . ?
C49 C50 C51 119.8(10) . . ?
C51 C50 H50 120.1 . . ?
C50 C51 H51 120.1 . . ?
C52 C51 C50 119.8(10) . . ?
C52 C51 H51 120.1 . . ?
C51 C52 H52 120.0 . . ?
C53 C52 C51 119.9(9) . . ?
C53 C52 H52 120.0 . . ?
C52 C53 H53 119.0 . . ?
C52 C53 C54 122.0(10) . . ?
C54 C53 H53 119.0 . . ?
C49 C54 H54 119.9 . . ?
C53 C54 C49 120.1(9) . . ?
C53 C54 H54 119.9 . . ?
C56 C55 P2 121.4(5) . . ?
C60 C55 P2 119.8(5) . . ?
C60 C55 C56 118.8(6) . . ?
C55 C56 H56 119.8 . . ?
C57 C56 C55 120.4(7) . . ?
C57 C56 H56 119.8 . . ?
C56 C57 H57 119.9 . . ?
C58 C57 C56 120.3(7) . . ?
C58 C57 H57 119.9 . . ?
C57 C58 H58 119.9 . . ?
C59 C58 C57 120.2(7) . . ?
C59 C58 H58 119.9 . . ?
C58 C59 H59 119.9 . . ?
C58 C59 C60 120.1(7) . . ?
C60 C59 H59 119.9 . . ?
C55 C60 C59 120.2(6) . . ?
C55 C60 H60 119.9 . . ?
C59 C60 H60 119.9 . . ?
C62 C61 P2 122.9(5) . . ?
C66 C61 P2 119.3(5) . . ?
C66 C61 C62 117.8(6) . . ?
C61 C62 H62 119.8 . . ?
C63 C62 C61 120.3(6) . . ?
C63 C62 H62 119.8 . . ?
C62 C63 H63 119.9 . . ?
C64 C63 C62 120.2(6) . . ?
C64 C63 H63 119.9 . . ?
C63 C64 H64 120.0 . . ?
C65 C64 C63 120.0(7) . . ?
C65 C64 H64 120.0 . . ?
C64 C65 H65 120.0 . . ?
C66 C65 C64 120.1(7) . . ?
C66 C65 H65 120.0 . . ?
C61 C66 H66 119.2 . . ?
C65 C66 C61 121.5(6) . . ?
C65 C66 H66 119.2 . . ?
C68 C67 P2 117.9(5) . . ?
C68 C67 C72 118.4(6) . . ?
C72 C67 P2 123.5(5) . . ?
C67 C68 H68 119.7 . . ?
C67 C68 C69 120.6(7) . . ?
C69 C68 H68 119.7 . . ?
C68 C69 H69 120.2 . . ?
C70 C69 C68 119.6(8) . . ?
C70 C69 H69 120.2 . . ?
C69 C70 H70 119.1 . . ?
C71 C70 C69 121.7(7) . . ?
C71 C70 H70 119.1 . . ?
C70 C71 H71 120.1 . . ?
C70 C71 C72 119.9(7) . . ?
C72 C71 H71 120.1 . . ?
C67 C72 C71 119.7(7) . . ?
C67 C72 H72 120.1 . . ?
C71 C72 H72 120.1 . . ?
C74 C73 P3 117.8(5) . . ?
C74 C73 C78 119.1(6) . . ?
C78 C73 P3 123.1(5) . . ?
C73 C74 H74 119.6 . . ?
C73 C74 C75 120.8(6) . . ?
C75 C74 H74 119.6 . . ?
C74 C75 H75 120.4 . . ?
C76 C75 C74 119.2(7) . . ?
C76 C75 H75 120.4 . . ?
C75 C76 H76 119.6 . . ?
C77 C76 C75 120.7(7) . . ?
C77 C76 H76 119.6 . . ?
C76 C77 H77 119.9 . . ?
C76 C77 C78 120.2(7) . . ?
C78 C77 H77 119.9 . . ?
C73 C78 H78 120.1 . . ?
C77 C78 C73 119.8(7) . . ?
C77 C78 H78 120.1 . . ?
C80 C79 P3 117.1(5) . . ?
C84 C79 P3 124.2(5) . . ?
C84 C79 C80 118.5(6) . . ?
C79 C80 H80 119.4 . . ?
C79 C80 C81 121.1(6) . . ?
C81 C80 H80 119.4 . . ?
C80 C81 H81 120.6 . . ?
C82 C81 C80 118.8(7) . . ?
C82 C81 H81 120.6 . . ?
C81 C82 H82 119.4 . . ?
C83 C82 C81 121.1(7) . . ?
C83 C82 H82 119.4 . . ?
C82 C83 H83 120.2 . . ?
C82 C83 C84 119.7(7) . . ?
C84 C83 H83 120.2 . . ?
C79 C84 C83 120.7(7) . . ?
C79 C84 H84 119.7 . . ?
C83 C84 H84 119.7 . . ?
C86 C85 P3 122.0(5) . . ?
C90 C85 P3 119.2(4) . . ?
C90 C85 C86 118.7(6) . . ?
C85 C86 H86 119.8 . . ?
C87 C86 C85 120.4(6) . . ?
C87 C86 H86 119.8 . . ?
C86 C87 H87 120.1 . . ?
C88 C87 C86 119.8(6) . . ?
C88 C87 H87 120.1 . . ?
C87 C88 H88 120.0 . . ?
C87 C88 C89 120.0(6) . . ?
C89 C88 H88 120.0 . . ?
C88 C89 H89 120.2 . . ?
C90 C89 C88 119.6(6) . . ?
C90 C89 H89 120.2 . . ?
C85 C90 H90 119.3 . . ?
C89 C90 C85 121.4(6) . . ?
C89 C90 H90 119.3 . . ?
C92 C91 P4 118.1(5) . . ?
C96 C91 P4 124.1(5) . . ?
C96 C91 C92 117.8(6) . . ?
C91 C92 H92 119.4 . . ?
C93 C92 C91 121.3(6) . . ?
C93 C92 H92 119.4 . . ?
C92 C93 H93 120.3 . . ?
C94 C93 C92 119.3(6) . . ?
C94 C93 H93 120.3 . . ?
C93 C94 H94 119.7 . . ?
C95 C94 C93 120.6(6) . . ?
C95 C94 H94 119.7 . . ?
C94 C95 H95 120.1 . . ?
C94 C95 C96 119.8(6) . . ?
C96 C95 H95 120.1 . . ?
C91 C96 H96 119.5 . . ?
C95 C96 C91 121.0(6) . . ?
C95 C96 H96 119.5 . . ?
C98 C97 P4 118.6(5) . . ?
C98 C97 C102 119.3(6) . . ?
C102 C97 P4 122.1(5) . . ?
C97 C98 H98 120.5 . . ?
C99 C98 C97 119.1(7) . . ?
C99 C98 H98 120.5 . . ?
C98 C99 H99 119.4 . . ?
C100 C99 C98 121.2(7) . . ?
C100 C99 H99 119.4 . . ?
C99 C100 H100 120.0 . . ?
C101 C100 C99 120.1(7) . . ?
C101 C100 H100 120.0 . . ?
C100 C101 H101 120.0 . . ?
C100 C101 C102 120.0(7) . . ?
C102 C101 H101 120.0 . . ?
C97 C102 H102 119.9 . . ?
C101 C102 C97 120.2(6) . . ?
C101 C102 H102 119.9 . . ?
C104 C103 P4 122.9(5) . . ?
C108 C103 P4 117.7(5) . . ?
C108 C103 C104 119.1(6) . . ?
C103 C104 H104 120.4 . . ?
C105 C104 C103 119.2(7) . . ?
C105 C104 H104 120.4 . . ?
C104 C105 H105 119.5 . . ?
C106 C105 C104 121.0(8) . . ?
C106 C105 H105 119.5 . . ?
C105 C106 H106 119.9 . . ?
C105 C106 C107 120.2(7) . . ?
C107 C106 H106 119.9 . . ?
C106 C107 H107 119.8 . . ?
C106 C107 C108 120.4(8) . . ?
C108 C107 H107 119.8 . . ?
C103 C108 C107 120.1(7) . . ?
C103 C108 H108 120.0 . . ?
C107 C108 H108 120.0 . . ?
C110 C109 P5 122.0(5) . . ?
C114 C109 P5 118.0(5) . . ?
C114 C109 C110 120.0(6) . . ?
C109 C110 H110 120.3 . . ?
C109 C110 C111 119.5(7) . . ?
C111 C110 H110 120.3 . . ?
C110 C111 H111 119.5 . . ?
C112 C111 C110 120.9(7) . . ?
C112 C111 H111 119.5 . . ?
C111 C112 H112 120.0 . . ?
C111 C112 C113 120.0(7) . . ?
C113 C112 H112 120.0 . . ?
C112 C113 H113 120.2 . . ?
C112 C113 C114 119.7(7) . . ?
C114 C113 H113 120.2 . . ?
C109 C114 C113 119.8(6) . . ?
C109 C114 H114 120.1 . . ?
C113 C114 H114 120.1 . . ?
C116 C115 P5 122.5(5) . . ?
C120 C115 P5 118.9(5) . . ?
C120 C115 C116 118.6(6) . . ?
C115 C116 H116 119.8 . . ?
C117 C116 C115 120.4(6) . . ?
C117 C116 H116 119.8 . . ?
C116 C117 H117 120.1 . . ?
C118 C117 C116 119.8(7) . . ?
C118 C117 H117 120.1 . . ?
C117 C118 H118 119.8 . . ?
C117 C118 C119 120.3(7) . . ?
C119 C118 H118 119.8 . . ?
C118 C119 H119 120.1 . . ?
C120 C119 C118 119.9(7) . . ?
C120 C119 H119 120.1 . . ?
C115 C120 H120 119.5 . . ?
C119 C120 C115 120.9(6) . . ?
C119 C120 H120 119.5 . . ?
C122 C121 P5 123.0(6) . . ?
C126 C121 P5 117.4(5) . . ?
C126 C121 C122 119.5(6) . . ?
C121 C122 H122 120.6 . . ?
C121 C122 C123 118.8(7) . . ?
C123 C122 H122 120.6 . . ?
C122 C123 H123 119.3 . . ?
C124 C123 C122 121.3(7) . . ?
C124 C123 H123 119.3 . . ?
C123 C124 H124 120.0 . . ?
C123 C124 C125 120.0(8) . . ?
C125 C124 H124 120.0 . . ?
C124 C125 H125 120.5 . . ?
C126 C125 C124 119.1(8) . . ?
C126 C125 H125 120.5 . . ?
C121 C126 C125 121.3(7) . . ?
C121 C126 H126 119.4 . . ?
C125 C126 H126 119.4 . . ?
C128 C127 P6 117.8(5) . . ?
C128 C127 C132 118.2(6) . . ?
C132 C127 P6 124.0(6) . . ?
C127 C128 H128 119.1 . . ?
C129 C128 C127 121.9(7) . . ?
C129 C128 H128 119.1 . . ?
C128 C129 H129 120.6 . . ?
C130 C129 C128 118.8(8) . . ?
C130 C129 H129 120.6 . . ?
C129 C130 H130 119.5 . . ?
C131 C130 C129 121.1(8) . . ?
C131 C130 H130 119.5 . . ?
C130 C131 H131 119.9 . . ?
C130 C131 C132 120.3(7) . . ?
C132 C131 H131 119.9 . . ?
C127 C132 C131 119.7(7) . . ?
C127 C132 H132 120.2 . . ?
C131 C132 H132 120.2 . . ?
C134 C133 P6 123.1(5) . . ?
C138 C133 P6 118.3(5) . . ?
C138 C133 C134 118.5(6) . . ?
C133 C134 H134 119.4 . . ?
C135 C134 C133 121.2(6) . . ?
C135 C134 H134 119.4 . . ?
C134 C135 H135 120.3 . . ?
C136 C135 C134 119.4(7) . . ?
C136 C135 H135 120.3 . . ?
C135 C136 H136 119.7 . . ?
C137 C136 C135 120.7(7) . . ?
C137 C136 H136 119.7 . . ?
C136 C137 H137 119.3 . . ?
C136 C137 C138 121.4(7) . . ?
C138 C137 H137 119.3 . . ?
C133 C138 H138 120.6 . . ?
C137 C138 C133 118.8(7) . . ?
C137 C138 H138 120.6 . . ?
C140 C139 P6 122.4(5) . . ?
C144 C139 P6 119.1(5) . . ?
C144 C139 C140 118.5(7) . . ?
C139 C140 H140 119.4 . . ?
C141 C140 C139 121.2(8) . . ?
C141 C140 H140 119.4 . . ?
C140 C141 H141 119.6 . . ?
C140 C141 C142 120.8(8) . . ?
C142 C141 H141 119.6 . . ?
C141 C142 H142 120.2 . . ?
C141 C142 C143 119.6(8) . . ?
C143 C142 H142 120.2 . . ?
C142 C143 H143 120.5 . . ?
C142 C143 C144 119.0(8) . . ?
C144 C143 H143 120.5 . . ?
C139 C144 C143 120.9(7) . . ?
C139 C144 H144 119.6 . . ?
C143 C144 H144 119.6 . . ?
C146 C145 P7 118.2(5) . . ?
C146 C145 C150 118.6(7) . . ?
C150 C145 P7 123.2(6) . . ?
C145 C146 H146 119.2 . . ?
C145 C146 C147 121.6(7) . . ?
C147 C146 H146 119.2 . . ?
C146 C147 H147 120.9 . . ?
C148 C147 C146 118.2(7) . . ?
C148 C147 H147 120.9 . . ?
C147 C148 H148 119.4 . . ?
C149 C148 C147 121.3(7) . . ?
C149 C148 H148 119.4 . . ?
C148 C149 H149 119.9 . . ?
C148 C149 C150 120.3(7) . . ?
C150 C149 H149 119.9 . . ?
C145 C150 C149 120.0(7) . . ?
C145 C150 H150 120.0 . . ?
C149 C150 H150 120.0 . . ?
C152 C151 P7 117.5(5) . . ?
C152 C151 C156 119.2(6) . . ?
C156 C151 P7 123.3(5) . . ?
C151 C152 H152 120.3 . . ?
C153 C152 C151 119.5(7) . . ?
C153 C152 H152 120.3 . . ?
C152 C153 H153 119.6 . . ?
C154 C153 C152 120.7(8) . . ?
C154 C153 H153 119.6 . . ?
C153 C154 H154 120.0 . . ?
C153 C154 C155 120.0(8) . . ?
C155 C154 H154 120.0 . . ?
C154 C155 H155 119.9 . . ?
C156 C155 C154 120.2(8) . . ?
C156 C155 H155 119.9 . . ?
C151 C156 H156 119.8 . . ?
C155 C156 C151 120.3(7) . . ?
C155 C156 H156 119.8 . . ?
C158 C157 P7 124.5(6) . . ?
C158 C157 C162 117.4(7) . . ?
C162 C157 P7 118.1(5) . . ?
C157 C158 H158 119.6 . . ?
C157 C158 C159 120.9(8) . . ?
C159 C158 H158 119.6 . . ?
C158 C159 H159 120.0 . . ?
C160 C159 C158 120.0(8) . . ?
C160 C159 H159 120.0 . . ?
C159 C160 H160 119.8 . . ?
C161 C160 C159 120.4(8) . . ?
C161 C160 H160 119.8 . . ?
C160 C161 H161 119.6 . . ?
C160 C161 C162 120.8(9) . . ?
C162 C161 H161 119.6 . . ?
C157 C162 H162 119.8 . . ?
C161 C162 C157 120.5(8) . . ?
C161 C162 H162 119.8 . . ?
C164 C163 P8 125.0(7) . . ?
C164 C163 C168 117.8(8) . . ?
C168 C163 P8 117.2(6) . . ?
C163 C164 H164 119.7 . . ?
C163 C164 C165 120.6(10) . . ?
C165 C164 H164 119.7 . . ?
C164 C165 H165 120.3 . . ?
C166 C165 C164 119.5(11) . . ?
C166 C165 H165 120.3 . . ?
C165 C166 H166 119.5 . . ?
C167 C166 C165 121.0(10) . . ?
C167 C166 H166 119.5 . . ?
C166 C167 H167 120.1 . . ?
C166 C167 C168 119.7(10) . . ?
C168 C167 H167 120.1 . . ?
C163 C168 H168 119.4 . . ?
C167 C168 C163 121.2(9) . . ?
C167 C168 H168 119.4 . . ?
C170 C169 P8 117.3(6) . . ?
C170 C169 C174 119.1(7) . . ?
C174 C169 P8 123.6(7) . . ?
C169 C170 H170 120.2 . . ?
C169 C170 C171 119.6(8) . . ?
C171 C170 H170 120.2 . . ?
C170 C171 H171 119.9 . . ?
C172 C171 C170 120.3(9) . . ?
C172 C171 H171 119.9 . . ?
C171 C172 H172 119.5 . . ?
C171 C172 C173 121.1(9) . . ?
C173 C172 H172 119.5 . . ?
C172 C173 H173 120.1 . . ?
C172 C173 C174 119.7(9) . . ?
C174 C173 H173 120.1 . . ?
C169 C174 H174 119.9 . . ?
C173 C174 C169 120.2(9) . . ?
C173 C174 H174 119.9 . . ?
C176 C175 P8 123.3(7) . . ?
C176 C175 C180 120.0(8) . . ?
C180 C175 P8 116.7(6) . . ?
C175 C176 H176 120.4 . . ?
C175 C176 C177 119.2(9) . . ?
C177 C176 H176 120.4 . . ?
C176 C177 H177 120.0 . . ?
C178 C177 C176 120.0(9) . . ?
C178 C177 H177 120.0 . . ?
C177 C178 H178 119.9 . . ?
C179 C178 C177 120.2(9) . . ?
C179 C178 H178 119.9 . . ?
C178 C179 H179 119.7 . . ?
C178 C179 C180 120.5(9) . . ?
C180 C179 H179 119.7 . . ?
C175 C180 H180 120.0 . . ?
C179 C180 C175 120.0(8) . . ?
C179 C180 H180 120.0 . . ?
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
Pt1 Ag2 2.7653(4) . ?
Pt1 Ag3 2.7386(4) . ?
Pt1 Ag4 2.7737(5) . ?
Pt1 Ag5 2.7466(4) . ?
Pt1 Ag6 2.7393(4) . ?
Pt1 Ag7 2.7489(4) . ?
Pt1 Ag8 2.7689(4) . ?
Pt1 Ag9 2.7162(4) . ?
Pt1 Ag10 2.7588(4) . ?
Pt1 Ag11 2.7663(4) . ?
Pt1 Ag12 2.7579(4) . ?
Pt1 Ag13 2.7640(4) . ?
Ag1 Ag2 3.3421(6) . ?
Ag1 Ag4 3.3270(6) . ?
Ag1 S1 2.6538(15) . ?
Ag1 S2 2.6504(16) . ?
Ag1 S3 2.6775(16) . ?
Ag1 P1 2.5492(17) . ?
Ag2 Ag3 2.8891(6) . ?
Ag2 Ag4 2.8371(5) . ?
Ag2 Ag5 2.9132(6) . ?
Ag2 Ag6 2.9206(6) . ?
Ag2 Ag10 2.9198(5) . ?
Ag2 S1 2.4476(15) . ?
Ag3 Ag4 2.8371(6) . ?
Ag3 Ag6 2.9164(5) . ?
Ag3 Ag7 2.9257(6) . ?
Ag3 Ag8 2.8842(5) . ?
Ag3 S2 2.4133(14) . ?
Ag4 Ag8 2.9990(6) . ?
Ag4 Ag9 2.8559(6) . ?
Ag4 Ag10 2.9547(6) . ?
Ag4 S3 2.4407(15) . ?
Ag5 Ag6 2.8943(5) . ?
Ag5 Ag10 2.8499(5) . ?
Ag5 Ag11 2.8882(6) . ?
Ag5 Ag13 2.9278(5) . ?
Ag5 P2 2.4490(14) . ?
Ag6 Ag7 2.8845(5) . ?
Ag6 Ag11 2.9229(5) . ?
Ag6 P3 2.4488(14) . ?
Ag7 Ag8 2.8638(5) . ?
Ag7 Ag11 2.9202(5) . ?
Ag7 Ag12 2.9004(5) . ?
Ag7 P4 2.4502(15) . ?
Ag8 Ag9 2.8702(5) . ?
Ag8 Ag12 2.8939(6) . ?
Ag8 P5 2.4652(14) . ?
Ag9 Ag10 2.8773(5) . ?
Ag9 Ag12 2.9296(6) . ?
Ag9 Ag13 2.9453(6) . ?
Ag9 P6 2.4255(14) . ?
Ag10 Ag13 2.8987(6) . ?
Ag10 P7 2.4581(15) . ?
Ag11 Ag12 2.8814(5) . ?
Ag11 Ag13 2.8434(5) . ?
Ag11 Ag14 3.3259(6) . ?
Ag11 S4 2.4288(15) . ?
Ag12 Ag13 2.8279(5) . ?
Ag12 Ag14 3.3134(6) . ?
Ag12 S5 2.4297(15) . ?
Ag13 S6 2.4387(14) . ?
Ag14 S4 2.6527(15) . ?
Ag14 S5 2.6541(16) . ?
Ag14 S6 2.6611(15) . ?
Ag14 P8 2.5410(18) . ?
Cl1 C2 1.735(8) . ?
Cl3 C14 1.765(9) . ?
Cl4 C20 1.730(8) . ?
Cl5 C26 1.737(8) . ?
Cl6 C32 1.738(6) . ?
Cl18 C8 1.738(8) . ?
S1 C1 1.763(6) . ?
S2 C7 1.754(6) . ?
S3 C13 1.770(8) . ?
S4 C19 1.761(6) . ?
S5 C25 1.773(7) . ?
S6 C31 1.762(6) . ?
P1 C37 1.830(7) . ?
P1 C43 1.837(7) . ?
P1 C49 1.827(8) . ?
P2 C55 1.813(6) . ?
P2 C61 1.820(7) . ?
P2 C67 1.826(6) . ?
P3 C73 1.820(6) . ?
P3 C79 1.814(7) . ?
P3 C85 1.829(6) . ?
P4 C91 1.815(6) . ?
P4 C97 1.821(6) . ?
P4 C103 1.816(6) . ?
P5 C109 1.835(7) . ?
P5 C115 1.835(6) . ?
P5 C121 1.824(7) . ?
P6 C127 1.821(6) . ?
P6 C133 1.812(6) . ?
P6 C139 1.819(7) . ?
P7 C145 1.820(7) . ?
P7 C151 1.815(7) . ?
P7 C157 1.815(7) . ?
P8 C163 1.817(8) . ?
P8 C169 1.839(8) . ?
P8 C175 1.846(8) . ?
F1 C4 1.367(8) . ?
F2 C10 1.368(8) . ?
F3 C16 1.385(10) . ?
F4 C22 1.364(8) . ?
F5 C28 1.364(9) . ?
F6 C34 1.371(7) . ?
C1 C2 1.390(9) . ?
C1 C6 1.406(9) . ?
C2 C3 1.398(10) . ?
C3 H3 0.9500 . ?
C3 C4 1.349(12) . ?
C4 C5 1.367(11) . ?
C5 H5 0.9500 . ?
C5 C6 1.388(9) . ?
C6 H6 0.9500 . ?
C7 C8 1.409(9) . ?
C7 C12 1.385(9) . ?
C8 C9 1.372(11) . ?
C9 H9 0.9500 . ?
C9 C10 1.354(12) . ?
C10 C11 1.388(11) . ?
C11 H11 0.9500 . ?
C11 C12 1.390(10) . ?
C12 H12 0.9500 . ?
C13 C14 1.378(10) . ?
C13 C18 1.408(11) . ?
C14 C15 1.383(13) . ?
C15 H15 0.9500 . ?
C15 C16 1.366(15) . ?
C16 C17 1.369(13) . ?
C17 H17 0.9500 . ?
C17 C18 1.369(11) . ?
C18 H18 0.9500 . ?
C19 C20 1.407(9) . ?
C19 C24 1.401(9) . ?
C20 C21 1.402(10) . ?
C21 H21 0.9500 . ?
C21 C22 1.359(12) . ?
C22 C23 1.397(11) . ?
C23 H23 0.9500 . ?
C23 C24 1.363(9) . ?
C24 H24 0.9500 . ?
C25 C26 1.389(9) . ?
C25 C30 1.394(9) . ?
C26 C27 1.379(11) . ?
C27 H27 0.9500 . ?
C27 C28 1.356(12) . ?
C28 C29 1.375(12) . ?
C29 H29 0.9500 . ?
C29 C30 1.380(10) . ?
C30 H30 0.9500 . ?
C31 C32 1.386(8) . ?
C31 C36 1.408(9) . ?
C32 C33 1.385(9) . ?
C33 H33 0.9500 . ?
C33 C34 1.366(10) . ?
C34 C35 1.366(10) . ?
C35 H35 0.9500 . ?
C35 C36 1.370(9) . ?
C36 H36 0.9500 . ?
C37 C38 1.385(10) . ?
C37 C42 1.388(10) . ?
C38 H38 0.9500 . ?
C38 C39 1.395(12) . ?
C39 H39 0.9500 . ?
C39 C40 1.366(13) . ?
C40 H40 0.9500 . ?
C40 C41 1.366(13) . ?
C41 H41 0.9500 . ?
C41 C42 1.392(11) . ?
C42 H42 0.9500 . ?
C43 C44 1.373(10) . ?
C43 C48 1.398(10) . ?
C44 H44 0.9500 . ?
C44 C45 1.378(10) . ?
C45 H45 0.9500 . ?
C45 C46 1.354(11) . ?
C46 H46 0.9500 . ?
C46 C47 1.412(13) . ?
C47 H47 0.9500 . ?
C47 C48 1.386(11) . ?
C48 H48 0.9500 . ?
C49 C50 1.396(11) . ?
C49 C54 1.380(11) . ?
C50 H50 0.9500 . ?
C50 C51 1.415(13) . ?
C51 H51 0.9500 . ?
C51 C52 1.352(16) . ?
C52 H52 0.9500 . ?
C52 C53 1.349(14) . ?
C53 H53 0.9500 . ?
C53 C54 1.375(12) . ?
C54 H54 0.9500 . ?
C55 C56 1.403(8) . ?
C55 C60 1.380(9) . ?
C56 H56 0.9500 . ?
C56 C57 1.383(10) . ?
C57 H57 0.9500 . ?
C57 C58 1.378(11) . ?
C58 H58 0.9500 . ?
C58 C59 1.369(11) . ?
C59 H59 0.9500 . ?
C59 C60 1.407(10) . ?
C60 H60 0.9500 . ?
C61 C62 1.399(8) . ?
C61 C66 1.390(9) . ?
C62 H62 0.9500 . ?
C62 C63 1.387(10) . ?
C63 H63 0.9500 . ?
C63 C64 1.377(11) . ?
C64 H64 0.9500 . ?
C64 C65 1.373(10) . ?
C65 H65 0.9500 . ?
C65 C66 1.370(10) . ?
C66 H66 0.9500 . ?
C67 C68 1.387(9) . ?
C67 C72 1.398(9) . ?
C68 H68 0.9500 . ?
C68 C69 1.390(10) . ?
C69 H69 0.9500 . ?
C69 C70 1.356(12) . ?
C70 H70 0.9500 . ?
C70 C71 1.349(12) . ?
C71 H71 0.9500 . ?
C71 C72 1.401(10) . ?
C72 H72 0.9500 . ?
C73 C74 1.376(9) . ?
C73 C78 1.403(9) . ?
C74 H74 0.9500 . ?
C74 C75 1.397(9) . ?
C75 H75 0.9500 . ?
C75 C76 1.385(11) . ?
C76 H76 0.9500 . ?
C76 C77 1.364(11) . ?
C77 H77 0.9500 . ?
C77 C78 1.395(9) . ?
C78 H78 0.9500 . ?
C79 C80 1.389(9) . ?
C79 C84 1.389(8) . ?
C80 H80 0.9500 . ?
C80 C81 1.405(10) . ?
C81 H81 0.9500 . ?
C81 C82 1.379(10) . ?
C82 H82 0.9500 . ?
C82 C83 1.372(11) . ?
C83 H83 0.9500 . ?
C83 C84 1.400(10) . ?
C84 H84 0.9500 . ?
C85 C86 1.398(8) . ?
C85 C90 1.381(8) . ?
C86 H86 0.9500 . ?
C86 C87 1.387(9) . ?
C87 H87 0.9500 . ?
C87 C88 1.381(10) . ?
C88 H88 0.9500 . ?
C88 C89 1.395(9) . ?
C89 H89 0.9500 . ?
C89 C90 1.371(9) . ?
C90 H90 0.9500 . ?
C91 C92 1.394(9) . ?
C91 C96 1.392(9) . ?
C92 H92 0.9500 . ?
C92 C93 1.379(9) . ?
C93 H93 0.9500 . ?
C93 C94 1.378(10) . ?
C94 H94 0.9500 . ?
C94 C95 1.374(10) . ?
C95 H95 0.9500 . ?
C95 C96 1.379(9) . ?
C96 H96 0.9500 . ?
C97 C98 1.389(9) . ?
C97 C102 1.399(9) . ?
C98 H98 0.9500 . ?
C98 C99 1.379(10) . ?
C99 H99 0.9500 . ?
C99 C100 1.370(12) . ?
C100 H100 0.9500 . ?
C100 C101 1.366(11) . ?
C101 H101 0.9500 . ?
C101 C102 1.378(10) . ?
C102 H102 0.9500 . ?
C103 C104 1.410(9) . ?
C103 C108 1.377(9) . ?
C104 H104 0.9500 . ?
C104 C105 1.388(10) . ?
C105 H105 0.9500 . ?
C105 C106 1.348(13) . ?
C106 H106 0.9500 . ?
C106 C107 1.377(13) . ?
C107 H107 0.9500 . ?
C107 C108 1.384(10) . ?
C108 H108 0.9500 . ?
C109 C110 1.386(9) . ?
C109 C114 1.384(9) . ?
C110 H110 0.9500 . ?
C110 C111 1.395(10) . ?
C111 H111 0.9500 . ?
C111 C112 1.363(11) . ?
C112 H112 0.9500 . ?
C112 C113 1.388(11) . ?
C113 H113 0.9500 . ?
C113 C114 1.402(10) . ?
C114 H114 0.9500 . ?
C115 C116 1.395(9) . ?
C115 C120 1.386(9) . ?
C116 H116 0.9500 . ?
C116 C117 1.385(10) . ?
C117 H117 0.9500 . ?
C117 C118 1.372(11) . ?
C118 H118 0.9500 . ?
C118 C119 1.383(11) . ?
C119 H119 0.9500 . ?
C119 C120 1.372(9) . ?
C120 H120 0.9500 . ?
C121 C122 1.395(9) . ?
C121 C126 1.384(10) . ?
C122 H122 0.9500 . ?
C122 C123 1.406(11) . ?
C123 H123 0.9500 . ?
C123 C124 1.367(12) . ?
C124 H124 0.9500 . ?
C124 C125 1.395(12) . ?
C125 H125 0.9500 . ?
C125 C126 1.391(11) . ?
C126 H126 0.9500 . ?
C127 C128 1.386(10) . ?
C127 C132 1.391(9) . ?
C128 H128 0.9500 . ?
C128 C129 1.384(10) . ?
C129 H129 0.9500 . ?
C129 C130 1.376(12) . ?
C130 H130 0.9500 . ?
C130 C131 1.356(13) . ?
C131 H131 0.9500 . ?
C131 C132 1.407(11) . ?
C132 H132 0.9500 . ?
C133 C134 1.402(8) . ?
C133 C138 1.401(9) . ?
C134 H134 0.9500 . ?
C134 C135 1.372(9) . ?
C135 H135 0.9500 . ?
C135 C136 1.372(11) . ?
C136 H136 0.9500 . ?
C136 C137 1.359(11) . ?
C137 H137 0.9500 . ?
C137 C138 1.388(10) . ?
C138 H138 0.9500 . ?
C139 C140 1.396(9) . ?
C139 C144 1.367(9) . ?
C140 H140 0.9500 . ?
C140 C141 1.359(11) . ?
C141 H141 0.9500 . ?
C141 C142 1.367(12) . ?
C142 H142 0.9500 . ?
C142 C143 1.398(12) . ?
C143 H143 0.9500 . ?
C143 C144 1.404(11) . ?
C144 H144 0.9500 . ?
C145 C146 1.385(10) . ?
C145 C150 1.398(9) . ?
C146 H146 0.9500 . ?
C146 C147 1.402(10) . ?
C147 H147 0.9500 . ?
C147 C148 1.390(11) . ?
C148 H148 0.9500 . ?
C148 C149 1.362(12) . ?
C149 H149 0.9500 . ?
C149 C150 1.399(11) . ?
C150 H150 0.9500 . ?
C151 C152 1.404(9) . ?
C151 C156 1.405(9) . ?
C152 H152 0.9500 . ?
C152 C153 1.393(11) . ?
C153 H153 0.9500 . ?
C153 C154 1.384(12) . ?
C154 H154 0.9500 . ?
C154 C155 1.386(12) . ?
C155 H155 0.9500 . ?
C155 C156 1.385(10) . ?
C156 H156 0.9500 . ?
C157 C158 1.380(10) . ?
C157 C162 1.396(10) . ?
C158 H158 0.9500 . ?
C158 C159 1.399(11) . ?
C159 H159 0.9500 . ?
C159 C160 1.352(14) . ?
C160 H160 0.9500 . ?
C160 C161 1.349(13) . ?
C161 H161 0.9500 . ?
C161 C162 1.385(11) . ?
C162 H162 0.9500 . ?
C163 C164 1.380(12) . ?
C163 C168 1.389(11) . ?
C164 H164 0.9500 . ?
C164 C165 1.386(14) . ?
C165 H165 0.9500 . ?
C165 C166 1.370(17) . ?
C166 H166 0.9500 . ?
C166 C167 1.348(16) . ?
C167 H167 0.9500 . ?
C167 C168 1.375(13) . ?
C168 H168 0.9500 . ?
C169 C170 1.381(12) . ?
C169 C174 1.394(11) . ?
C170 H170 0.9500 . ?
C170 C171 1.394(12) . ?
C171 H171 0.9500 . ?
C171 C172 1.350(13) . ?
C172 H172 0.9500 . ?
C172 C173 1.367(14) . ?
C173 H173 0.9500 . ?
C173 C174 1.377(12) . ?
C174 H174 0.9500 . ?
C175 C176 1.359(11) . ?
C175 C180 1.386(10) . ?
C176 H176 0.9500 . ?
C176 C177 1.407(14) . ?
C177 H177 0.9500 . ?
C177 C178 1.361(15) . ?
C178 H178 0.9500 . ?
C178 C179 1.359(14) . ?
C179 H179 0.9500 . ?
C179 C180 1.367(11) . ?
C180 H180 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
Ag1 S1 C1 C2 -123.9(5) . . . . ?
Ag1 S1 C1 C6 54.5(5) . . . . ?
Ag1 S2 C7 C8 -115.0(6) . . . . ?
Ag1 S2 C7 C12 62.9(6) . . . . ?
Ag1 S3 C13 C14 -120.0(6) . . . . ?
Ag1 S3 C13 C18 56.7(6) . . . . ?
Ag1 P1 C37 C38 -40.8(6) . . . . ?
Ag1 P1 C37 C42 137.9(6) . . . . ?
Ag1 P1 C43 C44 -16.9(7) . . . . ?
Ag1 P1 C43 C48 167.9(6) . . . . ?
Ag1 P1 C49 C50 127.2(6) . . . . ?
Ag1 P1 C49 C54 -51.6(7) . . . . ?
Ag2 S1 C1 C2 149.9(5) . . . . ?
Ag2 S1 C1 C6 -31.7(6) . . . . ?
Ag3 S2 C7 C8 159.0(5) . . . . ?
Ag3 S2 C7 C12 -23.1(7) . . . . ?
Ag4 S3 C13 C14 156.7(6) . . . . ?
Ag4 S3 C13 C18 -26.7(7) . . . . ?
Ag5 P2 C55 C56 160.5(5) . . . . ?
Ag5 P2 C55 C60 -20.5(6) . . . . ?
Ag5 P2 C61 C62 149.5(5) . . . . ?
Ag5 P2 C61 C66 -29.5(5) . . . . ?
Ag5 P2 C67 C68 -50.0(6) . . . . ?
Ag5 P2 C67 C72 134.4(5) . . . . ?
Ag6 P3 C73 C74 51.5(5) . . . . ?
Ag6 P3 C73 C78 -130.0(5) . . . . ?
Ag6 P3 C79 C80 40.5(5) . . . . ?
Ag6 P3 C79 C84 -144.7(5) . . . . ?
Ag6 P3 C85 C86 -160.7(5) . . . . ?
Ag6 P3 C85 C90 16.4(6) . . . . ?
Ag7 P4 C91 C92 55.5(5) . . . . ?
Ag7 P4 C91 C96 -124.8(5) . . . . ?
Ag7 P4 C97 C98 12.4(6) . . . . ?
Ag7 P4 C97 C102 -166.5(5) . . . . ?
Ag7 P4 C103 C104 -139.3(5) . . . . ?
Ag7 P4 C103 C108 47.4(6) . . . . ?
Ag8 P5 C109 C110 163.8(5) . . . . ?
Ag8 P5 C109 C114 -17.1(6) . . . . ?
Ag8 P5 C115 C116 151.1(5) . . . . ?
Ag8 P5 C115 C120 -27.8(6) . . . . ?
Ag8 P5 C121 C122 133.7(5) . . . . ?
Ag8 P5 C121 C126 -49.1(6) . . . . ?
Ag9 P6 C127 C128 -51.3(5) . . . . ?
Ag9 P6 C127 C132 129.7(5) . . . . ?
Ag9 P6 C133 C134 146.3(5) . . . . ?
Ag9 P6 C133 C138 -36.4(6) . . . . ?
Ag9 P6 C139 C140 159.6(5) . . . . ?
Ag9 P6 C139 C144 -19.7(6) . . . . ?
Ag10 P7 C145 C146 -15.5(6) . . . . ?
Ag10 P7 C145 C150 163.2(5) . . . . ?
Ag10 P7 C151 C152 -26.6(6) . . . . ?
Ag10 P7 C151 C156 152.8(5) . . . . ?
Ag10 P7 C157 C158 125.0(6) . . . . ?
Ag10 P7 C157 C162 -57.7(6) . . . . ?
Ag11 S4 C19 C20 157.0(4) . . . . ?
Ag11 S4 C19 C24 -25.2(6) . . . . ?
Ag12 S5 C25 C26 160.1(5) . . . . ?
Ag12 S5 C25 C30 -23.3(6) . . . . ?
Ag13 S6 C31 C32 157.3(5) . . . . ?
Ag13 S6 C31 C36 -24.5(6) . . . . ?
Ag14 S4 C19 C20 -119.1(5) . . . . ?
Ag14 S4 C19 C24 58.6(5) . . . . ?
Ag14 S5 C25 C26 -114.6(6) . . . . ?
Ag14 S5 C25 C30 61.9(6) . . . . ?
Ag14 S6 C31 C32 -116.8(5) . . . . ?
Ag14 S6 C31 C36 61.4(5) . . . . ?
Ag14 P8 C163 C164 130.5(7) . . . . ?
Ag14 P8 C163 C168 -50.6(6) . . . . ?
Ag14 P8 C169 C170 -33.6(7) . . . . ?
Ag14 P8 C169 C174 147.5(6) . . . . ?
Ag14 P8 C175 C176 143.0(9) . . . . ?
Ag14 P8 C175 C180 -36.8(7) . . . . ?
Cl1 C2 C3 C4 -180.0(7) . . . . ?
Cl3 C14 C15 C16 179.0(8) . . . . ?
Cl4 C20 C21 C22 178.2(6) . . . . ?
Cl5 C26 C27 C28 -178.1(8) . . . . ?
Cl6 C32 C33 C34 -178.6(6) . . . . ?
Cl18 C8 C9 C10 176.7(7) . . . . ?
S1 C1 C2 Cl1 -0.9(8) . . . . ?
S1 C1 C2 C3 -179.8(6) . . . . ?
S1 C1 C6 C5 -179.9(5) . . . . ?
S2 C7 C8 Cl18 2.2(9) . . . . ?
S2 C7 C8 C9 179.3(6) . . . . ?
S2 C7 C12 C11 -178.3(6) . . . . ?
S3 C13 C14 Cl3 -3.4(10) . . . . ?
S3 C13 C14 C15 175.4(7) . . . . ?
S3 C13 C18 C17 -174.9(6) . . . . ?
S4 C19 C20 Cl4 -1.2(8) . . . . ?
S4 C19 C20 C21 177.4(5) . . . . ?
S4 C19 C24 C23 -176.2(5) . . . . ?
S5 C25 C26 Cl5 -4.1(9) . . . . ?
S5 C25 C26 C27 178.0(7) . . . . ?
S5 C25 C30 C29 -179.1(6) . . . . ?
S6 C31 C32 Cl6 -4.6(8) . . . . ?
S6 C31 C32 C33 176.7(5) . . . . ?
S6 C31 C36 C35 -176.9(5) . . . . ?
P1 C37 C38 C39 178.6(7) . . . . ?
P1 C37 C42 C41 -179.0(6) . . . . ?
P1 C43 C44 C45 -178.1(6) . . . . ?
P1 C43 C48 C47 175.9(7) . . . . ?
P1 C49 C50 C51 178.2(7) . . . . ?
P1 C49 C54 C53 -177.6(7) . . . . ?
P2 C55 C56 C57 177.9(5) . . . . ?
P2 C55 C60 C59 -178.4(5) . . . . ?
P2 C61 C62 C63 179.8(5) . . . . ?
P2 C61 C66 C65 -178.9(5) . . . . ?
P2 C67 C68 C69 -175.7(6) . . . . ?
P2 C67 C72 C71 176.5(6) . . . . ?
P3 C73 C74 C75 174.7(5) . . . . ?
P3 C73 C78 C77 -176.7(5) . . . . ?
P3 C79 C80 C81 172.0(5) . . . . ?
P3 C79 C84 C83 -172.7(5) . . . . ?
P3 C85 C86 C87 177.2(5) . . . . ?
P3 C85 C90 C89 -175.9(5) . . . . ?
P4 C91 C92 C93 175.1(5) . . . . ?
P4 C91 C96 C95 -177.0(6) . . . . ?
P4 C97 C98 C99 -178.7(6) . . . . ?
P4 C97 C102 C101 179.6(6) . . . . ?
P4 C103 C104 C105 -173.7(6) . . . . ?
P4 C103 C108 C107 173.8(6) . . . . ?
P5 C109 C110 C111 176.6(5) . . . . ?
P5 C109 C114 C113 -177.6(6) . . . . ?
P5 C115 C116 C117 -178.0(6) . . . . ?
P5 C115 C120 C119 178.7(6) . . . . ?
P5 C121 C122 C123 175.8(6) . . . . ?
P5 C121 C126 C125 -175.3(6) . . . . ?
P6 C127 C128 C129 -177.4(5) . . . . ?
P6 C127 C132 C131 178.2(6) . . . . ?
P6 C133 C134 C135 176.6(6) . . . . ?
P6 C133 C138 C137 -176.0(7) . . . . ?
P6 C139 C140 C141 178.6(7) . . . . ?
P6 C139 C144 C143 -178.8(6) . . . . ?
P7 C145 C146 C147 179.3(6) . . . . ?
P7 C145 C150 C149 -179.5(6) . . . . ?
P7 C151 C152 C153 -180.0(7) . . . . ?
P7 C151 C156 C155 -179.0(6) . . . . ?
P7 C157 C158 C159 176.1(7) . . . . ?
P7 C157 C162 C161 -176.4(6) . . . . ?
P8 C163 C164 C165 175.2(8) . . . . ?
P8 C163 C168 C167 -176.5(6) . . . . ?
P8 C169 C170 C171 -176.7(7) . . . . ?
P8 C169 C174 C173 177.0(7) . . . . ?
P8 C175 C176 C177 178.5(11) . . . . ?
P8 C175 C180 C179 -178.1(7) . . . . ?
F1 C4 C5 C6 179.3(7) . . . . ?
F2 C10 C11 C12 -179.7(7) . . . . ?
F3 C16 C17 C18 179.6(8) . . . . ?
F4 C22 C23 C24 -178.9(7) . . . . ?
F5 C28 C29 C30 179.5(9) . . . . ?
F6 C34 C35 C36 179.4(7) . . . . ?
C1 C2 C3 C4 -1.0(13) . . . . ?
C2 C1 C6 C5 -1.5(10) . . . . ?
C2 C3 C4 F1 -179.0(8) . . . . ?
C2 C3 C4 C5 -0.2(14) . . . . ?
C3 C4 C5 C6 0.5(13) . . . . ?
C4 C5 C6 C1 0.4(11) . . . . ?
C6 C1 C2 Cl1 -179.3(5) . . . . ?
C6 C1 C2 C3 1.8(10) . . . . ?
C7 C8 C9 C10 -0.5(13) . . . . ?
C8 C7 C12 C11 -0.3(11) . . . . ?
C8 C9 C10 F2 -179.4(8) . . . . ?
C8 C9 C10 C11 -1.3(14) . . . . ?
C9 C10 C11 C12 2.1(13) . . . . ?
C10 C11 C12 C7 -1.3(12) . . . . ?
C12 C7 C8 Cl18 -175.8(5) . . . . ?
C12 C7 C8 C9 1.2(11) . . . . ?
C13 C14 C15 C16 0.2(15) . . . . ?
C14 C13 C18 C17 2.1(11) . . . . ?
C14 C15 C16 F3 -179.1(9) . . . . ?
C14 C15 C16 C17 0.9(16) . . . . ?
C15 C16 C17 C18 -0.4(14) . . . . ?
C16 C17 C18 C13 -1.2(13) . . . . ?
C18 C13 C14 Cl3 179.7(6) . . . . ?
C18 C13 C14 C15 -1.5(12) . . . . ?
C19 C20 C21 C22 -0.5(11) . . . . ?
C20 C19 C24 C23 1.7(10) . . . . ?
C20 C21 C22 F4 180.0(6) . . . . ?
C20 C21 C22 C23 0.5(12) . . . . ?
C21 C22 C23 C24 0.6(11) . . . . ?
C22 C23 C24 C19 -1.7(10) . . . . ?
C24 C19 C20 Cl4 -179.1(5) . . . . ?
C24 C19 C20 C21 -0.5(10) . . . . ?
C25 C26 C27 C28 -0.1(14) . . . . ?
C26 C25 C30 C29 -2.4(11) . . . . ?
C26 C27 C28 F5 179.4(9) . . . . ?
C26 C27 C28 C29 0.0(16) . . . . ?
C27 C28 C29 C30 -1.0(16) . . . . ?
C28 C29 C30 C25 2.2(13) . . . . ?
C30 C25 C26 Cl5 179.2(6) . . . . ?
C30 C25 C26 C27 1.3(12) . . . . ?
C31 C32 C33 C34 0.2(10) . . . . ?
C32 C31 C36 C35 1.4(10) . . . . ?
C32 C33 C34 F6 -179.6(6) . . . . ?
C32 C33 C34 C35 1.6(11) . . . . ?
C33 C34 C35 C36 -1.8(12) . . . . ?
C34 C35 C36 C31 0.2(11) . . . . ?
C36 C31 C32 Cl6 177.1(5) . . . . ?
C36 C31 C32 C33 -1.6(10) . . . . ?
C37 P1 C43 C44 -141.6(6) . . . . ?
C37 P1 C43 C48 43.2(8) . . . . ?
C37 P1 C49 C50 -107.2(7) . . . . ?
C37 P1 C49 C54 74.0(7) . . . . ?
C37 C38 C39 C40 0.9(14) . . . . ?
C38 C37 C42 C41 -0.3(11) . . . . ?
C38 C39 C40 C41 -1.3(14) . . . . ?
C39 C40 C41 C42 0.9(14) . . . . ?
C40 C41 C42 C37 -0.1(13) . . . . ?
C42 C37 C38 C39 -0.1(12) . . . . ?
C43 P1 C37 C38 83.5(6) . . . . ?
C43 P1 C37 C42 -97.8(7) . . . . ?
C43 P1 C49 C50 1.1(7) . . . . ?
C43 P1 C49 C54 -177.7(6) . . . . ?
C43 C44 C45 C46 1.2(12) . . . . ?
C44 C43 C48 C47 0.7(13) . . . . ?
C44 C45 C46 C47 2.4(13) . . . . ?
C45 C46 C47 C48 -4.3(14) . . . . ?
C46 C47 C48 C43 2.8(14) . . . . ?
C48 C43 C44 C45 -2.8(12) . . . . ?
C49 P1 C37 C38 -168.3(6) . . . . ?
C49 P1 C37 C42 10.4(7) . . . . ?
C49 P1 C43 C44 111.4(6) . . . . ?
C49 P1 C43 C48 -63.7(7) . . . . ?
C49 C50 C51 C52 -0.6(15) . . . . ?
C50 C49 C54 C53 3.6(13) . . . . ?
C50 C51 C52 C53 3.9(17) . . . . ?
C51 C52 C53 C54 -3.5(17) . . . . ?
C52 C53 C54 C49 -0.3(15) . . . . ?
C54 C49 C50 C51 -3.1(12) . . . . ?
C55 P2 C61 C62 -85.6(5) . . . . ?
C55 P2 C61 C66 95.3(5) . . . . ?
C55 P2 C67 C68 -179.2(5) . . . . ?
C55 P2 C67 C72 5.2(6) . . . . ?
C55 C56 C57 C58 1.0(11) . . . . ?
C56 C55 C60 C59 0.7(10) . . . . ?
C56 C57 C58 C59 -0.3(12) . . . . ?
C57 C58 C59 C60 -0.2(12) . . . . ?
C58 C59 C60 C55 0.0(11) . . . . ?
C60 C55 C56 C57 -1.2(10) . . . . ?
C61 P2 C55 C56 37.5(6) . . . . ?
C61 P2 C55 C60 -143.4(5) . . . . ?
C61 P2 C67 C68 72.4(5) . . . . ?
C61 P2 C67 C72 -103.2(6) . . . . ?
C61 C62 C63 C64 0.4(10) . . . . ?
C62 C61 C66 C65 2.0(10) . . . . ?
C62 C63 C64 C65 -0.5(11) . . . . ?
C63 C64 C65 C66 1.4(11) . . . . ?
C64 C65 C66 C61 -2.2(11) . . . . ?
C66 C61 C62 C63 -1.2(9) . . . . ?
C67 P2 C55 C56 -68.9(6) . . . . ?
C67 P2 C55 C60 110.1(5) . . . . ?
C67 P2 C61 C62 23.6(6) . . . . ?
C67 P2 C61 C66 -155.4(5) . . . . ?
C67 C68 C69 C70 -0.4(12) . . . . ?
C68 C67 C72 C71 0.9(10) . . . . ?
C68 C69 C70 C71 -0.5(13) . . . . ?
C69 C70 C71 C72 1.7(13) . . . . ?
C70 C71 C72 C67 -1.9(12) . . . . ?
C72 C67 C68 C69 0.2(10) . . . . ?
C73 P3 C79 C80 -84.2(5) . . . . ?
C73 P3 C79 C84 90.6(6) . . . . ?
C73 P3 C85 C86 -36.6(6) . . . . ?
C73 P3 C85 C90 140.5(5) . . . . ?
C73 C74 C75 C76 3.4(11) . . . . ?
C74 C73 C78 C77 1.7(9) . . . . ?
C74 C75 C76 C77 -0.8(11) . . . . ?
C75 C76 C77 C78 -1.2(11) . . . . ?
C76 C77 C78 C73 0.7(10) . . . . ?
C78 C73 C74 C75 -3.8(10) . . . . ?
C79 P3 C73 C74 175.9(5) . . . . ?
C79 P3 C73 C78 -5.7(6) . . . . ?
C79 P3 C85 C86 70.5(6) . . . . ?
C79 P3 C85 C90 -112.3(5) . . . . ?
C79 C80 C81 C82 2.1(10) . . . . ?
C80 C79 C84 C83 2.1(9) . . . . ?
C80 C81 C82 C83 0.0(11) . . . . ?
C81 C82 C83 C84 -1.0(12) . . . . ?
C82 C83 C84 C79 0.0(11) . . . . ?
C84 C79 C80 C81 -3.1(9) . . . . ?
C85 P3 C73 C74 -73.8(5) . . . . ?
C85 P3 C73 C78 104.6(5) . . . . ?
C85 P3 C79 C80 170.5(5) . . . . ?
C85 P3 C79 C84 -14.7(6) . . . . ?
C85 C86 C87 C88 -0.2(11) . . . . ?
C86 C85 C90 C89 1.3(10) . . . . ?
C86 C87 C88 C89 -1.0(11) . . . . ?
C87 C88 C89 C90 2.4(11) . . . . ?
C88 C89 C90 C85 -2.6(10) . . . . ?
C90 C85 C86 C87 0.1(10) . . . . ?
C91 P4 C97 C98 -111.2(5) . . . . ?
C91 P4 C97 C102 70.0(6) . . . . ?
C91 P4 C103 C104 -18.0(6) . . . . ?
C91 P4 C103 C108 168.7(5) . . . . ?
C91 C92 C93 C94 2.8(10) . . . . ?
C92 C91 C96 C95 2.7(10) . . . . ?
C92 C93 C94 C95 1.0(11) . . . . ?
C93 C94 C95 C96 -2.9(12) . . . . ?
C94 C95 C96 C91 1.0(12) . . . . ?
C96 C91 C92 C93 -4.6(10) . . . . ?
C97 P4 C91 C92 -176.4(5) . . . . ?
C97 P4 C91 C96 3.3(6) . . . . ?
C97 P4 C103 C104 90.4(6) . . . . ?
C97 P4 C103 C108 -82.8(6) . . . . ?
C97 C98 C99 C100 -2.5(12) . . . . ?
C98 C97 C102 C101 0.8(10) . . . . ?
C98 C99 C100 C101 4.0(13) . . . . ?
C99 C100 C101 C102 -3.0(12) . . . . ?
C100 C101 C102 C97 0.6(11) . . . . ?
C102 C97 C98 C99 0.2(10) . . . . ?
C103 P4 C91 C92 -70.8(5) . . . . ?
C103 P4 C91 C96 108.9(6) . . . . ?
C103 P4 C97 C98 142.8(5) . . . . ?
C103 P4 C97 C102 -36.0(6) . . . . ?
C103 C104 C105 C106 0.1(13) . . . . ?
C104 C103 C108 C107 0.3(11) . . . . ?
C104 C105 C106 C107 0.4(14) . . . . ?
C105 C106 C107 C108 -0.6(14) . . . . ?
C106 C107 C108 C103 0.2(13) . . . . ?
C108 C103 C104 C105 -0.5(11) . . . . ?
C109 P5 C115 C116 -79.1(6) . . . . ?
C109 P5 C115 C120 102.0(5) . . . . ?
C109 P5 C121 C122 5.6(6) . . . . ?
C109 P5 C121 C126 -177.2(5) . . . . ?
C109 C110 C111 C112 1.1(11) . . . . ?
C110 C109 C114 C113 1.6(10) . . . . ?
C110 C111 C112 C113 1.2(12) . . . . ?
C111 C112 C113 C114 -2.2(12) . . . . ?
C112 C113 C114 C109 0.8(12) . . . . ?
C114 C109 C110 C111 -2.5(10) . . . . ?
C115 P5 C109 C110 35.4(6) . . . . ?
C115 P5 C109 C114 -145.4(5) . . . . ?
C115 P5 C121 C122 -102.3(6) . . . . ?
C115 P5 C121 C126 74.9(6) . . . . ?
C115 C116 C117 C118 -2.6(11) . . . . ?
C116 C115 C120 C119 -0.2(10) . . . . ?
C116 C117 C118 C119 3.7(12) . . . . ?
C117 C118 C119 C120 -3.1(12) . . . . ?
C118 C119 C120 C115 1.3(11) . . . . ?
C120 C115 C116 C117 0.9(10) . . . . ?
C121 P5 C109 C110 -71.3(6) . . . . ?
C121 P5 C109 C114 107.9(5) . . . . ?
C121 P5 C115 C116 28.9(6) . . . . ?
C121 P5 C115 C120 -150.0(5) . . . . ?
C121 C122 C123 C124 0.2(12) . . . . ?
C122 C121 C126 C125 2.0(11) . . . . ?
C122 C123 C124 C125 0.4(13) . . . . ?
C123 C124 C125 C126 0.3(13) . . . . ?
C124 C125 C126 C121 -1.5(13) . . . . ?
C126 C121 C122 C123 -1.4(10) . . . . ?
C127 P6 C133 C134 23.3(6) . . . . ?
C127 P6 C133 C138 -159.4(6) . . . . ?
C127 P6 C139 C140 -72.9(7) . . . . ?
C127 P6 C139 C144 107.8(6) . . . . ?
C127 C128 C129 C130 -1.0(11) . . . . ?
C128 C127 C132 C131 -0.8(10) . . . . ?
C128 C129 C130 C131 -0.5(12) . . . . ?
C129 C130 C131 C132 1.3(12) . . . . ?
C130 C131 C132 C127 -0.6(12) . . . . ?
C132 C127 C128 C129 1.7(10) . . . . ?
C133 P6 C127 C128 71.2(5) . . . . ?
C133 P6 C127 C132 -107.8(6) . . . . ?
C133 P6 C139 C140 34.4(7) . . . . ?
C133 P6 C139 C144 -144.9(6) . . . . ?
C133 C134 C135 C136 -0.1(12) . . . . ?
C134 C133 C138 C137 1.4(11) . . . . ?
C134 C135 C136 C137 0.1(13) . . . . ?
C135 C136 C137 C138 0.7(15) . . . . ?
C136 C137 C138 C133 -1.4(14) . . . . ?
C138 C133 C134 C135 -0.7(11) . . . . ?
C139 P6 C127 C128 179.0(5) . . . . ?
C139 P6 C127 C132 -0.1(6) . . . . ?
C139 P6 C133 C134 -85.6(6) . . . . ?
C139 P6 C133 C138 91.6(6) . . . . ?
C139 C140 C141 C142 1.2(14) . . . . ?
C140 C139 C144 C143 1.8(11) . . . . ?
C140 C141 C142 C143 -0.1(14) . . . . ?
C141 C142 C143 C144 -0.1(13) . . . . ?
C142 C143 C144 C139 -0.8(13) . . . . ?
C144 C139 C140 C141 -2.1(12) . . . . ?
C145 P7 C151 C152 100.6(6) . . . . ?
C145 P7 C151 C156 -80.1(6) . . . . ?
C145 P7 C157 C158 -1.1(7) . . . . ?
C145 P7 C157 C162 176.2(5) . . . . ?
C145 C146 C147 C148 -0.7(11) . . . . ?
C146 C145 C150 C149 -0.8(10) . . . . ?
C146 C147 C148 C149 1.2(12) . . . . ?
C147 C148 C149 C150 -1.5(13) . . . . ?
C148 C149 C150 C145 1.3(12) . . . . ?
C150 C145 C146 C147 0.5(10) . . . . ?
C151 P7 C145 C146 -143.0(5) . . . . ?
C151 P7 C145 C150 35.7(6) . . . . ?
C151 P7 C157 C158 -109.8(6) . . . . ?
C151 P7 C157 C162 67.5(6) . . . . ?
C151 C152 C153 C154 -0.4(14) . . . . ?
C152 C151 C156 C155 0.4(11) . . . . ?
C152 C153 C154 C155 -0.8(16) . . . . ?
C153 C154 C155 C156 1.9(15) . . . . ?
C154 C155 C156 C151 -1.7(13) . . . . ?
C156 C151 C152 C153 0.6(12) . . . . ?
C157 P7 C145 C146 110.5(5) . . . . ?
C157 P7 C145 C150 -70.8(6) . . . . ?
C157 P7 C151 C152 -151.2(6) . . . . ?
C157 P7 C151 C156 28.1(6) . . . . ?
C157 C158 C159 C160 1.0(14) . . . . ?
C158 C157 C162 C161 1.1(11) . . . . ?
C158 C159 C160 C161 -0.5(14) . . . . ?
C159 C160 C161 C162 0.3(13) . . . . ?
C160 C161 C162 C157 -0.6(12) . . . . ?
C162 C157 C158 C159 -1.2(11) . . . . ?
C163 P8 C169 C170 -162.0(6) . . . . ?
C163 P8 C169 C174 19.1(7) . . . . ?
C163 P8 C175 C176 -89.4(10) . . . . ?
C163 P8 C175 C180 90.7(7) . . . . ?
C163 C164 C165 C166 1.5(16) . . . . ?
C164 C163 C168 C167 2.5(11) . . . . ?
C164 C165 C166 C167 1.9(17) . . . . ?
C165 C166 C167 C168 -3.1(15) . . . . ?
C166 C167 C168 C163 0.9(13) . . . . ?
C168 C163 C164 C165 -3.6(13) . . . . ?
C169 P8 C163 C164 -101.5(7) . . . . ?
C169 P8 C163 C168 77.4(6) . . . . ?
C169 P8 C175 C176 16.4(10) . . . . ?
C169 P8 C175 C180 -163.4(7) . . . . ?
C169 C170 C171 C172 -2.1(14) . . . . ?
C170 C169 C174 C173 -1.9(12) . . . . ?
C170 C171 C172 C173 1.5(15) . . . . ?
C171 C172 C173 C174 -1.1(15) . . . . ?
C172 C173 C174 C169 1.3(14) . . . . ?
C174 C169 C170 C171 2.2(12) . . . . ?
C175 P8 C163 C164 5.9(8) . . . . ?
C175 P8 C163 C168 -175.2(6) . . . . ?
C175 P8 C169 C170 90.5(7) . . . . ?
C175 P8 C169 C174 -88.4(7) . . . . ?
C175 C176 C177 C178 0(2) . . . . ?
C176 C175 C180 C179 2.1(14) . . . . ?
C176 C177 C178 C179 2(2) . . . . ?
C177 C178 C179 C180 -1.4(19) . . . . ?
C178 C179 C180 C175 -0.5(15) . . . . ?
C180 C175 C176 C177 -1.7(18) . . . . ?
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 0.000 0.026 0.250 2169 477 ' '
2 0.000 -0.044 0.750 2169 477 ' '
3 0.500 -0.049 0.250 2169 477 ' '
4 0.500 0.044 0.750 2169 477 ' '
