#------------------------------------------------------------------------------
#$Date: 2023-05-05 06:35:19 +0300 (Fri, 05 May 2023) $
#$Revision: 283506 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/64/7246420.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_7246420
loop_
_publ_author_name
'Ma, Along'
'Wang, Jiawei'
'Kong, Jie'
'Ren, Yonggang'
'Wang, Yuxuan'
'Ma, Xiaoshuang'
'Zhou, Meng'
'Wang, Shuxin'
_publ_section_title
;
 Au₁₀Ag₁₇(TPP)₁₀(SR)₆Cl₅
 nanocluster: structure, transformation and the origin of its
 photoluminescence.
;
_journal_issue                   14
_journal_name_full               'Physical chemistry chemical physics : PCCP'
_journal_page_first              9772
_journal_page_last               9778
_journal_paper_doi               10.1039/d3cp00459g
_journal_volume                  25
_journal_year                    2023
_chemical_formula_moiety         'C228 H168 Ag17 Au10 Cl5 F36 P10 S6'
_chemical_formula_sum            'C228 H168 Ag17 Au10 Cl5 F36 P10 S6'
_chemical_formula_weight         8074.38
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_date             2023-02-27
_audit_creation_method
;
Olex2 1.3-beta
(compiled 2020.02.04 svn.rd84adfe8 for OlexSys, GUI svn.r6032)
;
_audit_update_record
;
2023-02-27 deposited with the CCDC.	2023-03-09 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 100.869(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   25.8454(7)
_cell_length_b                   30.9591(5)
_cell_length_c                   33.6076(10)
_cell_measurement_reflns_used    1288
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      21.25
_cell_measurement_theta_min      2.56
_cell_volume                     26408.7(12)
_computing_molecular_graphics    'Olex2 1.3-beta (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3-beta (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      150.15
_diffrn_measured_fraction_theta_full 0.985
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measurement_device_type  'Rigaku (Mo) X-ray Source'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1468
_diffrn_reflns_av_unetI/netI     0.1410
_diffrn_reflns_Laue_measured_fraction_full 0.985
_diffrn_reflns_Laue_measured_fraction_max 0.981
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       38
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -41
_diffrn_reflns_number            139034
_diffrn_reflns_point_group_measured_fraction_full 0.985
_diffrn_reflns_point_group_measured_fraction_max 0.981
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.000
_diffrn_reflns_theta_min         1.940
_exptl_absorpt_coefficient_mu    6.985
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.230
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.41.110a (Rigaku Oxford Diffraction, 2021)
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    2.031
_exptl_crystal_description       block
_exptl_crystal_F_000             15120
_exptl_crystal_size_max          0.34
_exptl_crystal_size_mid          0.28
_exptl_crystal_size_min          0.065
_refine_diff_density_max         10.835
_refine_diff_density_min         -5.123
_refine_diff_density_rms         0.505
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.147
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     2224
_refine_ls_number_reflns         50910
_refine_ls_number_restraints     3644
_refine_ls_restrained_S_all      1.118
_refine_ls_R_factor_all          0.2127
_refine_ls_R_factor_gt           0.1240
_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)+(0.2000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3274
_refine_ls_wR_factor_ref         0.3722
_reflns_Friedel_coverage         0.000
_reflns_number_gt                26523
_reflns_number_total             50910
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3cp00459g2.cif
_cod_data_source_block           exp_1406_auto
_cod_depositor_comments          'Adding full bibliography for 7246420.cif.'
_cod_database_code               7246420
_shelx_shelxl_version_number     2016/6
_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   0.660
_shelx_estimated_absorpt_t_min   0.200
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2. Restrained distances
 F11-C8 = F17-C8 = F175-C8
 1.3 with sigma of 0.01
 F150-C181 = F190-C181 = F152-C181
 1.3 with sigma of 0.01
 F190-C181 = F150-C181 = F152-C181
 1.3 with sigma of 0.01
 F152-C181 = F195-C181 = F190-C181 = F199-C181 = F150-C181 = F83-C181
 1.3 with sigma of 0.01
 F152-F190 \\sim F190-F150
 with sigma of 0.02
3. Restrained planarity
 P01B, C189, C15, C227, C9, C259, C10
 with sigma of 0.1
4. Uiso/Uaniso restraints and constraints
S00T \\sim C27 \\sim C26 \\sim C109 \\sim C48 \\sim C64 \\sim C55: within 3.8A
with sigma of 0.001 and sigma for terminal atoms of 0.002 within 3.8A
Uanis(P01B) = Uanis(C189) = Uanis(C15) = Uanis(C227) = Uanis(C10) = Uanis(C259)
= Uanis(C9) = Uanis(C102) = Uanis(C261) = Uanis(C216) = Uanis(C308) =
Uanis(C11) = Uanis(C245)
Uanis(P01B) = Uanis(C211) = Uanis(C264) = Uanis(C303) = Uanis(C285) =
Uanis(C271) = Uanis(C251)
Uanis(P01C) = Uanis(C231) = Uanis(C309) = Uanis(C244) = Uanis(C7) = Uanis(C247)
= Uanis(C13)
Uanis(P01C) = Uanis(C295) = Uanis(C138) = Uanis(C14) = Uanis(C288) =
Uanis(C324) = Uanis(C322)
5. Rigid body (RIGU) restrains
 All non-hydrogen atoms
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.001
6. Others
 Fixed Sof: F150(0.5) F152(0.5) F190(0.5) F83(0.5) F195(0.5) F199(0.5)
7.a Aromatic/amide H refined with riding coordinates:
 C26(H26), C48(H48), C55(H55), C12(H12), C22(H22), C161(H161), C93(H93),
 C103(H103), C92(H92), C65(H65), C124(H124), C166(H166), C129(H129), C110(H110),
  C170(H170), C165(H165), C3(H3), C17(H17), C59(H59), C51(H51), C61(H61),
 C187(H187), C203(H203), C153(H153), C89(H89), C67(H67), C31(H31), C25(H25),
 C47(H47), C42(H42), C81(H81), C75(H75), C168(H168), C117(H117), C76(H76),
 C96(H96), C88(H88), C134(H134), C57(H57), C6(H6), C91(H91), C98(H98), C37(H37),
  C63(H63), C20(H20), C16(H16), C122(H122), C87(H87), C185(H185), C186(H186),
 C246(H246), C172(H172), C107(H107), C2(H2), C66(H66), C120(H120), C90(H90),
 C126(H126), C56(H56), C142(H142), C136(H136), C141(H141), C131(H131), C62(H62),
  C94(H94), C144(H144), C230(H230), C173(H173), C111(H111), C221(H221),
 C192(H192), C169(H169), C118(H118), C106(H106), C155(H155), C193(H193),
 C160(H160), C104(H104), C119(H119), C279(H279), C128(H128), C108(H108),
 C54(H54), C196(H196), C252(H252), C171(H171), C162(H162), C130(H130), C95(H95),
  C282(H282), C195(H195), C201(H201), C167(H167), C158(H158), C218(H218),
 C207(H207), C68(H68), C19(H19), C132(H132), C188(H188), C217(H217), C256(H256),
  C184(H184), C209(H209), C180(H180), C335(H335), C280(H280), C205(H205),
 C235(H235), C200(H200), C219(H219), C97(H97), C79(H79), C199(H199), C232(H232),
  C316(H316), C268(H268), C234(H234), C123(H123), C121(H121), C182(H182),
 C249(H249), C177(H177), C213(H213), C194(H194), C283(H283), C5(H5), C290(H290),
  C226(H226), C214(H214), C228(H228), C114(H114), C159(H159), C78(H78),
 C178(H178), C229(H229), C319(H319), C222(H222), C174(H174), C208(H208),
 C293(H293), C364(H364), C240(H240), C251(H251), C271(H271), C285(H285),
 C303(H303), C264(H264), C309(H309), C244(H244), C7(H7), C247(H247), C13(H13),
 C261(H261), C245(H245), C11(H11), C308(H308), C216(H216), C138(H138), C14(H14),
  C288(H288), C324(H324), C322(H322), C9(H9), C259(H259), C10(H10), C227(H227),
 C15(H15)
7.b Fitted hexagon refined as free rotating group:
 C27(C26,C109,C48,C64,C55), C18(C12,C22,C161,C93,C103), C21(C92,C65,C124,C166,
 C129), C24(C110,C170,C165,C3,C17), C1(C59,C53,C51,C74,C61), C30(C187,C203,C153,
 C89,C67), C33(C31,C82,C25,C58,C47), C34(C42,C81,C75,C168,C117), C40(C76,C96,
 C88,C134,C57), C41(C6,C60,C91,C52,C98), C43(C37,C63,C20,C16,C122), C45(C87,
 C185,C186,C246,C172), C49(C107,C125,C2,C46,C66), C70(C120,C115,C90,C179,C126),
 C71(C56,C142,C136,C141,C131), C72(C62,C94,C144,C230,C173), C84(C111,C221,C192,
 C169,C118), C85(C106,C155,C193,C160,C104), C86(C119,C279,C128,C108,C54),
 C99(C196,C252,C171,C162,C130), C105(C95,C282,C195,C201,C167), C112(C158,C218,
 C207,C68,C19), C116(C132,C188,C217,C256,C184), C133(C209,C180,C335,C280,C205),
 C140(C235,C200,C219,C97,C79), C143(C199,C232,C316,C268,C234), C145(C123,C121,
 C182,C249,C177), C148(C213,C194,C283,C5,C290), C149(C226,C214,C228,C114,C159),
 C157(C78,C178,C229,C319,C222), C164(C174,C208,C293,C364,C240), C211(C251,C271,
 C285,C303,C264), C231(C309,C244,C7,C247,C13), C261(C102,C245,C11,C308,C216),
 C295(C138,C14,C288,C324,C322), C9(C259,C10,C227,C15,C189)
;
_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
Au01 Au 0.39167(3) 0.46821(2) 0.71558(2) 0.0243(2) Uani 1 1 d . . . . .
Au02 Au 0.60692(3) 0.46326(2) 0.78158(2) 0.0262(2) Uani 1 1 d . . . . .
Au03 Au 0.32981(4) 0.44415(2) 0.76849(3) 0.0303(2) Uani 1 1 d . . . . .
Au04 Au 0.66630(4) 0.43571(2) 0.72857(3) 0.0306(2) Uani 1 1 d . . . . .
Au05 Au 0.36477(4) 0.43736(3) 0.64010(3) 0.0332(2) Uani 1 1 d . . . . .
Au06 Au 0.63087(4) 0.43178(2) 0.85742(3) 0.0333(2) Uani 1 1 d . . . . .
Au07 Au 0.33774(4) 0.53234(2) 0.74254(3) 0.0341(2) Uani 1 1 d . . . . .
Au08 Au 0.66613(4) 0.52412(2) 0.75559(3) 0.0349(2) Uani 1 1 d . . . . .
Au09 Au 0.35703(4) 0.52928(3) 0.65929(3) 0.0362(2) Uani 1 1 d . . . . .
Au0A Au 0.64510(4) 0.52281(3) 0.83838(3) 0.0387(2) Uani 1 1 d . . . . .
Ag0B Ag 0.49914(5) 0.46394(4) 0.74829(4) 0.0175(3) Uani 1 1 d . . . . .
Ag0C Ag 0.42877(6) 0.40179(4) 0.77264(5) 0.0262(3) Uani 1 1 d . . . . .
Ag0D Ag 0.57525(6) 0.48825(4) 0.70112(5) 0.0269(3) Uani 1 1 d . . . . .
Ag0E Ag 0.42538(7) 0.49219(4) 0.79625(5) 0.0277(3) Uani 1 1 d . . . . .
Ag0F Ag 0.56485(7) 0.39804(4) 0.72417(5) 0.0270(3) Uani 1 1 d . . . . .
Ag0G Ag 0.46021(7) 0.48828(4) 0.66441(5) 0.0277(3) Uani 1 1 d . . . . .
Ag0H Ag 0.54195(7) 0.39608(4) 0.80507(5) 0.0277(3) Uani 1 1 d . . . . .
Ag0I Ag 0.45155(7) 0.39791(4) 0.69145(5) 0.0277(3) Uani 1 1 d . . . . .
Ag0J Ag 0.53944(7) 0.48730(4) 0.83234(5) 0.0293(4) Uani 1 1 d . . . . .
Ag0K Ag 0.44377(7) 0.54576(4) 0.72912(5) 0.0312(4) Uani 1 1 d . . . . .
Ag0L Ag 0.56050(7) 0.54322(4) 0.76815(5) 0.0328(4) Uani 1 1 d . . . . .
Ag0M Ag 0.34007(7) 0.38611(5) 0.70463(5) 0.0329(4) Uani 1 1 d . . . . .
Ag0N Ag 0.65161(7) 0.37857(5) 0.79227(5) 0.0334(4) Uani 1 1 d . . . . .
Ag0O Ag 0.71331(7) 0.45662(5) 0.81255(5) 0.0378(4) Uani 1 1 d . . . . .
Ag0P Ag 0.28491(7) 0.46792(5) 0.68500(5) 0.0366(4) Uani 1 1 d . . . . .
Ag0Q Ag 0.17767(10) 0.38404(8) 0.63818(8) 0.0738(7) Uani 1 1 d . . . . .
Ag0R Ag 0.81750(9) 0.36429(7) 0.84770(8) 0.0724(7) Uani 1 1 d . . . . .
S00S S 0.4704(2) 0.38961(15) 0.84479(16) 0.0281(9) Uani 1 1 d . . . . .
S00T S 0.5348(2) 0.50770(15) 0.63173(17) 0.0334(8) Uani 1 1 d . U . . .
Cl00 Cl 0.5043(2) 0.60630(16) 0.74879(17) 0.0427(13) Uani 1 1 d . . . . .
S00V S 0.5226(2) 0.38677(15) 0.65238(16) 0.0319(9) Uani 1 1 d . . . . .
S00W S 0.4672(2) 0.51025(15) 0.86631(17) 0.0346(10) Uani 1 1 d . . . . .
Cl1 Cl 0.5722(2) 0.32457(14) 0.76888(17) 0.0370(10) Uani 1 1 d . . . . .
P00Y P 0.7161(3) 0.40282(17) 0.68735(19) 0.0350(12) Uani 1 1 d . . . . .
Cl Cl 0.4167(2) 0.32861(15) 0.72814(18) 0.0394(11) Uani 1 1 d . . . . .
P010 P 0.2774(3) 0.41451(18) 0.80889(19) 0.0403(13) Uani 1 1 d . . . . .
P011 P 0.7206(3) 0.57412(17) 0.7345(2) 0.0418(13) Uani 1 1 d . . . . .
S012 S 0.2556(3) 0.3500(2) 0.6791(2) 0.0534(14) Uani 1 1 d . . . . .
P013 P 0.6464(3) 0.39618(18) 0.91815(19) 0.0427(13) Uani 1 1 d . . . . .
Cl2 Cl 0.1904(3) 0.4664(2) 0.6552(2) 0.0566(15) Uani 1 1 d . . . . .
Cl3 Cl 0.8079(3) 0.4476(2) 0.8406(2) 0.0560(15) Uani 1 1 d . . . . .
P016 P 0.2878(3) 0.58448(18) 0.7656(2) 0.0480(15) Uani 1 1 d . . . . .
P017 P 0.3467(3) 0.40205(18) 0.57931(19) 0.0404(13) Uani 1 1 d . . . . .
P018 P 0.6798(3) 0.56653(19) 0.8924(2) 0.0479(14) Uani 1 1 d . . . . .
P019 P 0.3251(3) 0.57525(19) 0.6061(2) 0.0440(14) Uani 1 1 d . . . . .
S01A S 0.7326(3) 0.3373(2) 0.8161(2) 0.0565(15) Uani 1 1 d . . . . .
P01B P 0.0847(4) 0.3750(3) 0.6190(3) 0.0867(18) Uani 1 1 d . . . . .
P01C P 0.9103(4) 0.3497(3) 0.8584(4) 0.094(2) Uani 1 1 d . . . . .
C27 C 0.5432(5) 0.5646(3) 0.6301(4) 0.0338(9) Uani 1 1 d G U . . .
C26 C 0.5855(5) 0.5804(3) 0.6144(4) 0.0338(9) Uani 1 1 d G U . . .
H26 H 0.609790 0.560894 0.606019 0.041 Uiso 1 1 calc R U . . .
C109 C 0.5924(5) 0.6247(4) 0.6110(4) 0.0340(9) Uani 1 1 d G U . . .
C48 C 0.5569(5) 0.6532(3) 0.6233(4) 0.0340(9) Uani 1 1 d G U . . .
H48 H 0.561644 0.683423 0.620973 0.041 Uiso 1 1 calc R U . . .
C64 C 0.5146(5) 0.6374(3) 0.6390(4) 0.0340(9) Uani 1 1 d G U . . .
C55 C 0.5077(5) 0.5931(4) 0.6424(4) 0.0338(9) Uani 1 1 d G U . . .
H55 H 0.478771 0.582291 0.653081 0.041 Uiso 1 1 calc R U . . .
F1 F 0.4363(6) 0.6519(4) 0.6614(5) 0.061(3) Uani 1 1 d . . . . .
F9 F 0.5004(7) 0.6903(5) 0.6862(5) 0.075(4) Uani 1 1 d . . . . .
F10 F 0.4630(7) 0.6990(4) 0.6256(5) 0.069(3) Uani 1 1 d . . . . .
C77 C 0.4796(11) 0.6683(7) 0.6535(8) 0.050(3) Uani 1 1 d . . . . .
F6 F 0.4834(7) 0.2309(4) 0.7884(5) 0.075(4) Uani 1 1 d . . . . .
F4 F 0.6507(6) 0.6799(4) 0.6049(5) 0.066(3) Uani 1 1 d . . . . .
F3 F 0.5066(7) 0.2289(4) 0.7118(5) 0.077(4) Uani 1 1 d . . . . .
F5 F 0.2731(8) 0.2477(5) 0.5396(5) 0.085(4) Uani 1 1 d . . . . .
F7 F 0.5718(7) 0.6491(5) 0.8324(5) 0.072(4) Uani 1 1 d . . . . .
F12 F 0.3963(7) 0.2212(5) 0.7109(6) 0.079(4) Uani 1 1 d . . . . .
F8 F 0.7185(7) 0.2374(5) 0.9582(5) 0.075(4) Uani 1 1 d . . . . .
F2 F 0.6200(6) 0.6441(4) 0.5525(5) 0.064(3) Uani 1 1 d . . . . .
F11 F 0.5901(7) 0.2102(5) 0.7882(6) 0.087(4) Uani 1 1 d D . . . .
F13 F 0.5559(7) 0.6951(5) 0.8754(5) 0.081(4) Uani 1 1 d . . . . .
F16 F 0.3620(7) 0.6875(5) 0.8957(6) 0.079(4) Uani 1 1 d . . . . .
C18 C 0.3758(6) 0.5901(5) 0.5764(5) 0.052(4) Uani 1 1 d G . . . .
C12 C 0.4082(6) 0.5568(3) 0.5683(5) 0.044(5) Uani 1 1 d G . . . .
H12 H 0.402116 0.528066 0.576292 0.053 Uiso 1 1 calc R U . . .
C22 C 0.4497(6) 0.5654(4) 0.5485(5) 0.043(5) Uani 1 1 d G . . . .
H22 H 0.471892 0.542622 0.542924 0.052 Uiso 1 1 calc R U . . .
C161 C 0.4587(6) 0.6074(5) 0.5368(5) 0.061(7) Uani 1 1 d G . . . .
H161 H 0.486980 0.613312 0.523259 0.073 Uiso 1 1 calc R U . . .
C93 C 0.4262(7) 0.6407(3) 0.5449(5) 0.050(5) Uani 1 1 d G . . . .
H93 H 0.432292 0.669446 0.536961 0.060 Uiso 1 1 calc R U . . .
C103 C 0.3847(6) 0.6321(4) 0.5648(5) 0.053(6) Uani 1 1 d G . . . .
H103 H 0.362516 0.654891 0.570329 0.064 Uiso 1 1 calc R U . . .
F20 F 0.5625(8) 0.1918(5) 0.6896(6) 0.092(4) Uani 1 1 d . . . . .
C21 C 0.7209(6) 0.3458(3) 0.6976(5) 0.039(3) Uani 1 1 d G . . . .
C92 C 0.6746(5) 0.3230(4) 0.6975(5) 0.051(6) Uani 1 1 d G . . . .
H92 H 0.641529 0.337203 0.690440 0.061 Uiso 1 1 calc R U . . .
C65 C 0.6766(5) 0.2795(4) 0.7078(5) 0.048(6) Uani 1 1 d G . . . .
H65 H 0.644917 0.263898 0.707703 0.057 Uiso 1 1 calc R U . . .
C124 C 0.7250(6) 0.2587(3) 0.7181(5) 0.046(5) Uani 1 1 d G . . . .
H124 H 0.726339 0.228976 0.725128 0.055 Uiso 1 1 calc R U . . .
C166 C 0.7713(5) 0.2815(4) 0.7182(5) 0.048(5) Uani 1 1 d G . . . .
H166 H 0.804374 0.267359 0.725291 0.058 Uiso 1 1 calc R U . . .
C129 C 0.7693(5) 0.3251(4) 0.7080(5) 0.057(7) Uani 1 1 d G . . . .
H129 H 0.800987 0.340664 0.708028 0.068 Uiso 1 1 calc R U . . .
F23 F 0.4853(9) 0.1944(5) 0.6578(6) 0.100(5) Uani 1 1 d . . . . .
C24 C 0.6311(6) 0.5824(5) 0.9230(5) 0.053(4) Uani 1 1 d G . . . .
C110 C 0.6276(6) 0.6247(4) 0.9359(5) 0.054(5) Uani 1 1 d G . . . .
H110 H 0.652212 0.645695 0.930432 0.064 Uiso 1 1 calc R U . . .
C170 C 0.5881(7) 0.6365(4) 0.9567(5) 0.069(7) Uani 1 1 d G . . . .
H170 H 0.585771 0.665438 0.965510 0.083 Uiso 1 1 calc R U . . .
C165 C 0.5521(6) 0.6058(5) 0.9646(5) 0.060(6) Uani 1 1 d G . . . .
H165 H 0.525144 0.613830 0.978883 0.072 Uiso 1 1 calc R U . . .
C3 C 0.5556(6) 0.5634(5) 0.9517(5) 0.056(5) Uani 1 1 d G . . . .
H3 H 0.530958 0.542479 0.957179 0.067 Uiso 1 1 calc R U . . .
C17 C 0.5950(7) 0.5517(4) 0.9309(5) 0.046(5) Uani 1 1 d G . . . .
H17 H 0.597399 0.522735 0.922101 0.055 Uiso 1 1 calc R U . . .
C1 C 0.5360(6) 0.3315(3) 0.6423(4) 0.032(4) Uani 1 1 d G . . . .
C59 C 0.5234(6) 0.2967(4) 0.6649(4) 0.042(6) Uani 1 1 d G . . . .
H59 H 0.505530 0.301421 0.686741 0.051 Uiso 1 1 calc R U . . .
C53 C 0.5371(7) 0.2550(3) 0.6555(5) 0.057(5) Uani 1 1 d G . . . .
C51 C 0.5632(7) 0.2481(3) 0.6235(5) 0.046(6) Uani 1 1 d G . . . .
H51 H 0.572555 0.219587 0.617098 0.056 Uiso 1 1 calc R U . . .
C74 C 0.5758(7) 0.2829(4) 0.6010(5) 0.073(6) Uani 1 1 d G . . . .
C61 C 0.5621(7) 0.3245(4) 0.6104(4) 0.041(5) Uani 1 1 d G . . . .
H61 H 0.570706 0.348315 0.594926 0.049 Uiso 1 1 calc R U . . .
F28 F 0.3635(7) 0.1676(5) 0.6765(6) 0.085(4) Uani 1 1 d . . . . .
F29 F 0.5112(7) 0.6955(5) 0.8153(5) 0.077(4) Uani 1 1 d . . . . .
C30 C 0.2689(6) 0.3573(3) 0.7982(5) 0.048(4) Uani 1 1 d G . . . .
C187 C 0.2197(5) 0.3382(4) 0.7870(6) 0.058(6) Uani 1 1 d G . . . .
H187 H 0.188694 0.355101 0.785399 0.070 Uiso 1 1 calc R U . . .
C203 C 0.2157(5) 0.2943(4) 0.7781(6) 0.066(8) Uani 1 1 d G . . . .
H203 H 0.182042 0.281251 0.770488 0.079 Uiso 1 1 calc R U . . .
C153 C 0.2610(6) 0.2695(3) 0.7805(5) 0.053(6) Uani 1 1 d G . . . .
H153 H 0.258342 0.239544 0.774402 0.064 Uiso 1 1 calc R U . . .
C89 C 0.3103(5) 0.2886(4) 0.7916(5) 0.053(6) Uani 1 1 d G . . . .
H89 H 0.341296 0.271686 0.793228 0.064 Uiso 1 1 calc R U . . .
C67 C 0.3143(5) 0.3325(4) 0.8005(5) 0.048(5) Uani 1 1 d G . . . .
H67 H 0.347949 0.345537 0.808141 0.057 Uiso 1 1 calc R U . . .
C33 C 0.4548(6) 0.3352(3) 0.8554(4) 0.031(3) Uani 1 1 d G . . . .
C31 C 0.4305(7) 0.3292(4) 0.8886(4) 0.043(5) Uani 1 1 d G . . . .
H31 H 0.423663 0.353263 0.904297 0.052 Uiso 1 1 calc R U . . .
C82 C 0.4163(7) 0.2879(4) 0.8987(4) 0.059(5) Uani 1 1 d G . . . .
C25 C 0.4263(7) 0.2527(3) 0.8756(5) 0.039(5) Uani 1 1 d G . . . .
H25 H 0.416581 0.224432 0.882518 0.047 Uiso 1 1 calc R U . . .
C58 C 0.4506(7) 0.2587(3) 0.8425(4) 0.056(5) Uani 1 1 d G . . . .
C47 C 0.4648(6) 0.3000(4) 0.8324(4) 0.040(5) Uani 1 1 d G . . . .
H47 H 0.481431 0.304149 0.809749 0.048 Uiso 1 1 calc R U . . .
C34 C 0.6199(7) 0.4247(5) 0.9567(4) 0.044(3) Uani 1 1 d G . . . .
C42 C 0.5657(7) 0.4308(5) 0.9502(4) 0.059(5) Uani 1 1 d G . . . .
H42 H 0.544190 0.421153 0.925761 0.070 Uiso 1 1 calc R U . . .
C81 C 0.5428(5) 0.4511(5) 0.9796(5) 0.057(5) Uani 1 1 d G . . . .
H81 H 0.505790 0.455289 0.975128 0.068 Uiso 1 1 calc R U . . .
C75 C 0.5743(7) 0.4653(5) 1.0154(5) 0.059(6) Uani 1 1 d G . . . .
H75 H 0.558669 0.479116 1.035439 0.071 Uiso 1 1 calc R U . . .
C168 C 0.6285(7) 0.4591(6) 1.0219(4) 0.072(7) Uani 1 1 d G . . . .
H168 H 0.649949 0.468807 1.046382 0.086 Uiso 1 1 calc R U . . .
C117 C 0.6513(5) 0.4389(5) 0.9926(5) 0.064(6) Uani 1 1 d G . . . .
H117 H 0.688350 0.434671 0.997015 0.077 Uiso 1 1 calc R U . . .
F35 F 0.4905(8) 0.1932(5) 0.8401(5) 0.093(4) Uani 1 1 d . . . . .
F36 F 0.2299(9) 0.1941(6) 0.5569(6) 0.104(5) Uani 1 1 d . . . . .
F38 F 0.6779(6) 0.6170(5) 0.5993(6) 0.074(4) Uani 1 1 d . . . . .
F39 F 0.5924(10) 0.3018(6) 0.5371(6) 0.110(5) Uani 1 1 d . . . . .
C40 C 0.6908(6) 0.6272(3) 0.7232(5) 0.044(4) Uani 1 1 d G . . . .
C76 C 0.7133(5) 0.6590(4) 0.7027(5) 0.047(5) Uani 1 1 d G . . . .
H76 H 0.745080 0.653293 0.693384 0.057 Uiso 1 1 calc R U . . .
C96 C 0.6892(6) 0.6991(4) 0.6958(5) 0.054(6) Uani 1 1 d G . . . .
H96 H 0.704509 0.720877 0.681763 0.065 Uiso 1 1 calc R U . . .
C88 C 0.6426(6) 0.7075(3) 0.7094(5) 0.044(5) Uani 1 1 d G . . . .
H88 H 0.626114 0.734939 0.704668 0.053 Uiso 1 1 calc R U . . .
C134 C 0.6201(5) 0.6757(4) 0.7299(5) 0.050(6) Uani 1 1 d G . . . .
H134 H 0.588291 0.681417 0.739195 0.060 Uiso 1 1 calc R U . . .
C57 C 0.6442(6) 0.6356(3) 0.7368(5) 0.041(4) Uani 1 1 d G . . . .
H57 H 0.628861 0.613832 0.750817 0.049 Uiso 1 1 calc R U . . .
C41 C 0.4620(6) 0.5678(3) 0.8683(4) 0.036(4) Uani 1 1 d G . . . .
C6 C 0.4979(5) 0.5946(4) 0.8545(4) 0.035(4) Uani 1 1 d G . . . .
H6 H 0.525189 0.582558 0.842586 0.042 Uiso 1 1 calc R U . . .
C60 C 0.4940(6) 0.6392(4) 0.8581(5) 0.052(4) Uani 1 1 d G . . . .
C91 C 0.4542(7) 0.6569(3) 0.8755(5) 0.051(5) Uani 1 1 d G . . . .
H91 H 0.451475 0.687339 0.878023 0.061 Uiso 1 1 calc R U . . .
C52 C 0.4182(6) 0.6300(4) 0.8894(5) 0.060(4) Uani 1 1 d G . . . .
C98 C 0.4221(6) 0.5855(4) 0.8857(5) 0.046(5) Uani 1 1 d G . . . .
H98 H 0.397581 0.567123 0.895172 0.055 Uiso 1 1 calc R U . . .
C43 C 0.3757(6) 0.4300(5) 0.5419(4) 0.043(3) Uani 1 1 d G . . . .
C37 C 0.4304(6) 0.4328(5) 0.5483(4) 0.047(5) Uani 1 1 d G . . . .
H37 H 0.450986 0.421318 0.572427 0.056 Uiso 1 1 calc R U . . .
C63 C 0.4548(5) 0.4523(5) 0.5195(4) 0.038(4) Uani 1 1 d G . . . .
H63 H 0.492155 0.454140 0.523927 0.046 Uiso 1 1 calc R U . . .
C20 C 0.4247(6) 0.4690(5) 0.4843(4) 0.050(5) Uani 1 1 d G . . . .
H20 H 0.441365 0.482320 0.464575 0.060 Uiso 1 1 calc R U . . .
C16 C 0.3700(6) 0.4662(6) 0.4778(4) 0.066(8) Uani 1 1 d G . . . .
H16 H 0.349406 0.477680 0.453723 0.080 Uiso 1 1 calc R U . . .
C122 C 0.3456(5) 0.4467(5) 0.5066(5) 0.056(6) Uani 1 1 d G . . . .
H122 H 0.308236 0.444858 0.502223 0.067 Uiso 1 1 calc R U . . .
F44 F 0.4201(8) 0.1993(5) 0.8036(6) 0.094(4) Uani 1 1 d . . . . .
C45 C 0.7155(5) 0.3837(5) 0.9378(5) 0.047(4) Uani 1 1 d G . . . .
C87 C 0.7304(6) 0.3503(5) 0.9653(5) 0.075(9) Uani 1 1 d G . . . .
H87 H 0.704442 0.334673 0.975904 0.090 Uiso 1 1 calc R U . . .
C185 C 0.7834(7) 0.3397(5) 0.9771(5) 0.075(8) Uani 1 1 d G . . . .
H185 H 0.793556 0.316858 0.995824 0.090 Uiso 1 1 calc R U . . .
C186 C 0.8214(5) 0.3625(6) 0.9615(6) 0.072(8) Uani 1 1 d G . . . .
H186 H 0.857552 0.355254 0.969596 0.086 Uiso 1 1 calc R U . . .
C246 C 0.8065(6) 0.3959(6) 0.9341(6) 0.077(8) Uani 1 1 d G . . . .
H246 H 0.832436 0.411466 0.923449 0.093 Uiso 1 1 calc R U . . .
C172 C 0.7535(7) 0.4065(5) 0.9223(5) 0.064(7) Uani 1 1 d G . . . .
H172 H 0.743322 0.429282 0.903529 0.076 Uiso 1 1 calc R U . . .
F48 F 0.3320(7) 0.1877(5) 0.7259(6) 0.085(4) Uani 1 1 d . . . . .
C49 C 0.7178(6) 0.2876(4) 0.8365(5) 0.046(4) Uani 1 1 d G . . . .
C107 C 0.7413(6) 0.2755(4) 0.8756(5) 0.056(6) Uani 1 1 d G . . . .
H107 H 0.765228 0.294529 0.891920 0.067 Uiso 1 1 calc R U . . .
C125 C 0.7298(7) 0.2356(5) 0.8907(4) 0.059(4) Uani 1 1 d G . . . .
C2 C 0.6948(7) 0.2078(4) 0.8668(5) 0.048(4) Uani 1 1 d G . . . .
H2 H 0.686914 0.180499 0.877189 0.057 Uiso 1 1 calc R U . . .
C46 C 0.6713(6) 0.2199(4) 0.8278(5) 0.052(4) Uani 1 1 d G . . . .
C66 C 0.6828(6) 0.2598(5) 0.8126(4) 0.051(5) Uani 1 1 d G . . . .
H66 H 0.666787 0.268020 0.785882 0.061 Uiso 1 1 calc R U . . .
F50 F 0.1933(8) 0.2527(6) 0.5475(6) 0.098(4) Uani 1 1 d . . . . .
F55 F 0.3331(7) 0.6255(5) 0.9031(6) 0.082(4) Uani 1 1 d . . . . .
C70 C 0.2684(7) 0.2999(4) 0.6585(5) 0.053(4) Uani 1 1 d G . . . .
C120 C 0.3012(7) 0.2713(5) 0.6833(4) 0.057(5) Uani 1 1 d G . . . .
H120 H 0.316366 0.279365 0.710301 0.068 Uiso 1 1 calc R U . . .
C115 C 0.3120(6) 0.2310(4) 0.6687(5) 0.056(4) Uani 1 1 d G . . . .
C90 C 0.2898(7) 0.2192(4) 0.6292(5) 0.059(5) Uani 1 1 d G . . . .
H90 H 0.297153 0.191655 0.619169 0.071 Uiso 1 1 calc R U . . .
C179 C 0.2570(7) 0.2478(5) 0.6044(4) 0.072(5) Uani 1 1 d G . . . .
C126 C 0.2462(7) 0.2882(5) 0.6191(5) 0.066(6) Uani 1 1 d G . . . .
H126 H 0.223791 0.307729 0.602150 0.079 Uiso 1 1 calc R U . . .
C71 C 0.3222(6) 0.6364(3) 0.7778(5) 0.049(4) Uani 1 1 d G . . . .
C56 C 0.3680(6) 0.6432(4) 0.7625(5) 0.047(5) Uani 1 1 d G . . . .
H56 H 0.381577 0.620822 0.748122 0.056 Uiso 1 1 calc R U . . .
C142 C 0.3938(6) 0.6827(5) 0.7684(5) 0.062(7) Uani 1 1 d G . . . .
H142 H 0.425019 0.687376 0.757989 0.075 Uiso 1 1 calc R U . . .
C136 C 0.3738(6) 0.7154(3) 0.7895(5) 0.051(5) Uani 1 1 d G . . . .
H136 H 0.391476 0.742462 0.793512 0.061 Uiso 1 1 calc R U . . .
C141 C 0.3281(7) 0.7086(4) 0.8047(5) 0.068(7) Uani 1 1 d G . . . .
H141 H 0.314490 0.730995 0.819168 0.081 Uiso 1 1 calc R U . . .
C131 C 0.3023(6) 0.6691(5) 0.7989(6) 0.065(6) Uani 1 1 d G . . . .
H131 H 0.271047 0.664442 0.809301 0.078 Uiso 1 1 calc R U . . .
C72 C 0.3759(7) 0.3480(3) 0.5805(5) 0.047(4) Uani 1 1 d G . . . .
C62 C 0.3805(6) 0.3247(4) 0.6163(4) 0.042(5) Uani 1 1 d G . . . .
H62 H 0.369221 0.336998 0.639083 0.050 Uiso 1 1 calc R U . . .
C94 C 0.4017(6) 0.2833(4) 0.6187(4) 0.042(5) Uani 1 1 d G . . . .
H94 H 0.404831 0.267289 0.643225 0.050 Uiso 1 1 calc R U . . .
C144 C 0.4182(7) 0.2652(4) 0.5854(5) 0.051(6) Uani 1 1 d G . . . .
H144 H 0.432666 0.236909 0.587072 0.061 Uiso 1 1 calc R U . . .
C230 C 0.4136(8) 0.2886(5) 0.5496(4) 0.084(10) Uani 1 1 d G . . . .
H230 H 0.424891 0.276237 0.526776 0.101 Uiso 1 1 calc R U . . .
C173 C 0.3924(8) 0.3300(5) 0.5471(4) 0.085(11) Uani 1 1 d G . . . .
H173 H 0.389280 0.345946 0.522633 0.101 Uiso 1 1 calc R U . . .
C84 C 0.2993(7) 0.6267(4) 0.6179(5) 0.050(4) Uani 1 1 d G . . . .
C111 C 0.2607(7) 0.6473(5) 0.5900(4) 0.071(8) Uani 1 1 d G . . . .
H111 H 0.246613 0.633538 0.564972 0.085 Uiso 1 1 calc R U . . .
C221 C 0.2427(7) 0.6879(5) 0.5985(5) 0.070(8) Uani 1 1 d G . . . .
H221 H 0.216309 0.701932 0.579410 0.084 Uiso 1 1 calc R U . . .
C192 C 0.2633(7) 0.7079(4) 0.6351(6) 0.072(8) Uani 1 1 d G . . . .
H192 H 0.251045 0.735711 0.640940 0.086 Uiso 1 1 calc R U . . .
C169 C 0.3020(7) 0.6874(5) 0.6631(5) 0.072(8) Uani 1 1 d G . . . .
H169 H 0.316084 0.701097 0.688033 0.087 Uiso 1 1 calc R U . . .
C118 C 0.3200(6) 0.6468(5) 0.6545(5) 0.054(6) Uani 1 1 d G . . . .
H118 H 0.346388 0.632703 0.673596 0.064 Uiso 1 1 calc R U . . .
C85 C 0.7443(6) 0.5587(4) 0.6882(4) 0.041(3) Uani 1 1 d G . . . .
C106 C 0.7917(6) 0.5752(4) 0.6809(4) 0.049(5) Uani 1 1 d G . . . .
H106 H 0.812593 0.593269 0.700470 0.059 Uiso 1 1 calc R U . . .
C155 C 0.8084(6) 0.5652(5) 0.6451(5) 0.088(10) Uani 1 1 d G . . . .
H155 H 0.840828 0.576486 0.640111 0.106 Uiso 1 1 calc R U . . .
C193 C 0.7778(7) 0.5388(5) 0.6165(4) 0.065(7) Uani 1 1 d G . . . .
H193 H 0.789288 0.531994 0.591982 0.078 Uiso 1 1 calc R U . . .
C160 C 0.7304(7) 0.5223(4) 0.6238(4) 0.054(5) Uani 1 1 d G . . . .
H160 H 0.709513 0.504283 0.604210 0.065 Uiso 1 1 calc R U . . .
C104 C 0.7137(5) 0.5323(4) 0.6596(5) 0.048(5) Uani 1 1 d G . . . .
H104 H 0.681277 0.521065 0.664569 0.057 Uiso 1 1 calc R U . . .
C86 C 0.6133(7) 0.3432(3) 0.9170(5) 0.047(4) Uani 1 1 d G . . . .
C119 C 0.5925(8) 0.3269(5) 0.9492(4) 0.070(8) Uani 1 1 d G . . . .
H119 H 0.594485 0.343422 0.973231 0.083 Uiso 1 1 calc R U . . .
C279 C 0.5686(7) 0.2865(5) 0.9461(4) 0.071(8) Uani 1 1 d G . . . .
H279 H 0.554348 0.275382 0.968083 0.085 Uiso 1 1 calc R U . . .
C128 C 0.5656(6) 0.2623(4) 0.9109(5) 0.050(5) Uani 1 1 d G . . . .
H128 H 0.549349 0.234700 0.908799 0.060 Uiso 1 1 calc R U . . .
C108 C 0.5865(7) 0.2786(4) 0.8787(4) 0.047(5) Uani 1 1 d G . . . .
H108 H 0.584486 0.262059 0.854661 0.056 Uiso 1 1 calc R U . . .
C54 C 0.6104(6) 0.3190(4) 0.8818(4) 0.044(5) Uani 1 1 d G . . . .
H54 H 0.624622 0.330100 0.859808 0.053 Uiso 1 1 calc R U . . .
C99 C 0.2648(7) 0.5697(5) 0.8112(4) 0.049(4) Uani 1 1 d G . . . .
C196 C 0.2191(7) 0.5875(5) 0.8205(5) 0.082(9) Uani 1 1 d G . . . .
H196 H 0.197873 0.606080 0.801697 0.098 Uiso 1 1 calc R U . . .
C252 C 0.2045(6) 0.5780(6) 0.8573(6) 0.097(11) Uani 1 1 d G . . . .
H252 H 0.173295 0.590136 0.863612 0.116 Uiso 1 1 calc R U . . .
C171 C 0.2356(8) 0.5507(5) 0.8848(5) 0.074(7) Uani 1 1 d G . . . .
H171 H 0.225614 0.544263 0.909940 0.089 Uiso 1 1 calc R U . . .
C162 C 0.2813(7) 0.5330(5) 0.8755(4) 0.060(5) Uani 1 1 d G . . . .
H162 H 0.302512 0.514334 0.894353 0.072 Uiso 1 1 calc R U . . .
C130 C 0.2959(6) 0.5424(5) 0.8388(5) 0.049(4) Uani 1 1 d G . . . .
H130 H 0.327091 0.530278 0.832438 0.059 Uiso 1 1 calc R U . . .
C101 C 0.5333(13) 0.6692(8) 0.8444(9) 0.064(3) Uani 1 1 d . . . . .
C105 C 0.2766(5) 0.3943(5) 0.5574(5) 0.048(4) Uani 1 1 d G . . . .
C95 C 0.2411(7) 0.4221(5) 0.5706(5) 0.055(6) Uani 1 1 d G . . . .
H95 H 0.253615 0.444628 0.589190 0.066 Uiso 1 1 calc R U . . .
C282 C 0.1873(6) 0.4170(5) 0.5567(6) 0.068(7) Uani 1 1 d G . . . .
H282 H 0.163059 0.436036 0.565671 0.081 Uiso 1 1 calc R U . . .
C195 C 0.1690(5) 0.3841(6) 0.5295(6) 0.076(9) Uani 1 1 d G . . . .
H195 H 0.132247 0.380647 0.519936 0.091 Uiso 1 1 calc R U . . .
C201 C 0.2045(7) 0.3563(5) 0.5163(5) 0.076(8) Uani 1 1 d G . . . .
H201 H 0.191990 0.333849 0.497720 0.092 Uiso 1 1 calc R U . . .
C167 C 0.2583(6) 0.3614(5) 0.5303(6) 0.071(8) Uani 1 1 d G . . . .
H167 H 0.282546 0.342440 0.521238 0.085 Uiso 1 1 calc R U . . .
F109 F 0.5951(10) 0.2354(5) 0.5513(6) 0.113(5) Uani 1 1 d . . . . .
C112 C 0.6909(7) 0.4044(5) 0.6341(4) 0.047(4) Uani 1 1 d G . . . .
C158 C 0.7159(6) 0.3823(5) 0.6071(5) 0.077(9) Uani 1 1 d G . . . .
H158 H 0.746745 0.365913 0.616879 0.092 Uiso 1 1 calc R U . . .
C218 C 0.6958(8) 0.3842(6) 0.5657(5) 0.096(11) Uani 1 1 d G . . . .
H218 H 0.712931 0.369074 0.547267 0.115 Uiso 1 1 calc R U . . .
C207 C 0.6507(8) 0.4082(6) 0.5514(3) 0.075(8) Uani 1 1 d G . . . .
H207 H 0.636955 0.409440 0.523108 0.089 Uiso 1 1 calc R U . . .
C68 C 0.6256(6) 0.4303(5) 0.5784(5) 0.054(5) Uani 1 1 d G . . . .
H68 H 0.594793 0.446647 0.568562 0.065 Uiso 1 1 calc R U . . .
C19 C 0.6457(6) 0.4284(5) 0.6197(4) 0.047(5) Uani 1 1 d G . . . .
H19 H 0.628607 0.443487 0.638175 0.056 Uiso 1 1 calc R U . . .
C113 C 0.4638(13) 0.2224(8) 0.8185(9) 0.067(4) Uani 1 1 d . . . . .
C116 C 0.2116(5) 0.4386(5) 0.7985(5) 0.048(3) Uani 1 1 d G . . . .
C132 C 0.1850(7) 0.4366(5) 0.7586(5) 0.051(5) Uani 1 1 d G . . . .
H132 H 0.200419 0.422129 0.738771 0.062 Uiso 1 1 calc R U . . .
C188 C 0.1358(7) 0.4559(6) 0.7475(5) 0.078(8) Uani 1 1 d G . . . .
H188 H 0.117633 0.454625 0.720237 0.093 Uiso 1 1 calc R U . . .
C217 C 0.1133(6) 0.4772(6) 0.7765(7) 0.072(7) Uani 1 1 d G . . . .
H217 H 0.079663 0.490351 0.768975 0.087 Uiso 1 1 calc R U . . .
C256 C 0.1399(8) 0.4791(7) 0.8165(6) 0.101(12) Uani 1 1 d G . . . .
H256 H 0.124478 0.493581 0.836248 0.121 Uiso 1 1 calc R U . . .
C184 C 0.1891(8) 0.4598(7) 0.8275(4) 0.092(11) Uani 1 1 d G . . . .
H184 H 0.207264 0.461085 0.854783 0.110 Uiso 1 1 calc R U . . .
C133 C 0.2714(7) 0.5518(6) 0.5699(6) 0.062(4) Uani 1 1 d G . . . .
C209 C 0.2728(7) 0.5450(6) 0.5292(6) 0.081(8) Uani 1 1 d G . . . .
H209 H 0.304323 0.550257 0.519310 0.097 Uiso 1 1 calc R U . . .
C180 C 0.2280(9) 0.5305(6) 0.5030(5) 0.083(7) Uani 1 1 d G . . . .
H180 H 0.228973 0.525805 0.475185 0.100 Uiso 1 1 calc R U . . .
C335 C 0.1819(7) 0.5228(6) 0.5174(6) 0.102(10) Uani 1 1 d G . . . .
H335 H 0.151340 0.512828 0.499526 0.122 Uiso 1 1 calc R U . . .
C280 C 0.1806(7) 0.5296(6) 0.5581(7) 0.086(8) Uani 1 1 d G . . . .
H280 H 0.149055 0.524302 0.567993 0.103 Uiso 1 1 calc R U . . .
C205 C 0.2253(8) 0.5441(6) 0.5843(5) 0.075(7) Uani 1 1 d G . . . .
H205 H 0.224404 0.548753 0.612119 0.089 Uiso 1 1 calc R U . . .
C135 C 0.5245(13) 0.2196(7) 0.6792(9) 0.064(4) Uani 1 1 d . . . . .
F137 F 0.6512(9) 0.2736(7) 0.5764(6) 0.113(5) Uani 1 1 d . . . . .
C139 C 0.6367(11) 0.6412(8) 0.5929(9) 0.052(3) Uani 1 1 d . . . . .
C140 C 0.3021(7) 0.4163(5) 0.8629(4) 0.050(4) Uani 1 1 d G . . . .
C235 C 0.2740(6) 0.3991(6) 0.8907(5) 0.078(9) Uani 1 1 d G . . . .
H235 H 0.240538 0.386231 0.881446 0.094 Uiso 1 1 calc R U . . .
C200 C 0.2949(8) 0.4008(7) 0.9319(5) 0.106(13) Uani 1 1 d G . . . .
H200 H 0.275712 0.389107 0.950852 0.127 Uiso 1 1 calc R U . . .
C219 C 0.3439(8) 0.4197(6) 0.9454(3) 0.073(8) Uani 1 1 d G . . . .
H219 H 0.358143 0.420872 0.973577 0.088 Uiso 1 1 calc R U . . .
C97 C 0.3719(5) 0.4369(5) 0.9177(5) 0.053(5) Uani 1 1 d G . . . .
H97 H 0.405399 0.449762 0.926896 0.064 Uiso 1 1 calc R U . . .
C79 C 0.3510(6) 0.4352(4) 0.8764(4) 0.041(4) Uani 1 1 d G . . . .
H79 H 0.370225 0.446886 0.857489 0.050 Uiso 1 1 calc R U . . .
C143 C 0.7310(7) 0.5398(5) 0.9270(5) 0.059(4) Uani 1 1 d G . . . .
C199 C 0.7284(7) 0.5329(6) 0.9675(6) 0.068(6) Uani 1 1 d G . . . .
H199 H 0.697956 0.541425 0.977533 0.081 Uiso 1 1 calc R U . . .
C232 C 0.7705(9) 0.5137(7) 0.9933(4) 0.116(13) Uani 1 1 d G . . . .
H232 H 0.768731 0.509013 1.020952 0.139 Uiso 1 1 calc R U . . .
C316 C 0.8150(7) 0.5013(7) 0.9786(6) 0.100(10) Uani 1 1 d G . . . .
H316 H 0.843768 0.488125 0.996251 0.120 Uiso 1 1 calc R U . . .
C268 C 0.8176(7) 0.5081(6) 0.9382(7) 0.085(8) Uani 1 1 d G . . . .
H268 H 0.848030 0.499649 0.928132 0.102 Uiso 1 1 calc R U . . .
C234 C 0.7755(8) 0.5274(6) 0.9124(5) 0.075(7) Uani 1 1 d G . . . .
H234 H 0.777255 0.532060 0.884712 0.090 Uiso 1 1 calc R U . . .
C145 C 0.7096(7) 0.6165(4) 0.8811(5) 0.056(4) Uani 1 1 d G . . . .
C123 C 0.6894(6) 0.6377(5) 0.8450(5) 0.062(7) Uani 1 1 d G . . . .
H123 H 0.662072 0.624752 0.825906 0.075 Uiso 1 1 calc R U . . .
C121 C 0.7093(7) 0.6778(5) 0.8370(5) 0.061(7) Uani 1 1 d G . . . .
H121 H 0.695543 0.692285 0.812358 0.074 Uiso 1 1 calc R U . . .
C182 C 0.7494(7) 0.6967(4) 0.8650(6) 0.067(7) Uani 1 1 d G . . . .
H182 H 0.762960 0.724118 0.859492 0.080 Uiso 1 1 calc R U . . .
C249 C 0.7695(7) 0.6755(5) 0.9010(6) 0.108(13) Uani 1 1 d G . . . .
H249 H 0.796905 0.688419 0.920174 0.129 Uiso 1 1 calc R U . . .
C177 C 0.7497(8) 0.6354(5) 0.9091(5) 0.074(8) Uani 1 1 d G . . . .
H177 H 0.763434 0.620885 0.933722 0.089 Uiso 1 1 calc R U . . .
C148 C 0.9389(8) 0.3171(6) 0.9017(7) 0.087(5) Uani 1 1 d G . . . .
C213 C 0.9070(6) 0.2850(7) 0.9130(6) 0.076(7) Uani 1 1 d G . . . .
H213 H 0.870921 0.283290 0.900301 0.091 Uiso 1 1 calc R U . . .
C194 C 0.9278(8) 0.2553(6) 0.9428(7) 0.080(8) Uani 1 1 d G . . . .
H194 H 0.905911 0.233358 0.950473 0.096 Uiso 1 1 calc R U . . .
C283 C 0.9805(8) 0.2577(7) 0.9613(7) 0.095(10) Uani 1 1 d G . . . .
H283 H 0.994715 0.237473 0.981666 0.114 Uiso 1 1 calc R U . . .
C5 C 1.0125(6) 0.2898(8) 0.9500(8) 0.141(17) Uani 1 1 d G . . . .
H5 H 1.048529 0.291520 0.962686 0.170 Uiso 1 1 calc R U . . .
C290 C 0.9917(8) 0.3195(7) 0.9202(8) 0.150(19) Uani 1 1 d G . . . .
H290 H 1.013539 0.341452 0.912514 0.180 Uiso 1 1 calc R U . . .
C149 C 0.7790(6) 0.5836(5) 0.7720(5) 0.047(3) Uani 1 1 d G . . . .
C226 C 0.8086(7) 0.5474(4) 0.7865(6) 0.075(8) Uani 1 1 d G . . . .
H226 H 0.798265 0.519642 0.775828 0.089 Uiso 1 1 calc R U . . .
C214 C 0.8532(7) 0.5519(5) 0.8166(7) 0.083(9) Uani 1 1 d G . . . .
H214 H 0.873398 0.527206 0.826467 0.100 Uiso 1 1 calc R U . . .
C228 C 0.8683(7) 0.5925(6) 0.8321(6) 0.107(12) Uani 1 1 d G . . . .
H228 H 0.898806 0.595616 0.852697 0.129 Uiso 1 1 calc R U . . .
C114 C 0.8388(8) 0.6287(5) 0.8176(6) 0.085(9) Uani 1 1 d G . . . .
H114 H 0.849081 0.656463 0.828288 0.102 Uiso 1 1 calc R U . . .
C159 C 0.7941(7) 0.6242(4) 0.7876(6) 0.075(8) Uani 1 1 d G . . . .
H159 H 0.773948 0.648900 0.777648 0.090 Uiso 1 1 calc R U . . .
F150 F 0.3670(13) 0.3148(8) 0.9462(10) 0.069(6) Uani 0.5 1 d D . P A 1
F152 F 0.3643(12) 0.2466(8) 0.9375(11) 0.069(6) Uani 0.5 1 d D . P A 1
C157 C 0.7820(5) 0.4250(5) 0.6974(5) 0.046(3) Uani 1 1 d G . . . .
C78 C 0.8073(6) 0.4279(5) 0.7377(5) 0.053(5) Uani 1 1 d G . . . .
H78 H 0.790437 0.417487 0.758573 0.064 Uiso 1 1 calc R U . . .
C178 C 0.8573(6) 0.4460(6) 0.7473(5) 0.062(6) Uani 1 1 d G . . . .
H178 H 0.874606 0.448008 0.774850 0.074 Uiso 1 1 calc R U . . .
C229 C 0.8820(6) 0.4613(7) 0.7168(7) 0.105(12) Uani 1 1 d G . . . .
H229 H 0.916124 0.473676 0.723376 0.126 Uiso 1 1 calc R U . . .
C319 C 0.8566(8) 0.4584(7) 0.6765(6) 0.110(13) Uani 1 1 d G . . . .
H319 H 0.873474 0.468823 0.655625 0.132 Uiso 1 1 calc R U . . .
C222 C 0.8066(7) 0.4403(6) 0.6669(4) 0.066(7) Uani 1 1 d G . . . .
H222 H 0.789305 0.438302 0.639348 0.079 Uiso 1 1 calc R U . . .
C164 C 0.2299(7) 0.5963(5) 0.7292(5) 0.053(4) Uani 1 1 d G . . . .
C174 C 0.2183(7) 0.6366(5) 0.7115(6) 0.064(6) Uani 1 1 d G . . . .
H174 H 0.240814 0.660468 0.719842 0.077 Uiso 1 1 calc R U . . .
C208 C 0.1736(9) 0.6420(5) 0.6816(7) 0.101(12) Uani 1 1 d G . . . .
H208 H 0.165694 0.669507 0.669453 0.122 Uiso 1 1 calc R U . . .
C293 C 0.1407(8) 0.6071(7) 0.6693(7) 0.123(14) Uani 1 1 d G . . . .
H293 H 0.110154 0.610734 0.648864 0.147 Uiso 1 1 calc R U . . .
C364 C 0.1523(8) 0.5668(6) 0.6870(8) 0.114(13) Uani 1 1 d G . . . .
H364 H 0.129734 0.542921 0.678664 0.136 Uiso 1 1 calc R U . . .
C240 C 0.1969(8) 0.5614(4) 0.7170(7) 0.101(11) Uani 1 1 d G . . . .
H240 H 0.204854 0.533881 0.729053 0.121 Uiso 1 1 calc R U . . .
F175 F 0.6508(8) 0.1762(6) 0.7719(6) 0.099(4) Uani 1 1 d D . . . .
C181 C 0.3908(9) 0.2816(5) 0.9342(7) 0.067(4) Uani 1 1 d D . . . .
F190 F 0.4276(10) 0.2774(9) 0.9661(8) 0.071(5) Uani 0.5 1 d D . P A 1
C191 C 0.3522(13) 0.2031(9) 0.6963(10) 0.068(3) Uani 1 1 d . . . . .
C198 C 0.5980(16) 0.2732(10) 0.5645(10) 0.089(5) Uani 1 1 d . . . . .
C211 C 0.0596(9) 0.3750(6) 0.6660(6) 0.0867(18) Uani 1 1 d G . . . .
C251 C 0.0178(8) 0.3987(6) 0.6753(6) 0.0867(18) Uani 1 1 d G . . . .
H251 H -0.002347 0.416882 0.655403 0.104 Uiso 1 1 calc R U . . .
C271 C 0.0053(7) 0.3958(6) 0.7137(7) 0.0867(18) Uani 1 1 d G . . . .
H271 H -0.023278 0.411971 0.720026 0.104 Uiso 1 1 calc R U . . .
C285 C 0.0348(8) 0.3692(6) 0.7428(6) 0.0867(18) Uani 1 1 d G . . . .
H285 H 0.026253 0.367207 0.769019 0.104 Uiso 1 1 calc R U . . .
C303 C 0.0766(8) 0.3455(5) 0.7335(7) 0.0867(18) Uani 1 1 d G . . . .
H303 H 0.096716 0.327352 0.753389 0.104 Uiso 1 1 calc R U . . .
C264 C 0.0890(7) 0.3484(6) 0.6951(8) 0.0867(18) Uani 1 1 d G . . . .
H264 H 0.117647 0.332262 0.688767 0.104 Uiso 1 1 calc R U . . .
F224 F 0.7977(7) 0.2411(5) 0.9480(5) 0.074(4) Uani 1 1 d . . . . .
C231 C 0.9467(8) 0.3980(5) 0.8662(8) 0.094(2) Uani 1 1 d G . . . .
C309 C 0.9713(8) 0.4154(7) 0.8365(6) 0.094(2) Uani 1 1 d G . . . .
H309 H 0.974484 0.398753 0.813365 0.113 Uiso 1 1 calc R U . . .
C244 C 0.9913(8) 0.4572(7) 0.8407(6) 0.094(2) Uani 1 1 d G . . . .
H244 H 1.008146 0.469077 0.820447 0.113 Uiso 1 1 calc R U . . .
C7 C 0.9867(8) 0.4815(5) 0.8747(7) 0.094(2) Uani 1 1 d G . . . .
H7 H 1.000362 0.510054 0.877528 0.113 Uiso 1 1 calc R U . . .
C247 C 0.9621(8) 0.4641(7) 0.9044(6) 0.094(2) Uani 1 1 d G . . . .
H247 H 0.958916 0.480706 0.927529 0.113 Uiso 1 1 calc R U . . .
C13 C 0.9421(8) 0.4223(7) 0.9001(7) 0.094(2) Uani 1 1 d G . . . .
H13 H 0.925253 0.410382 0.920448 0.113 Uiso 1 1 calc R U . . .
C254 C 0.2389(16) 0.2355(11) 0.5636(10) 0.084(4) Uani 1 1 d . . . . .
C261 C 0.0897(6) 0.3017(6) 0.5736(7) 0.0867(18) Uani 1 1 d G . . . .
H261 H 0.124623 0.311007 0.573100 0.104 Uiso 1 1 calc R U . . .
C102 C 0.0589(8) 0.3245(5) 0.5962(7) 0.0867(18) Uani 1 1 d G . . . .
C245 C 0.0079(8) 0.3108(6) 0.5970(6) 0.0867(18) Uani 1 1 d G . . . .
H245 H -0.013188 0.326405 0.612361 0.104 Uiso 1 1 calc R U . . .
C11 C -0.0123(6) 0.2744(6) 0.5753(7) 0.0867(18) Uani 1 1 d G . . . .
H11 H -0.047213 0.265119 0.575799 0.104 Uiso 1 1 calc R U . . .
C308 C 0.0185(8) 0.2517(5) 0.5527(6) 0.0867(18) Uani 1 1 d G . . . .
H308 H 0.004678 0.226777 0.537887 0.104 Uiso 1 1 calc R U . . .
C216 C 0.0695(8) 0.2653(6) 0.5519(6) 0.0867(18) Uani 1 1 d G . . . .
H216 H 0.090596 0.249721 0.536537 0.104 Uiso 1 1 calc R U . . .
C295 C 0.9303(9) 0.3253(6) 0.8136(6) 0.094(2) Uani 1 1 d G . . . .
C138 C 0.9745(8) 0.2989(7) 0.8166(6) 0.094(2) Uani 1 1 d G . . . .
H138 H 0.996367 0.294011 0.842205 0.113 Uiso 1 1 calc R U . . .
C14 C 0.9865(7) 0.2798(6) 0.7820(8) 0.094(2) Uani 1 1 d G . . . .
H14 H 1.016631 0.261812 0.784038 0.113 Uiso 1 1 calc R U . . .
C288 C 0.9544(9) 0.2870(6) 0.7445(6) 0.094(2) Uani 1 1 d G . . . .
H288 H 0.962647 0.273973 0.720891 0.113 Uiso 1 1 calc R U . . .
C324 C 0.9103(8) 0.3134(7) 0.7415(6) 0.094(2) Uani 1 1 d G . . . .
H324 H 0.888398 0.318334 0.715911 0.113 Uiso 1 1 calc R U . . .
C322 C 0.8983(7) 0.3325(6) 0.7761(8) 0.094(2) Uani 1 1 d G . . . .
H322 H 0.868133 0.350533 0.774077 0.113 Uiso 1 1 calc R U . . .
F15 F 0.7552(7) 0.1816(5) 0.9384(5) 0.074(4) Uani 1 1 d . . . . .
F14 F 0.3928(8) 0.6501(6) 0.9483(6) 0.087(4) Uani 1 1 d . . . . .
C32 C 0.7520(14) 0.2252(10) 0.9340(10) 0.071(3) Uani 1 1 d . . . . .
C4 C 0.3769(14) 0.6482(9) 0.9081(10) 0.072(4) Uani 1 1 d . . . . .
F17 F 0.6229(8) 0.1564(5) 0.8207(6) 0.104(5) Uani 1 1 d D . . . .
C8 C 0.6348(8) 0.1917(6) 0.8035(6) 0.079(4) Uani 1 1 d D . . . .
C9 C 0.0024(8) 0.4087(5) 0.5618(6) 0.0867(18) Uani 1 1 d G . . . .
H9 H -0.008151 0.379571 0.556224 0.104 Uiso 1 1 calc R U . . .
C259 C -0.0265(6) 0.4422(6) 0.5409(6) 0.0867(18) Uani 1 1 d G . . . .
H259 H -0.056879 0.435970 0.520975 0.104 Uiso 1 1 calc R U . . .
C10 C -0.0110(7) 0.4848(5) 0.5491(6) 0.0867(18) Uani 1 1 d G . . . .
H10 H -0.030824 0.507651 0.534777 0.104 Uiso 1 1 calc R U . . .
C227 C 0.0334(8) 0.4938(5) 0.5782(7) 0.0867(18) Uani 1 1 d G . . . .
H227 H 0.043959 0.522933 0.583829 0.104 Uiso 1 1 calc R U . . .
C15 C 0.0623(6) 0.4603(6) 0.5992(5) 0.0867(18) Uani 1 1 d G . . . .
H15 H 0.092688 0.466535 0.619079 0.104 Uiso 1 1 calc R U . . .
C189 C 0.0469(7) 0.4178(5) 0.5910(5) 0.0867(18) Uani 1 1 d G . . . .
F83 F 0.3401(9) 0.2771(13) 0.9240(11) 0.091(7) Uani 0.5 1 d D . P A 2
F195 F 0.3969(17) 0.2421(8) 0.9476(13) 0.086(7) Uani 0.5 1 d D . P A 2
F199 F 0.4064(19) 0.3086(12) 0.9634(9) 0.094(8) Uani 0.5 1 d D . P A 2
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'
Au Au -2.0133 8.8022 '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'
F F 0.0171 0.0103 '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'
S S 0.1246 0.1234 '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
Au03 Au01 Ag0B 113.26(4) . . ?
Au03 Au01 Ag0C 61.69(4) . . ?
Au03 Au01 Ag0E 63.25(4) . . ?
Au03 Au01 Ag0G 175.70(5) . . ?
Au03 Au01 Ag0I 113.11(4) . . ?
Au03 Au01 Ag0K 117.56(5) . . ?
Au03 Au01 Ag0M 61.44(4) . . ?
Au03 Au01 Ag0P 64.59(4) . . ?
Au05 Au01 Au03 116.34(4) . . ?
Au05 Au01 Au07 121.74(4) . . ?
Au05 Au01 Au09 66.05(3) . . ?
Au05 Au01 Ag0B 114.69(4) . . ?
Au05 Au01 Ag0C 111.98(4) . . ?
Au05 Au01 Ag0E 173.96(5) . . ?
Au05 Au01 Ag0G 64.71(4) . . ?
Au05 Au01 Ag0I 61.31(4) . . ?
Au05 Au01 Ag0K 120.02(5) . . ?
Au05 Au01 Ag0M 61.95(4) . . ?
Au05 Au01 Ag0P 65.34(5) . . ?
Au07 Au01 Au03 64.73(3) . . ?
Au07 Au01 Au09 66.04(3) . . ?
Au07 Au01 Ag0B 116.38(4) . . ?
Au07 Au01 Ag0C 115.93(4) . . ?
Au07 Au01 Ag0E 63.96(4) . . ?
Au07 Au01 Ag0G 118.64(4) . . ?
Au07 Au01 Ag0I 176.68(5) . . ?
Au07 Au01 Ag0K 64.32(4) . . ?
Au07 Au01 Ag0M 116.24(5) . . ?
Au07 Au01 Ag0P 65.21(4) . . ?
Au09 Au01 Au03 119.51(4) . . ?
Au09 Au01 Ag0B 118.83(4) . . ?
Au09 Au01 Ag0C 177.94(5) . . ?
Au09 Au01 Ag0E 119.71(4) . . ?
Au09 Au01 Ag0G 64.78(4) . . ?
Au09 Au01 Ag0I 117.18(4) . . ?
Au09 Au01 Ag0K 65.95(4) . . ?
Au09 Au01 Ag0M 116.50(5) . . ?
Au09 Au01 Ag0P 64.25(4) . . ?
Ag0B Au01 Ag0C 61.15(4) . . ?
Ag0B Au01 Ag0I 61.73(4) . . ?
Ag0B Au01 Ag0M 114.43(5) . . ?
Ag0C Au01 Ag0I 60.86(5) . . ?
Ag0C Au01 Ag0M 62.32(5) . . ?
Ag0E Au01 Ag0B 61.59(5) . . ?
Ag0E Au01 Ag0C 62.24(4) . . ?
Ag0E Au01 Ag0I 112.94(5) . . ?
Ag0E Au01 Ag0M 114.47(5) . . ?
Ag0G Au01 Ag0B 63.15(5) . . ?
Ag0G Au01 Ag0C 114.01(5) . . ?
Ag0G Au01 Ag0E 115.22(6) . . ?
Ag0G Au01 Ag0I 63.39(4) . . ?
Ag0G Au01 Ag0M 117.24(5) . . ?
Ag0K Au01 Ag0B 63.64(5) . . ?
Ag0K Au01 Ag0C 115.24(5) . . ?
Ag0K Au01 Ag0E 63.43(5) . . ?
Ag0K Au01 Ag0G 63.57(5) . . ?
Ag0K Au01 Ag0I 115.79(5) . . ?
Ag0K Au01 Ag0M 177.55(6) . . ?
Ag0K Au01 Ag0P 119.29(5) . . ?
Ag0M Au01 Ag0I 63.50(5) . . ?
Ag0P Au01 Ag0B 176.81(5) . . ?
Ag0P Au01 Ag0C 115.74(5) . . ?
Ag0P Au01 Ag0E 118.08(6) . . ?
Ag0P Au01 Ag0G 118.88(6) . . ?
Ag0P Au01 Ag0I 116.53(5) . . ?
Ag0P Au01 Ag0M 62.60(5) . . ?
Au04 Au02 Au0A 120.29(4) . . ?
Au04 Au02 Ag0B 112.66(4) . . ?
Au04 Au02 Ag0D 63.02(4) . . ?
Au04 Au02 Ag0F 61.52(4) . . ?
Au04 Au02 Ag0H 112.75(4) . . ?
Au04 Au02 Ag0J 175.23(5) . . ?
Au04 Au02 Ag0L 117.43(5) . . ?
Au04 Au02 Ag0N 61.76(4) . . ?
Au04 Au02 Ag0O 64.86(5) . . ?
Au06 Au02 Au04 116.93(4) . . ?
Au06 Au02 Au0A 65.78(3) . . ?
Au06 Au02 Ag0B 114.54(4) . . ?
Au06 Au02 Ag0D 173.93(5) . . ?
Au06 Au02 Ag0F 111.93(4) . . ?
Au06 Au02 Ag0H 61.30(4) . . ?
Au06 Au02 Ag0J 64.64(4) . . ?
Au06 Au02 Ag0L 119.80(5) . . ?
Au06 Au02 Ag0N 62.19(4) . . ?
Au06 Au02 Ag0O 65.19(5) . . ?
Au08 Au02 Au04 64.90(3) . . ?
Au08 Au02 Au06 121.40(4) . . ?
Au08 Au02 Au0A 66.12(3) . . ?
Au08 Au02 Ag0B 116.84(4) . . ?
Au08 Au02 Ag0D 64.44(4) . . ?
Au08 Au02 Ag0F 116.41(5) . . ?
Au08 Au02 Ag0H 176.87(5) . . ?
Au08 Au02 Ag0J 118.60(4) . . ?
Au08 Au02 Ag0L 64.62(4) . . ?
Au08 Au02 Ag0N 116.37(5) . . ?
Au08 Au02 Ag0O 65.47(4) . . ?
Au0A Au02 Ag0B 118.72(4) . . ?
Au0A Au02 Ag0D 119.86(4) . . ?
Au0A Au02 Ag0F 177.45(5) . . ?
Au0A Au02 Ag0H 116.99(5) . . ?
Au0A Au02 Ag0J 64.47(4) . . ?
Au0A Au02 Ag0L 65.92(4) . . ?
Au0A Au02 Ag0N 116.84(5) . . ?
Au0A Au02 Ag0O 65.11(5) . . ?
Ag0B Au02 Ag0F 60.85(4) . . ?
Ag0B Au02 Ag0H 61.74(4) . . ?
Ag0B Au02 Ag0N 113.88(5) . . ?
Ag0D Au02 Ag0B 61.41(5) . . ?
Ag0D Au02 Ag0F 62.38(4) . . ?
Ag0D Au02 Ag0H 112.82(5) . . ?
Ag0D Au02 Ag0N 114.50(5) . . ?
Ag0F Au02 Ag0H 60.49(5) . . ?
Ag0J Au02 Ag0B 63.14(5) . . ?
Ag0J Au02 Ag0D 114.90(5) . . ?
Ag0J Au02 Ag0F 113.74(5) . . ?
Ag0J Au02 Ag0H 63.63(4) . . ?
Ag0J Au02 Ag0N 117.16(5) . . ?
Ag0L Au02 Ag0B 63.73(5) . . ?
Ag0L Au02 Ag0D 63.33(5) . . ?
Ag0L Au02 Ag0F 115.21(6) . . ?
Ag0L Au02 Ag0H 115.90(5) . . ?
Ag0L Au02 Ag0J 63.40(5) . . ?
Ag0L Au02 Ag0N 177.23(6) . . ?
Ag0L Au02 Ag0O 120.13(5) . . ?
Ag0N Au02 Ag0F 62.03(5) . . ?
Ag0N Au02 Ag0H 62.96(5) . . ?
Ag0O Au02 Ag0B 175.94(5) . . ?
Ag0O Au02 Ag0D 118.49(6) . . ?
Ag0O Au02 Ag0F 115.26(5) . . ?
Ag0O Au02 Ag0H 115.77(5) . . ?
Ag0O Au02 Ag0J 119.19(6) . . ?
Ag0O Au02 Ag0N 62.23(5) . . ?
Au01 Au03 Au07 57.13(3) . . ?
Au01 Au03 Ag0C 61.60(4) . . ?
Au01 Au03 Ag0E 59.68(4) . . ?
Au01 Au03 Ag0M 61.90(4) . . ?
Au01 Au03 Ag0P 58.48(4) . . ?
Au07 Au03 Ag0P 60.61(4) . . ?
Ag0C Au03 Au07 109.60(4) . . ?
Ag0C Au03 Ag0E 61.06(4) . . ?
Ag0C Au03 Ag0P 110.66(5) . . ?
Ag0E Au03 Au07 60.29(4) . . ?
Ag0E Au03 Ag0P 109.98(5) . . ?
Ag0M Au03 Au07 110.31(4) . . ?
Ag0M Au03 Ag0C 62.44(5) . . ?
Ag0M Au03 Ag0E 111.91(5) . . ?
Ag0M Au03 Ag0P 60.79(5) . . ?
P010 Au03 Au01 171.93(15) . . ?
P010 Au03 Au07 130.08(16) . . ?
P010 Au03 Ag0C 114.40(17) . . ?
P010 Au03 Ag0E 125.66(17) . . ?
P010 Au03 Ag0M 110.14(15) . . ?
P010 Au03 Ag0P 119.96(18) . . ?
Au02 Au04 Au08 57.14(3) . . ?
Au02 Au04 Ag0D 59.91(4) . . ?
Au02 Au04 Ag0F 62.04(4) . . ?
Au02 Au04 Ag0N 61.88(4) . . ?
Au02 Au04 Ag0O 58.53(4) . . ?
Au08 Au04 Ag0O 60.75(4) . . ?
Ag0D Au04 Au08 60.84(4) . . ?
Ag0D Au04 Ag0O 110.55(5) . . ?
Ag0F Au04 Au08 110.42(4) . . ?
Ag0F Au04 Ag0D 61.56(4) . . ?
Ag0F Au04 Ag0N 62.24(5) . . ?
Ag0F Au04 Ag0O 110.56(5) . . ?
Ag0N Au04 Au08 110.07(5) . . ?
Ag0N Au04 Ag0D 112.04(5) . . ?
Ag0N Au04 Ag0O 60.27(5) . . ?
P00Y Au04 Au02 171.96(14) . . ?
P00Y Au04 Au08 130.14(15) . . ?
P00Y Au04 Ag0D 125.19(16) . . ?
P00Y Au04 Ag0F 113.68(16) . . ?
P00Y Au04 Ag0N 110.24(14) . . ?
P00Y Au04 Ag0O 120.10(17) . . ?
Au01 Au05 Au09 57.43(3) . . ?
Au01 Au05 Ag0G 59.07(4) . . ?
Au01 Au05 Ag0I 62.79(4) . . ?
Au01 Au05 Ag0M 62.21(4) . . ?
Au01 Au05 Ag0P 58.64(4) . . ?
Au09 Au05 Ag0P 59.35(4) . . ?
Ag0G Au05 Au09 60.15(4) . . ?
Ag0G Au05 Ag0P 108.79(5) . . ?
Ag0I Au05 Au09 111.29(4) . . ?
Ag0I Au05 Ag0G 62.06(5) . . ?
Ag0I Au05 Ag0M 64.07(5) . . ?
Ag0I Au05 Ag0P 112.23(5) . . ?
Ag0M Au05 Au09 109.75(4) . . ?
Ag0M Au05 Ag0G 112.75(5) . . ?
Ag0M Au05 Ag0P 60.58(5) . . ?
P017 Au05 Au01 171.96(16) . . ?
P017 Au05 Au09 130.51(15) . . ?
P017 Au05 Ag0G 121.91(18) . . ?
P017 Au05 Ag0I 110.02(17) . . ?
P017 Au05 Ag0M 112.08(15) . . ?
P017 Au05 Ag0P 124.70(19) . . ?
Au02 Au06 Au0A 57.33(3) . . ?
Au02 Au06 Ag0H 62.58(4) . . ?
Au02 Au06 Ag0J 58.88(4) . . ?
Au02 Au06 Ag0N 61.82(4) . . ?
Au02 Au06 Ag0O 58.53(4) . . ?
Au0A Au06 Ag0O 60.16(4) . . ?
Ag0H Au06 Au0A 111.05(4) . . ?
Ag0H Au06 Ag0J 62.18(4) . . ?
Ag0H Au06 Ag0N 63.26(5) . . ?
Ag0H Au06 Ag0O 111.38(6) . . ?
Ag0J Au06 Au0A 59.85(4) . . ?
Ag0J Au06 Ag0O 108.93(5) . . ?
Ag0N Au06 Au0A 109.66(4) . . ?
Ag0N Au06 Ag0J 112.06(5) . . ?
Ag0N Au06 Ag0O 60.03(5) . . ?
P013 Au06 Au02 172.07(16) . . ?
P013 Au06 Au0A 130.57(16) . . ?
P013 Au06 Ag0H 110.54(18) . . ?
P013 Au06 Ag0J 122.59(18) . . ?
P013 Au06 Ag0N 112.18(16) . . ?
P013 Au06 Ag0O 124.19(19) . . ?
Au01 Au07 Au03 58.15(3) . . ?
Au01 Au07 Au09 57.39(3) . . ?
Au01 Au07 Ag0E 59.83(4) . . ?
Au01 Au07 Ag0K 58.99(4) . . ?
Au01 Au07 Ag0P 58.66(4) . . ?
Au03 Au07 Au09 106.99(3) . . ?
Au03 Au07 Ag0E 59.83(4) . . ?
Au03 Au07 Ag0K 107.86(4) . . ?
Au03 Au07 Ag0P 60.30(4) . . ?
Ag0E Au07 Au09 109.07(4) . . ?
Ag0E Au07 Ag0P 109.36(5) . . ?
Ag0K Au07 Au09 61.27(4) . . ?
Ag0K Au07 Ag0E 60.39(5) . . ?
Ag0K Au07 Ag0P 109.42(5) . . ?
Ag0P Au07 Au09 59.38(4) . . ?
P016 Au07 Au01 176.77(19) . . ?
P016 Au07 Au03 119.22(17) . . ?
P016 Au07 Au09 123.55(18) . . ?
P016 Au07 Ag0E 121.07(19) . . ?
P016 Au07 Ag0K 124.24(19) . . ?
P016 Au07 Ag0P 118.7(2) . . ?
Au02 Au08 Au04 57.96(3) . . ?
Au02 Au08 Au0A 57.39(3) . . ?
Au02 Au08 Ag0D 59.57(4) . . ?
Au02 Au08 Ag0L 58.94(4) . . ?
Au02 Au08 Ag0O 58.62(4) . . ?
Au04 Au08 Au0A 107.29(3) . . ?
Au04 Au08 Ag0D 59.28(4) . . ?
Au04 Au08 Ag0L 107.26(4) . . ?
Au04 Au08 Ag0O 60.35(4) . . ?
Au0A Au08 Ag0O 60.06(4) . . ?
Ag0D Au08 Au0A 108.61(4) . . ?
Ag0D Au08 Ag0O 108.95(5) . . ?
Ag0L Au08 Au0A 61.13(4) . . ?
Ag0L Au08 Ag0D 59.97(5) . . ?
Ag0L Au08 Ag0O 109.66(5) . . ?
P011 Au08 Au02 177.06(18) . . ?
P011 Au08 Au04 120.41(16) . . ?
P011 Au08 Au0A 122.44(17) . . ?
P011 Au08 Ag0D 122.20(18) . . ?
P011 Au08 Ag0L 123.83(17) . . ?
P011 Au08 Ag0O 118.54(18) . . ?
Au01 Au09 Au05 56.51(3) . . ?
Au01 Au09 Au07 56.57(3) . . ?
Au01 Au09 Ag0G 58.56(4) . . ?
Au01 Au09 Ag0K 57.73(4) . . ?
Au01 Au09 Ag0P 58.74(4) . . ?
Au05 Au09 Au07 105.77(3) . . ?
Au05 Au09 Ag0K 105.54(4) . . ?
Au07 Au09 Ag0K 58.62(4) . . ?
Ag0G Au09 Au05 59.56(4) . . ?
Ag0G Au09 Au07 105.93(4) . . ?
Ag0G Au09 Ag0K 58.97(5) . . ?
Ag0P Au09 Au05 60.34(4) . . ?
Ag0P Au09 Au07 60.23(4) . . ?
Ag0P Au09 Ag0G 109.10(5) . . ?
Ag0P Au09 Ag0K 107.97(5) . . ?
P019 Au09 Au01 173.62(17) . . ?
P019 Au09 Au05 117.15(17) . . ?
P019 Au09 Au07 128.10(17) . . ?
P019 Au09 Ag0G 120.05(18) . . ?
P019 Au09 Ag0K 127.74(18) . . ?
P019 Au09 Ag0P 118.47(18) . . ?
Au02 Au0A Au06 56.89(3) . . ?
Au02 Au0A Au08 56.49(3) . . ?
Au02 Au0A Ag0J 58.74(4) . . ?
Au02 Au0A Ag0L 57.81(4) . . ?
Au02 Au0A Ag0O 58.35(4) . . ?
Au06 Au0A Au08 105.89(3) . . ?
Au06 Au0A Ag0L 105.94(4) . . ?
Au06 Au0A Ag0O 60.04(4) . . ?
Au08 Au0A Ag0L 58.88(4) . . ?
Au08 Au0A Ag0O 60.05(4) . . ?
Ag0J Au0A Au06 59.84(4) . . ?
Ag0J Au0A Au08 106.12(5) . . ?
Ag0J Au0A Ag0L 58.99(5) . . ?
Ag0J Au0A Ag0O 108.82(5) . . ?
Ag0O Au0A Ag0L 107.85(5) . . ?
P018 Au0A Au02 172.89(17) . . ?
P018 Au0A Au06 116.06(17) . . ?
P018 Au0A Au08 128.61(17) . . ?
P018 Au0A Ag0J 119.78(19) . . ?
P018 Au0A Ag0L 128.32(18) . . ?
P018 Au0A Ag0O 118.4(2) . . ?
Au01 Ag0B Au02 177.68(6) . . ?
Au01 Ag0B Ag0C 60.47(4) . . ?
Au01 Ag0B Ag0D 120.56(6) . . ?
Au01 Ag0B Ag0E 59.15(5) . . ?
Au01 Ag0B Ag0F 121.39(6) . . ?
Au01 Ag0B Ag0G 57.94(4) . . ?
Au01 Ag0B Ag0H 121.28(6) . . ?
Au01 Ag0B Ag0I 60.55(4) . . ?
Au01 Ag0B Ag0J 121.18(6) . . ?
Au01 Ag0B Ag0K 57.47(4) . . ?
Au01 Ag0B Ag0L 120.38(6) . . ?
Au02 Ag0B Ag0C 121.14(6) . . ?
Au02 Ag0B Ag0D 59.01(5) . . ?
Au02 Ag0B Ag0E 119.77(6) . . ?
Au02 Ag0B Ag0F 60.65(5) . . ?
Au02 Ag0B Ag0G 121.71(6) . . ?
Au02 Ag0B Ag0H 60.41(4) . . ?
Au02 Ag0B Ag0I 121.54(6) . . ?
Au02 Ag0B Ag0J 57.80(5) . . ?
Au02 Ag0B Ag0K 120.25(6) . . ?
Au02 Ag0B Ag0L 57.32(4) . . ?
Ag0C Ag0B Ag0G 109.16(6) . . ?
Ag0C Ag0B Ag0H 60.83(5) . . ?
Ag0C Ag0B Ag0I 60.25(5) . . ?
Ag0C Ag0B Ag0J 91.14(6) . . ?
Ag0C Ag0B Ag0K 109.50(6) . . ?
Ag0C Ag0B Ag0L 147.27(7) . . ?
Ag0D Ag0B Ag0C 151.20(6) . . ?
Ag0D Ag0B Ag0E 146.83(6) . . ?
Ag0D Ag0B Ag0F 61.52(5) . . ?
Ag0D Ag0B Ag0G 62.70(5) . . ?
Ag0D Ag0B Ag0H 109.76(6) . . ?
Ag0D Ag0B Ag0I 94.08(6) . . ?
Ag0D Ag0B Ag0J 108.40(6) . . ?
Ag0D Ag0B Ag0K 90.52(6) . . ?
Ag0D Ag0B Ag0L 60.32(5) . . ?
Ag0E Ag0B Ag0C 61.20(5) . . ?
Ag0E Ag0B Ag0F 150.62(6) . . ?
Ag0E Ag0B Ag0G 108.79(6) . . ?
Ag0E Ag0B Ag0H 93.59(6) . . ?
Ag0E Ag0B Ag0I 109.96(6) . . ?
Ag0E Ag0B Ag0J 62.04(5) . . ?
Ag0E Ag0B Ag0K 60.49(5) . . ?
Ag0E Ag0B Ag0L 90.29(6) . . ?
Ag0F Ag0B Ag0C 92.55(6) . . ?
Ag0F Ag0B Ag0G 91.46(6) . . ?
Ag0F Ag0B Ag0H 59.99(5) . . ?
Ag0F Ag0B Ag0I 60.91(5) . . ?
Ag0F Ag0B Ag0J 109.16(6) . . ?
Ag0F Ag0B Ag0K 147.82(7) . . ?
Ag0F Ag0B Ag0L 109.66(6) . . ?
Ag0G Ag0B Ag0H 147.28(6) . . ?
Ag0G Ag0B Ag0J 150.59(6) . . ?
Ag0G Ag0B Ag0K 59.73(5) . . ?
Ag0G Ag0B Ag0L 94.43(6) . . ?
Ag0H Ag0B Ag0K 151.62(7) . . ?
Ag0H Ag0B Ag0L 109.41(6) . . ?
Ag0I Ag0B Ag0G 61.26(5) . . ?
Ag0I Ag0B Ag0H 89.13(6) . . ?
Ag0I Ag0B Ag0J 147.31(6) . . ?
Ag0I Ag0B Ag0K 109.62(6) . . ?
Ag0I Ag0B Ag0L 151.92(7) . . ?
Ag0J Ag0B Ag0H 61.40(5) . . ?
Ag0J Ag0B Ag0K 93.97(6) . . ?
Ag0J Ag0B Ag0L 59.45(5) . . ?
Ag0K Ag0B Ag0L 62.97(6) . . ?
Au01 Ag0C Au03 56.71(4) . . ?
Au01 Ag0C Ag0B 58.38(4) . . ?
Au01 Ag0C Ag0E 57.80(4) . . ?
Au01 Ag0C Ag0H 118.65(6) . . ?
Au01 Ag0C Ag0I 59.96(4) . . ?
Au01 Ag0C Ag0M 59.00(4) . . ?
Au03 Ag0C Ag0B 106.74(5) . . ?
Au03 Ag0C Ag0E 59.96(5) . . ?
Au03 Ag0C Ag0H 150.35(6) . . ?
Au03 Ag0C Ag0I 108.18(6) . . ?
Au03 Ag0C Ag0M 58.70(5) . . ?
Ag0B Ag0C Ag0E 59.15(5) . . ?
Ag0B Ag0C Ag0H 60.29(5) . . ?
Ag0B Ag0C Ag0I 60.50(5) . . ?
Ag0B Ag0C Ag0M 109.28(6) . . ?
Ag0E Ag0C Ag0H 92.05(6) . . ?
Ag0E Ag0C Ag0M 108.02(6) . . ?
Ag0H Ag0C Ag0M 148.49(7) . . ?
Ag0I Ag0C Ag0E 108.52(6) . . ?
Ag0I Ag0C Ag0H 88.97(6) . . ?
Ag0I Ag0C Ag0M 62.04(6) . . ?
S00S Ag0C Au01 142.47(12) . . ?
S00S Ag0C Au03 109.65(14) . . ?
S00S Ag0C Ag0B 101.43(13) . . ?
S00S Ag0C Ag0E 84.83(12) . . ?
S00S Ag0C Ag0H 53.84(13) . . ?
S00S Ag0C Ag0I 141.52(15) . . ?
S00S Ag0C Ag0M 149.12(14) . . ?
S00S Ag0C Cl 113.34(17) . . ?
Cl Ag0C Au01 104.09(13) . . ?
Cl Ag0C Au03 110.46(14) . . ?
Cl Ag0C Ag0B 114.69(13) . . ?
Cl Ag0C Ag0E 161.82(14) . . ?
Cl Ag0C Ag0H 99.13(14) . . ?
Cl Ag0C Ag0I 57.79(12) . . ?
Cl Ag0C Ag0M 56.10(13) . . ?
Au02 Ag0D Au04 57.07(4) . . ?
Au02 Ag0D Au08 55.99(4) . . ?
Au02 Ag0D Ag0B 59.58(4) . . ?
Au02 Ag0D Ag0F 60.14(4) . . ?
Au02 Ag0D Ag0G 119.17(6) . . ?
Au02 Ag0D Ag0L 57.79(5) . . ?
Au04 Ag0D Au08 59.88(4) . . ?
Au04 Ag0D Ag0F 58.91(4) . . ?
Au04 Ag0D Ag0G 145.42(6) . . ?
Au04 Ag0D Ag0L 107.62(6) . . ?
Au08 Ag0D Ag0F 107.53(6) . . ?
Au08 Ag0D Ag0G 151.51(6) . . ?
Ag0B Ag0D Au04 106.38(5) . . ?
Ag0B Ag0D Au08 108.10(6) . . ?
Ag0B Ag0D Ag0F 59.53(5) . . ?
Ag0B Ag0D Ag0G 59.59(5) . . ?
Ag0B Ag0D Ag0L 61.20(5) . . ?
Ag0F Ag0D Ag0G 88.61(6) . . ?
Ag0L Ag0D Au08 59.83(5) . . ?
Ag0L Ag0D Ag0F 108.79(6) . . ?
Ag0L Ag0D Ag0G 93.10(6) . . ?
S00T Ag0D Au02 171.91(16) . . ?
S00T Ag0D Au04 128.60(15) . . ?
S00T Ag0D Au08 130.90(14) . . ?
S00T Ag0D Ag0B 112.35(15) . . ?
S00T Ag0D Ag0F 116.36(13) . . ?
S00T Ag0D Ag0G 52.76(15) . . ?
S00T Ag0D Ag0L 120.05(14) . . ?
Au01 Ag0E Au03 57.07(4) . . ?
Au01 Ag0E Au07 56.22(4) . . ?
Au01 Ag0E Ag0B 59.27(4) . . ?
Au01 Ag0E Ag0C 59.97(4) . . ?
Au01 Ag0E Ag0J 119.17(6) . . ?
Au01 Ag0E Ag0K 57.63(5) . . ?
Au03 Ag0E Au07 59.89(4) . . ?
Au03 Ag0E Ag0C 58.98(5) . . ?
Au03 Ag0E Ag0J 145.98(6) . . ?
Au03 Ag0E Ag0K 107.35(6) . . ?
Au07 Ag0E Ag0C 107.61(6) . . ?
Au07 Ag0E Ag0J 151.03(7) . . ?
Au07 Ag0E Ag0K 59.68(5) . . ?
Ag0B Ag0E Au03 106.36(6) . . ?
Ag0B Ag0E Au07 107.84(6) . . ?
Ag0B Ag0E Ag0C 59.65(5) . . ?
Ag0B Ag0E Ag0J 59.90(5) . . ?
Ag0B Ag0E Ag0K 60.86(5) . . ?
Ag0C Ag0E Ag0J 89.06(6) . . ?
Ag0K Ag0E Ag0C 108.57(6) . . ?
Ag0K Ag0E Ag0J 92.92(6) . . ?
S00W Ag0E Au01 172.16(16) . . ?
S00W Ag0E Au03 128.42(15) . . ?
S00W Ag0E Au07 130.48(14) . . ?
S00W Ag0E Ag0B 112.92(15) . . ?
S00W Ag0E Ag0C 116.60(13) . . ?
S00W Ag0E Ag0J 53.02(15) . . ?
S00W Ag0E Ag0K 120.35(14) . . ?
Au02 Ag0F Ag0B 58.50(4) . . ?
Au02 Ag0F Ag0D 57.48(4) . . ?
Au02 Ag0F Ag0H 59.98(4) . . ?
Au02 Ag0F Ag0I 118.69(6) . . ?
Au02 Ag0F Ag0N 58.96(5) . . ?
Au04 Ag0F Au02 56.43(4) . . ?
Au04 Ag0F Ag0B 106.41(5) . . ?
Au04 Ag0F Ag0D 59.53(5) . . ?
Au04 Ag0F Ag0H 108.04(6) . . ?
Au04 Ag0F Ag0I 149.99(6) . . ?
Au04 Ag0F Ag0N 59.03(5) . . ?
Ag0B Ag0F Ag0D 58.95(5) . . ?
Ag0B Ag0F Ag0H 60.77(5) . . ?
Ag0B Ag0F Ag0I 60.22(5) . . ?
Ag0B Ag0F Ag0N 109.29(6) . . ?
Ag0D Ag0F Ag0I 92.13(6) . . ?
Ag0D Ag0F Ag0N 107.84(6) . . ?
Ag0H Ag0F Ag0D 108.33(6) . . ?
Ag0H Ag0F Ag0I 89.17(6) . . ?
Ag0H Ag0F Ag0N 61.72(6) . . ?
Ag0I Ag0F Ag0N 148.40(7) . . ?
S00V Ag0F Au02 142.86(12) . . ?
S00V Ag0F Au04 109.88(14) . . ?
S00V Ag0F Ag0B 101.53(13) . . ?
S00V Ag0F Ag0D 85.53(12) . . ?
S00V Ag0F Ag0H 141.48(15) . . ?
S00V Ag0F Ag0I 53.74(14) . . ?
S00V Ag0F Ag0N 149.07(14) . . ?
S00V Ag0F Cl1 113.16(17) . . ?
Cl1 Ag0F Au02 103.89(13) . . ?
Cl1 Ag0F Au04 110.29(14) . . ?
Cl1 Ag0F Ag0B 115.06(13) . . ?
Cl1 Ag0F Ag0D 161.28(14) . . ?
Cl1 Ag0F Ag0H 57.79(12) . . ?
Cl1 Ag0F Ag0I 99.66(14) . . ?
Cl1 Ag0F Ag0N 55.60(13) . . ?
Au01 Ag0G Au05 56.22(4) . . ?
Au01 Ag0G Au09 56.66(4) . . ?
Au01 Ag0G Ag0B 58.90(4) . . ?
Au01 Ag0G Ag0D 116.53(6) . . ?
Au01 Ag0G Ag0I 60.15(4) . . ?
Au01 Ag0G Ag0K 57.98(5) . . ?
Au05 Ag0G Au09 60.29(4) . . ?
Au05 Ag0G Ag0D 146.91(6) . . ?
Au05 Ag0G Ag0I 57.71(5) . . ?
Au09 Ag0G Ag0D 147.77(6) . . ?
Au09 Ag0G Ag0I 107.85(6) . . ?
Ag0B Ag0G Au05 104.57(5) . . ?
Ag0B Ag0G Au09 108.30(6) . . ?
Ag0B Ag0G Ag0D 57.71(5) . . ?
Ag0B Ag0G Ag0I 59.36(5) . . ?
Ag0I Ag0G Ag0D 90.00(6) . . ?
Ag0K Ag0G Au05 107.82(6) . . ?
Ag0K Ag0G Au09 61.18(5) . . ?
Ag0K Ag0G Ag0B 60.35(5) . . ?
Ag0K Ag0G Ag0D 88.04(6) . . ?
Ag0K Ag0G Ag0I 108.59(6) . . ?
S00T Ag0G Au01 168.22(15) . . ?
S00T Ag0G Au05 134.36(15) . . ?
S00T Ag0G Au09 130.37(13) . . ?
S00T Ag0G Ag0B 109.76(15) . . ?
S00T Ag0G Ag0D 52.05(14) . . ?
S00T Ag0G Ag0I 118.51(13) . . ?
S00T Ag0G Ag0K 114.92(14) . . ?
Au02 Ag0H Ag0B 57.85(4) . . ?
Au02 Ag0H Ag0C 116.64(6) . . ?
Au02 Ag0H Ag0F 59.53(4) . . ?
Au02 Ag0H Ag0J 56.32(4) . . ?
Au02 Ag0H Ag0N 58.27(4) . . ?
Au06 Ag0H Au02 56.13(4) . . ?
Au06 Ag0H Ag0B 106.75(5) . . ?
Au06 Ag0H Ag0C 147.32(6) . . ?
Au06 Ag0H Ag0F 106.81(6) . . ?
Au06 Ag0H Ag0J 60.12(5) . . ?
Au06 Ag0H Ag0N 58.84(5) . . ?
Ag0B Ag0H Ag0C 58.88(5) . . ?
Ag0B Ag0H Ag0J 59.29(5) . . ?
Ag0B Ag0H Ag0N 106.82(6) . . ?
Ag0C Ag0H Ag0J 88.80(6) . . ?
Ag0C Ag0H Ag0N 149.70(7) . . ?
Ag0F Ag0H Ag0B 59.23(5) . . ?
Ag0F Ag0H Ag0C 90.92(6) . . ?
Ag0F Ag0H Ag0J 106.88(6) . . ?
Ag0F Ag0H Ag0N 60.10(6) . . ?
Ag0J Ag0H Ag0N 107.00(6) . . ?
S00S Ag0H Au02 137.58(12) . . ?
S00S Ag0H Au06 107.19(13) . . ?
S00S Ag0H Ag0B 100.43(13) . . ?
S00S Ag0H Ag0C 54.02(13) . . ?
S00S Ag0H Ag0F 144.34(15) . . ?
S00S Ag0H Ag0J 81.33(12) . . ?
S00S Ag0H Ag0N 151.98(14) . . ?
S00S Ag0H Cl1 118.83(17) . . ?
Cl1 Ag0H Au02 103.57(13) . . ?
Cl1 Ag0H Au06 109.10(14) . . ?
Cl1 Ag0H Ag0B 113.65(13) . . ?
Cl1 Ag0H Ag0C 103.58(14) . . ?
Cl1 Ag0H Ag0F 57.82(12) . . ?
Cl1 Ag0H Ag0J 159.82(14) . . ?
Cl1 Ag0H Ag0N 55.03(13) . . ?
Au01 Ag0I Ag0B 57.72(4) . . ?
Au01 Ag0I Ag0C 59.19(4) . . ?
Au01 Ag0I Ag0F 116.53(6) . . ?
Au01 Ag0I Ag0G 56.46(4) . . ?
Au01 Ag0I Ag0M 58.04(4) . . ?
Au05 Ag0I Au01 55.90(4) . . ?
Au05 Ag0I Ag0B 106.56(5) . . ?
Au05 Ag0I Ag0C 106.09(6) . . ?
Au05 Ag0I Ag0F 148.04(6) . . ?
Au05 Ag0I Ag0G 60.23(5) . . ?
Au05 Ag0I Ag0M 58.27(5) . . ?
Ag0B Ag0I Ag0F 58.87(5) . . ?
Ag0B Ag0I Ag0G 59.38(5) . . ?
Ag0B Ag0I Ag0M 106.62(6) . . ?
Ag0C Ag0I Ag0B 59.24(5) . . ?
Ag0C Ag0I Ag0F 90.72(6) . . ?
Ag0C Ag0I Ag0G 106.86(6) . . ?
Ag0C Ag0I Ag0M 59.89(5) . . ?
Ag0F Ag0I Ag0G 89.19(6) . . ?
Ag0F Ag0I Ag0M 149.30(7) . . ?
Ag0G Ag0I Ag0M 106.78(6) . . ?
S00V Ag0I Au01 138.41(13) . . ?
S00V Ag0I Au05 108.55(14) . . ?
S00V Ag0I Ag0B 100.49(14) . . ?
S00V Ag0I Ag0C 143.84(15) . . ?
S00V Ag0I Ag0F 53.81(14) . . ?
S00V Ag0I Ag0G 82.08(12) . . ?
S00V Ag0I Ag0M 152.29(15) . . ?
S00V Ag0I Cl 118.32(17) . . ?
Cl Ag0I Au01 103.19(13) . . ?
Cl Ag0I Au05 108.97(14) . . ?
Cl Ag0I Ag0B 113.15(13) . . ?
Cl Ag0I Ag0C 57.40(12) . . ?
Cl Ag0I Ag0F 102.99(14) . . ?
Cl Ag0I Ag0G 159.60(14) . . ?
Cl Ag0I Ag0M 55.21(13) . . ?
Au02 Ag0J Au06 56.49(4) . . ?
Au02 Ag0J Au0A 56.79(4) . . ?
Au02 Ag0J Ag0B 59.06(4) . . ?
Au02 Ag0J Ag0E 117.06(6) . . ?
Au02 Ag0J Ag0H 60.05(4) . . ?
Au02 Ag0J Ag0L 58.11(5) . . ?
Au06 Ag0J Au0A 60.30(4) . . ?
Au06 Ag0J Ag0E 146.67(6) . . ?
Au06 Ag0J Ag0H 57.69(5) . . ?
Au0A Ag0J Ag0E 148.55(7) . . ?
Au0A Ag0J Ag0H 107.76(6) . . ?
Ag0B Ag0J Au06 104.85(6) . . ?
Ag0B Ag0J Au0A 108.68(6) . . ?
Ag0B Ag0J Ag0E 58.06(5) . . ?
Ag0B Ag0J Ag0H 59.31(5) . . ?
Ag0E Ag0J Ag0H 90.01(6) . . ?
Ag0L Ag0J Au06 108.17(6) . . ?
Ag0L Ag0J Au0A 61.40(5) . . ?
Ag0L Ag0J Ag0B 60.60(5) . . ?
Ag0L Ag0J Ag0E 88.67(6) . . ?
Ag0L Ag0J Ag0H 108.66(6) . . ?
S00W Ag0J Au02 169.64(16) . . ?
S00W Ag0J Au06 132.71(15) . . ?
S00W Ag0J Au0A 129.72(13) . . ?
S00W Ag0J Ag0B 110.91(15) . . ?
S00W Ag0J Ag0E 52.85(14) . . ?
S00W Ag0J Ag0H 118.57(13) . . ?
S00W Ag0J Ag0L 115.91(14) . . ?
Au01 Ag0K Au07 56.69(4) . . ?
Au01 Ag0K Au09 56.32(4) . . ?
Au01 Ag0K Ag0B 58.89(4) . . ?
Au01 Ag0K Ag0E 58.94(4) . . ?
Au01 Ag0K Ag0G 58.45(4) . . ?
Au01 Ag0K Ag0L 117.51(5) . . ?
Au07 Ag0K Au09 60.11(4) . . ?
Au07 Ag0K Ag0B 106.29(5) . . ?
Au07 Ag0K Ag0E 59.93(5) . . ?
Au07 Ag0K Ag0G 107.81(6) . . ?
Au07 Ag0K Ag0L 144.88(7) . . ?
Au09 Ag0K Ag0L 150.74(7) . . ?
Ag0B Ag0K Au09 106.91(5) . . ?
Ag0B Ag0K Ag0L 58.67(5) . . ?
Ag0E Ag0K Au09 107.80(6) . . ?
Ag0E Ag0K Ag0B 58.65(5) . . ?
Ag0E Ag0K Ag0L 86.84(6) . . ?
Ag0G Ag0K Au09 59.85(5) . . ?
Ag0G Ag0K Ag0B 59.91(5) . . ?
Ag0G Ag0K Ag0E 107.45(6) . . ?
Ag0G Ag0K Ag0L 91.93(6) . . ?
Cl00 Ag0K Au01 168.68(15) . . ?
Cl00 Ag0K Au07 130.08(14) . . ?
Cl00 Ag0K Au09 133.89(15) . . ?
Cl00 Ag0K Ag0B 110.01(14) . . ?
Cl00 Ag0K Ag0E 114.58(15) . . ?
Cl00 Ag0K Ag0G 119.63(15) . . ?
Cl00 Ag0K Ag0L 51.34(13) . . ?
Au02 Ag0L Au08 56.44(4) . . ?
Au02 Ag0L Au0A 56.27(4) . . ?
Au02 Ag0L Ag0B 58.95(4) . . ?
Au02 Ag0L Ag0D 58.88(4) . . ?
Au02 Ag0L Ag0J 58.49(4) . . ?
Au02 Ag0L Ag0K 117.28(6) . . ?
Au08 Ag0L Au0A 59.99(4) . . ?
Au08 Ag0L Ag0B 106.25(5) . . ?
Au08 Ag0L Ag0D 60.20(5) . . ?
Au08 Ag0L Ag0K 145.37(7) . . ?
Au0A Ag0L Ag0K 150.09(7) . . ?
Ag0B Ag0L Au0A 106.79(5) . . ?
Ag0B Ag0L Ag0K 58.37(5) . . ?
Ag0D Ag0L Au0A 107.90(6) . . ?
Ag0D Ag0L Ag0B 58.48(5) . . ?
Ag0D Ag0L Ag0K 86.87(6) . . ?
Ag0J Ag0L Au08 107.50(6) . . ?
Ag0J Ag0L Au0A 59.61(5) . . ?
Ag0J Ag0L Ag0B 59.96(5) . . ?
Ag0J Ag0L Ag0D 107.33(6) . . ?
Ag0J Ag0L Ag0K 91.49(6) . . ?
Cl00 Ag0L Au02 168.61(15) . . ?
Cl00 Ag0L Au08 130.64(14) . . ?
Cl00 Ag0L Au0A 133.84(15) . . ?
Cl00 Ag0L Ag0B 109.84(14) . . ?
Cl00 Ag0L Ag0D 114.79(15) . . ?
Cl00 Ag0L Ag0J 119.32(15) . . ?
Cl00 Ag0L Ag0K 51.47(13) . . ?
Au01 Ag0M Ag0C 58.68(4) . . ?
Au01 Ag0M Ag0I 58.46(4) . . ?
Au01 Ag0M Ag0P 56.94(5) . . ?
Au03 Ag0M Au01 56.66(4) . . ?
Au03 Ag0M Au05 106.71(5) . . ?
Au03 Ag0M Ag0C 58.86(5) . . ?
Au03 Ag0M Ag0I 105.14(6) . . ?
Au03 Ag0M Ag0P 60.81(5) . . ?
Au05 Ag0M Au01 55.84(4) . . ?
Au05 Ag0M Ag0C 104.13(6) . . ?
Au05 Ag0M Ag0I 57.65(5) . . ?
Au05 Ag0M Ag0P 61.05(5) . . ?
Ag0C Ag0M Ag0I 58.07(5) . . ?
Ag0P Ag0M Ag0C 107.85(6) . . ?
Ag0P Ag0M Ag0I 107.50(6) . . ?
Cl Ag0M Au01 104.63(13) . . ?
Cl Ag0M Au03 111.52(13) . . ?
Cl Ag0M Au05 109.62(14) . . ?
Cl Ag0M Ag0C 57.09(12) . . ?
Cl Ag0M Ag0I 56.54(12) . . ?
Cl Ag0M Ag0P 161.55(13) . . ?
S012 Ag0M Au01 144.10(18) . . ?
S012 Ag0M Au03 110.30(18) . . ?
S012 Ag0M Au05 107.35(18) . . ?
S012 Ag0M Ag0C 148.51(18) . . ?
S012 Ag0M Ag0I 144.39(18) . . ?
S012 Ag0M Ag0P 87.23(18) . . ?
S012 Ag0M Cl 111.2(2) . . ?
Au02 Ag0N Au06 55.99(4) . . ?
Au02 Ag0N Ag0F 59.02(4) . . ?
Au02 Ag0N Ag0H 58.77(4) . . ?
Au02 Ag0N Ag0O 57.16(5) . . ?
Au04 Ag0N Au02 56.36(4) . . ?
Au04 Ag0N Au06 106.66(5) . . ?
Au04 Ag0N Ag0F 58.73(5) . . ?
Au04 Ag0N Ag0H 104.99(6) . . ?
Au04 Ag0N Ag0O 61.06(5) . . ?
Au06 Ag0N Ag0F 104.52(6) . . ?
Au06 Ag0N Ag0H 57.91(5) . . ?
Au06 Ag0N Ag0O 61.10(5) . . ?
Ag0F Ag0N Ag0H 58.18(5) . . ?
Ag0O Ag0N Ag0F 108.40(6) . . ?
Ag0O Ag0N Ag0H 107.95(7) . . ?
Cl1 Ag0N Au02 105.64(12) . . ?
Cl1 Ag0N Au04 111.92(13) . . ?
Cl1 Ag0N Au06 110.07(13) . . ?
Cl1 Ag0N Ag0F 57.68(12) . . ?
Cl1 Ag0N Ag0H 57.04(12) . . ?
Cl1 Ag0N Ag0O 162.77(13) . . ?
S01A Ag0N Au02 144.84(18) . . ?
S01A Ag0N Au04 109.93(18) . . ?
S01A Ag0N Au06 108.69(19) . . ?
S01A Ag0N Ag0F 146.8(2) . . ?
S01A Ag0N Ag0H 145.03(18) . . ?
S01A Ag0N Ag0O 87.69(18) . . ?
S01A Ag0N Cl1 109.5(2) . . ?
Au02 Ag0O Au04 56.61(4) . . ?
Au02 Ag0O Au06 56.28(4) . . ?
Au02 Ag0O Au08 55.91(4) . . ?
Au02 Ag0O Au0A 56.54(4) . . ?
Au02 Ag0O Ag0N 60.61(5) . . ?
Au04 Ag0O Au06 103.17(6) . . ?
Au04 Ag0O Au08 58.90(4) . . ?
Au04 Ag0O Au0A 106.02(6) . . ?
Au06 Ag0O Au08 105.59(6) . . ?
Au06 Ag0O Au0A 59.80(4) . . ?
Au08 Ag0O Au0A 59.89(4) . . ?
Ag0N Ag0O Au04 58.67(5) . . ?
Ag0N Ag0O Au06 58.87(5) . . ?
Ag0N Ag0O Au08 107.26(7) . . ?
Ag0N Ag0O Au0A 108.42(7) . . ?
Cl3 Ag0O Au02 177.71(16) . . ?
Cl3 Ag0O Au04 123.01(19) . . ?
Cl3 Ag0O Au06 122.52(17) . . ?
Cl3 Ag0O Au08 126.13(15) . . ?
Cl3 Ag0O Au0A 124.99(18) . . ?
Cl3 Ag0O Ag0N 117.14(16) . . ?
Au01 Ag0P Au03 56.94(4) . . ?
Au01 Ag0P Au05 56.01(4) . . ?
Au01 Ag0P Au07 56.13(4) . . ?
Au01 Ag0P Au09 57.01(4) . . ?
Au01 Ag0P Ag0M 60.46(5) . . ?
Au03 Ag0P Au05 102.84(6) . . ?
Au03 Ag0P Au07 59.09(4) . . ?
Au07 Ag0P Au05 105.87(6) . . ?
Au09 Ag0P Au03 106.83(6) . . ?
Au09 Ag0P Au05 60.31(4) . . ?
Au09 Ag0P Au07 60.39(4) . . ?
Au09 Ag0P Ag0M 108.73(7) . . ?
Ag0M Ag0P Au03 58.40(5) . . ?
Ag0M Ag0P Au05 58.37(5) . . ?
Ag0M Ag0P Au07 107.13(7) . . ?
Cl2 Ag0P Au01 177.68(19) . . ?
Cl2 Ag0P Au03 124.79(18) . . ?
Cl2 Ag0P Au05 121.66(18) . . ?
Cl2 Ag0P Au07 125.85(17) . . ?
Cl2 Ag0P Au09 122.36(17) . . ?
Cl2 Ag0P Ag0M 118.68(17) . . ?
S012 Ag0Q Cl2 103.8(2) . . ?
P01B Ag0Q S012 141.3(3) . . ?
P01B Ag0Q Cl2 104.6(3) . . ?
S01A Ag0R Cl3 104.0(2) . . ?
P01C Ag0R Cl3 106.0(3) . . ?
P01C Ag0R S01A 143.6(3) . . ?
Ag0H S00S Ag0C 72.14(15) . . ?
C33 S00S Ag0C 105.4(5) . . ?
C33 S00S Ag0H 113.8(5) . . ?
Ag0D S00T Ag0G 75.19(16) . . ?
C27 S00T Ag0D 104.0(5) . . ?
C27 S00T Ag0G 111.4(5) . . ?
Ag0L Cl00 Ag0K 77.18(16) . . ?
Ag0I S00V Ag0F 72.45(15) . . ?
C1 S00V Ag0F 104.7(5) . . ?
C1 S00V Ag0I 114.9(5) . . ?
Ag0E S00W Ag0J 74.14(16) . . ?
C41 S00W Ag0E 103.8(5) . . ?
C41 S00W Ag0J 111.9(5) . . ?
Ag0H Cl1 Ag0F 64.39(11) . . ?
Ag0N Cl1 Ag0F 66.72(12) . . ?
Ag0N Cl1 Ag0H 67.93(13) . . ?
C21 P00Y Au04 110.3(6) . . ?
C21 P00Y C157 107.9(8) . . ?
C112 P00Y Au04 116.9(6) . . ?
C112 P00Y C21 102.6(8) . . ?
C112 P00Y C157 109.3(9) . . ?
C157 P00Y Au04 109.4(6) . . ?
Ag0C Cl Ag0I 64.81(11) . . ?
Ag0M Cl Ag0C 66.81(13) . . ?
Ag0M Cl Ag0I 68.24(13) . . ?
C30 P010 Au03 109.7(6) . . ?
C30 P010 C116 106.7(8) . . ?
C116 P010 Au03 111.0(6) . . ?
C140 P010 Au03 116.6(6) . . ?
C140 P010 C30 103.6(8) . . ?
C140 P010 C116 108.6(9) . . ?
C40 P011 Au08 114.4(6) . . ?
C40 P011 C85 104.5(7) . . ?
C85 P011 Au08 114.1(5) . . ?
C149 P011 Au08 112.2(6) . . ?
C149 P011 C40 105.4(8) . . ?
C149 P011 C85 105.3(9) . . ?
Ag0Q S012 Ag0M 125.6(3) . . ?
C70 S012 Ag0M 108.6(6) . . ?
C70 S012 Ag0Q 110.8(7) . . ?
C34 P013 Au06 112.2(6) . . ?
C34 P013 C45 108.8(9) . . ?
C34 P013 C86 102.2(8) . . ?
C45 P013 Au06 114.9(6) . . ?
C45 P013 C86 103.7(8) . . ?
C86 P013 Au06 114.0(6) . . ?
Ag0P Cl2 Ag0Q 100.5(2) . . ?
Ag0O Cl3 Ag0R 102.6(2) . . ?
C71 P016 Au07 114.2(6) . . ?
C99 P016 Au07 113.9(6) . . ?
C99 P016 C71 104.7(8) . . ?
C164 P016 Au07 111.5(7) . . ?
C164 P016 C71 106.3(8) . . ?
C164 P016 C99 105.4(9) . . ?
C43 P017 Au05 110.6(6) . . ?
C43 P017 C72 103.3(8) . . ?
C43 P017 C105 106.9(8) . . ?
C72 P017 Au05 113.8(6) . . ?
C72 P017 C105 105.1(8) . . ?
C105 P017 Au05 116.0(6) . . ?
C24 P018 Au0A 113.0(6) . . ?
C143 P018 Au0A 111.8(7) . . ?
C143 P018 C24 105.0(9) . . ?
C143 P018 C145 104.0(9) . . ?
C145 P018 Au0A 117.2(6) . . ?
C145 P018 C24 104.8(8) . . ?
C18 P019 Au09 112.6(6) . . ?
C84 P019 Au09 117.8(6) . . ?
C84 P019 C18 103.2(8) . . ?
C84 P019 C133 103.6(9) . . ?
C133 P019 Au09 112.9(7) . . ?
C133 P019 C18 105.5(10) . . ?
Ag0R S01A Ag0N 128.0(3) . . ?
C49 S01A Ag0N 110.4(6) . . ?
C49 S01A Ag0R 112.3(6) . . ?
C211 P01B Ag0Q 105.8(8) . . ?
C102 P01B Ag0Q 119.2(8) . . ?
C102 P01B C211 101.9(11) . . ?
C189 P01B Ag0Q 118.3(7) . . ?
C189 P01B C211 101.9(9) . . ?
C189 P01B C102 107.0(11) . . ?
C148 P01C Ag0R 118.2(9) . . ?
C148 P01C C295 107.0(12) . . ?
C231 P01C Ag0R 110.7(8) . . ?
C231 P01C C148 103.2(12) . . ?
C231 P01C C295 104.1(12) . . ?
C295 P01C Ag0R 112.4(9) . . ?
C26 C27 S00T 118.0(7) . . ?
C26 C27 C55 120.0 . . ?
C55 C27 S00T 122.0(7) . . ?
C27 C26 H26 120.0 . . ?
C109 C26 C27 120.0 . . ?
C109 C26 H26 120.0 . . ?
C26 C109 C48 120.0 . . ?
C26 C109 C139 119.6(12) . . ?
C48 C109 C139 120.4(12) . . ?
C109 C48 H48 120.0 . . ?
C64 C48 C109 120.0 . . ?
C64 C48 H48 120.0 . . ?
C48 C64 C55 120.0 . . ?
C48 C64 C77 118.5(13) . . ?
C55 C64 C77 121.5(13) . . ?
C27 C55 H55 120.0 . . ?
C64 C55 C27 120.0 . . ?
C64 C55 H55 120.0 . . ?
F1 C77 C64 115.0(19) . . ?
F1 C77 F9 105(2) . . ?
F1 C77 F10 104(2) . . ?
F9 C77 C64 116(2) . . ?
F9 C77 F10 104.0(19) . . ?
F10 C77 C64 112(2) . . ?
C12 C18 P019 115.9(8) . . ?
C12 C18 C103 120.0 . . ?
C103 C18 P019 123.9(8) . . ?
C18 C12 H12 120.0 . . ?
C22 C12 C18 120.0 . . ?
C22 C12 H12 120.0 . . ?
C12 C22 H22 120.0 . . ?
C12 C22 C161 120.0 . . ?
C161 C22 H22 120.0 . . ?
C22 C161 H161 120.0 . . ?
C93 C161 C22 120.0 . . ?
C93 C161 H161 120.0 . . ?
C161 C93 H93 120.0 . . ?
C161 C93 C103 120.0 . . ?
C103 C93 H93 120.0 . . ?
C18 C103 H103 120.0 . . ?
C93 C103 C18 120.0 . . ?
C93 C103 H103 120.0 . . ?
C92 C21 P00Y 118.0(8) . . ?
C92 C21 C129 120.0 . . ?
C129 C21 P00Y 121.9(8) . . ?
C21 C92 H92 120.0 . . ?
C65 C92 C21 120.0 . . ?
C65 C92 H92 120.0 . . ?
C92 C65 H65 120.0 . . ?
C92 C65 C124 120.0 . . ?
C124 C65 H65 120.0 . . ?
C65 C124 H124 120.0 . . ?
C166 C124 C65 120.0 . . ?
C166 C124 H124 120.0 . . ?
C124 C166 H166 120.0 . . ?
C124 C166 C129 120.0 . . ?
C129 C166 H166 120.0 . . ?
C21 C129 H129 120.0 . . ?
C166 C129 C21 120.0 . . ?
C166 C129 H129 120.0 . . ?
C110 C24 P018 121.2(9) . . ?
C110 C24 C17 120.0 . . ?
C17 C24 P018 118.7(9) . . ?
C24 C110 H110 120.0 . . ?
C24 C110 C170 120.0 . . ?
C170 C110 H110 120.0 . . ?
C110 C170 H170 120.0 . . ?
C165 C170 C110 120.0 . . ?
C165 C170 H170 120.0 . . ?
C170 C165 H165 120.0 . . ?
C3 C165 C170 120.0 . . ?
C3 C165 H165 120.0 . . ?
C165 C3 H3 120.0 . . ?
C165 C3 C17 120.0 . . ?
C17 C3 H3 120.0 . . ?
C24 C17 H17 120.0 . . ?
C3 C17 C24 120.0 . . ?
C3 C17 H17 120.0 . . ?
C59 C1 S00V 124.4(8) . . ?
C59 C1 C61 120.0 . . ?
C61 C1 S00V 115.6(8) . . ?
C1 C59 H59 120.0 . . ?
C53 C59 C1 120.0 . . ?
C53 C59 H59 120.0 . . ?
C59 C53 C51 120.0 . . ?
C59 C53 C135 119.5(14) . . ?
C51 C53 C135 120.5(14) . . ?
C53 C51 H51 120.0 . . ?
C53 C51 C74 120.0 . . ?
C74 C51 H51 120.0 . . ?
C51 C74 C61 120.0 . . ?
C51 C74 C198 117.5(15) . . ?
C61 C74 C198 122.1(15) . . ?
C1 C61 H61 120.0 . . ?
C74 C61 C1 120.0 . . ?
C74 C61 H61 120.0 . . ?
C187 C30 P010 122.6(9) . . ?
C187 C30 C67 120.0 . . ?
C67 C30 P010 117.4(9) . . ?
C30 C187 H187 120.0 . . ?
C203 C187 C30 120.0 . . ?
C203 C187 H187 120.0 . . ?
C187 C203 H203 120.0 . . ?
C187 C203 C153 120.0 . . ?
C153 C203 H203 120.0 . . ?
C203 C153 H153 120.0 . . ?
C89 C153 C203 120.0 . . ?
C89 C153 H153 120.0 . . ?
C153 C89 H89 120.0 . . ?
C67 C89 C153 120.0 . . ?
C67 C89 H89 120.0 . . ?
C30 C67 H67 120.0 . . ?
C89 C67 C30 120.0 . . ?
C89 C67 H67 120.0 . . ?
C31 C33 S00S 116.2(8) . . ?
C31 C33 C47 120.0 . . ?
C47 C33 S00S 123.8(8) . . ?
C33 C31 H31 120.0 . . ?
C33 C31 C82 120.0 . . ?
C82 C31 H31 120.0 . . ?
C31 C82 C25 120.0 . . ?
C31 C82 C181 119.8(11) . . ?
C25 C82 C181 120.2(11) . . ?
C82 C25 H25 120.0 . . ?
C58 C25 C82 120.0 . . ?
C58 C25 H25 120.0 . . ?
C25 C58 C47 120.0 . . ?
C25 C58 C113 121.8(14) . . ?
C47 C58 C113 118.2(14) . . ?
C33 C47 H47 120.0 . . ?
C58 C47 C33 120.0 . . ?
C58 C47 H47 120.0 . . ?
C42 C34 P013 117.5(10) . . ?
C42 C34 C117 120.0 . . ?
C117 C34 P013 122.5(10) . . ?
C34 C42 H42 120.0 . . ?
C81 C42 C34 120.0 . . ?
C81 C42 H42 120.0 . . ?
C42 C81 H81 120.0 . . ?
C75 C81 C42 120.0 . . ?
C75 C81 H81 120.0 . . ?
C81 C75 H75 120.0 . . ?
C81 C75 C168 120.0 . . ?
C168 C75 H75 120.0 . . ?
C75 C168 H168 120.0 . . ?
C75 C168 C117 120.0 . . ?
C117 C168 H168 120.0 . . ?
C34 C117 H117 120.0 . . ?
C168 C117 C34 120.0 . . ?
C168 C117 H117 120.0 . . ?
C76 C40 P011 122.8(8) . . ?
C76 C40 C57 120.0 . . ?
C57 C40 P011 117.2(8) . . ?
C40 C76 H76 120.0 . . ?
C96 C76 C40 120.0 . . ?
C96 C76 H76 120.0 . . ?
C76 C96 H96 120.0 . . ?
C76 C96 C88 120.0 . . ?
C88 C96 H96 120.0 . . ?
C96 C88 H88 120.0 . . ?
C96 C88 C134 120.0 . . ?
C134 C88 H88 120.0 . . ?
C88 C134 H134 120.0 . . ?
C88 C134 C57 120.0 . . ?
C57 C134 H134 120.0 . . ?
C40 C57 H57 120.0 . . ?
C134 C57 C40 120.0 . . ?
C134 C57 H57 120.0 . . ?
C6 C41 S00W 121.6(8) . . ?
C6 C41 C98 120.0 . . ?
C98 C41 S00W 118.4(8) . . ?
C41 C6 H6 120.0 . . ?
C41 C6 C60 120.0 . . ?
C60 C6 H6 120.0 . . ?
C6 C60 C101 121.3(14) . . ?
C91 C60 C6 120.0 . . ?
C91 C60 C101 118.7(14) . . ?
C60 C91 H91 120.0 . . ?
C52 C91 C60 120.0 . . ?
C52 C91 H91 120.0 . . ?
C91 C52 C98 120.0 . . ?
C91 C52 C4 120.4(15) . . ?
C98 C52 C4 119.6(15) . . ?
C41 C98 H98 120.0 . . ?
C52 C98 C41 120.0 . . ?
C52 C98 H98 120.0 . . ?
C37 C43 P017 117.7(9) . . ?
C37 C43 C122 120.0 . . ?
C122 C43 P017 122.3(9) . . ?
C43 C37 H37 120.0 . . ?
C43 C37 C63 120.0 . . ?
C63 C37 H37 120.0 . . ?
C37 C63 H63 120.0 . . ?
C20 C63 C37 120.0 . . ?
C20 C63 H63 120.0 . . ?
C63 C20 H20 120.0 . . ?
C16 C20 C63 120.0 . . ?
C16 C20 H20 120.0 . . ?
C20 C16 H16 120.0 . . ?
C20 C16 C122 120.0 . . ?
C122 C16 H16 120.0 . . ?
C43 C122 H122 120.0 . . ?
C16 C122 C43 120.0 . . ?
C16 C122 H122 120.0 . . ?
C87 C45 P013 121.9(9) . . ?
C87 C45 C172 120.0 . . ?
C172 C45 P013 117.9(9) . . ?
C45 C87 H87 120.0 . . ?
C45 C87 C185 120.0 . . ?
C185 C87 H87 120.0 . . ?
C87 C185 H185 120.0 . . ?
C186 C185 C87 120.0 . . ?
C186 C185 H185 120.0 . . ?
C185 C186 H186 120.0 . . ?
C185 C186 C246 120.0 . . ?
C246 C186 H186 120.0 . . ?
C186 C246 H246 120.0 . . ?
C186 C246 C172 120.0 . . ?
C172 C246 H246 120.0 . . ?
C45 C172 H172 120.0 . . ?
C246 C172 C45 120.0 . . ?
C246 C172 H172 120.0 . . ?
C107 C49 S01A 121.1(9) . . ?
C107 C49 C66 120.0 . . ?
C66 C49 S01A 118.9(9) . . ?
C49 C107 H107 120.0 . . ?
C125 C107 C49 120.0 . . ?
C125 C107 H107 120.0 . . ?
C107 C125 C2 120.0 . . ?
C107 C125 C32 118.6(17) . . ?
C2 C125 C32 121.2(17) . . ?
C125 C2 H2 120.0 . . ?
C46 C2 C125 120.0 . . ?
C46 C2 H2 120.0 . . ?
C2 C46 C66 120.0 . . ?
C2 C46 C8 120.1(13) . . ?
C66 C46 C8 119.9(13) . . ?
C49 C66 H66 120.0 . . ?
C46 C66 C49 120.0 . . ?
C46 C66 H66 120.0 . . ?
C120 C70 S012 117.8(10) . . ?
C120 C70 C126 120.0 . . ?
C126 C70 S012 122.2(10) . . ?
C70 C120 H120 120.0 . . ?
C115 C120 C70 120.0 . . ?
C115 C120 H120 120.0 . . ?
C120 C115 C90 120.0 . . ?
C120 C115 C191 116.9(15) . . ?
C90 C115 C191 122.9(16) . . ?
C115 C90 H90 120.0 . . ?
C115 C90 C179 120.0 . . ?
C179 C90 H90 120.0 . . ?
C90 C179 C254 117(2) . . ?
C126 C179 C90 120.0 . . ?
C126 C179 C254 122(2) . . ?
C70 C126 H126 120.0 . . ?
C179 C126 C70 120.0 . . ?
C179 C126 H126 120.0 . . ?
C56 C71 P016 117.2(9) . . ?
C56 C71 C131 120.0 . . ?
C131 C71 P016 122.6(9) . . ?
C71 C56 H56 120.0 . . ?
C142 C56 C71 120.0 . . ?
C142 C56 H56 120.0 . . ?
C56 C142 H142 120.0 . . ?
C56 C142 C136 120.0 . . ?
C136 C142 H142 120.0 . . ?
C142 C136 H136 120.0 . . ?
C141 C136 C142 120.0 . . ?
C141 C136 H136 120.0 . . ?
C136 C141 H141 120.0 . . ?
C131 C141 C136 120.0 . . ?
C131 C141 H141 120.0 . . ?
C71 C131 H131 120.0 . . ?
C141 C131 C71 120.0 . . ?
C141 C131 H131 120.0 . . ?
C62 C72 P017 117.5(9) . . ?
C62 C72 C173 120.0 . . ?
C173 C72 P017 122.5(9) . . ?
C72 C62 H62 120.0 . . ?
C94 C62 C72 120.0 . . ?
C94 C62 H62 120.0 . . ?
C62 C94 H94 120.0 . . ?
C144 C94 C62 120.0 . . ?
C144 C94 H94 120.0 . . ?
C94 C144 H144 120.0 . . ?
C230 C144 C94 120.0 . . ?
C230 C144 H144 120.0 . . ?
C144 C230 H230 120.0 . . ?
C144 C230 C173 120.0 . . ?
C173 C230 H230 120.0 . . ?
C72 C173 H173 120.0 . . ?
C230 C173 C72 120.0 . . ?
C230 C173 H173 120.0 . . ?
C111 C84 P019 120.3(9) . . ?
C111 C84 C118 120.0 . . ?
C118 C84 P019 119.7(9) . . ?
C84 C111 H111 120.0 . . ?
C221 C111 C84 120.0 . . ?
C221 C111 H111 120.0 . . ?
C111 C221 H221 120.0 . . ?
C111 C221 C192 120.0 . . ?
C192 C221 H221 120.0 . . ?
C221 C192 H192 120.0 . . ?
C169 C192 C221 120.0 . . ?
C169 C192 H192 120.0 . . ?
C192 C169 H169 120.0 . . ?
C192 C169 C118 120.0 . . ?
C118 C169 H169 120.0 . . ?
C84 C118 H118 120.0 . . ?
C169 C118 C84 120.0 . . ?
C169 C118 H118 120.0 . . ?
C106 C85 P011 119.9(9) . . ?
C106 C85 C104 120.0 . . ?
C104 C85 P011 120.0(9) . . ?
C85 C106 H106 120.0 . . ?
C155 C106 C85 120.0 . . ?
C155 C106 H106 120.0 . . ?
C106 C155 H155 120.0 . . ?
C106 C155 C193 120.0 . . ?
C193 C155 H155 120.0 . . ?
C155 C193 H193 120.0 . . ?
C160 C193 C155 120.0 . . ?
C160 C193 H193 120.0 . . ?
C193 C160 H160 120.0 . . ?
C104 C160 C193 120.0 . . ?
C104 C160 H160 120.0 . . ?
C85 C104 H104 120.0 . . ?
C160 C104 C85 120.0 . . ?
C160 C104 H104 120.0 . . ?
C119 C86 P013 123.5(8) . . ?
C119 C86 C54 120.0 . . ?
C54 C86 P013 116.5(8) . . ?
C86 C119 H119 120.0 . . ?
C279 C119 C86 120.0 . . ?
C279 C119 H119 120.0 . . ?
C119 C279 H279 120.0 . . ?
C128 C279 C119 120.0 . . ?
C128 C279 H279 120.0 . . ?
C279 C128 H128 120.0 . . ?
C279 C128 C108 120.0 . . ?
C108 C128 H128 120.0 . . ?
C128 C108 H108 120.0 . . ?
C128 C108 C54 120.0 . . ?
C54 C108 H108 120.0 . . ?
C86 C54 H54 120.0 . . ?
C108 C54 C86 120.0 . . ?
C108 C54 H54 120.0 . . ?
C196 C99 P016 121.3(10) . . ?
C196 C99 C130 120.0 . . ?
C130 C99 P016 118.5(10) . . ?
C99 C196 H196 120.0 . . ?
C252 C196 C99 120.0 . . ?
C252 C196 H196 120.0 . . ?
C196 C252 H252 120.0 . . ?
C196 C252 C171 120.0 . . ?
C171 C252 H252 120.0 . . ?
C252 C171 H171 120.0 . . ?
C162 C171 C252 120.0 . . ?
C162 C171 H171 120.0 . . ?
C171 C162 H162 120.0 . . ?
C171 C162 C130 120.0 . . ?
C130 C162 H162 120.0 . . ?
C99 C130 H130 120.0 . . ?
C162 C130 C99 120.0 . . ?
C162 C130 H130 120.0 . . ?
F7 C101 F13 106(3) . . ?
F7 C101 F29 108(3) . . ?
F7 C101 C60 113(2) . . ?
F13 C101 C60 110(2) . . ?
F29 C101 F13 106(2) . . ?
F29 C101 C60 113(2) . . ?
C95 C105 P017 116.9(9) . . ?
C95 C105 C167 120.0 . . ?
C167 C105 P017 123.1(9) . . ?
C105 C95 H95 120.0 . . ?
C105 C95 C282 120.0 . . ?
C282 C95 H95 120.0 . . ?
C95 C282 H282 120.0 . . ?
C195 C282 C95 120.0 . . ?
C195 C282 H282 120.0 . . ?
C282 C195 H195 120.0 . . ?
C282 C195 C201 120.0 . . ?
C201 C195 H195 120.0 . . ?
C195 C201 H201 120.0 . . ?
C167 C201 C195 120.0 . . ?
C167 C201 H201 120.0 . . ?
C105 C167 H167 120.0 . . ?
C201 C167 C105 120.0 . . ?
C201 C167 H167 120.0 . . ?
C158 C112 P00Y 120.9(10) . . ?
C158 C112 C19 120.0 . . ?
C19 C112 P00Y 119.1(10) . . ?
C112 C158 H158 120.0 . . ?
C112 C158 C218 120.0 . . ?
C218 C158 H158 120.0 . . ?
C158 C218 H218 120.0 . . ?
C207 C218 C158 120.0 . . ?
C207 C218 H218 120.0 . . ?
C218 C207 H207 120.0 . . ?
C218 C207 C68 120.0 . . ?
C68 C207 H207 120.0 . . ?
C207 C68 H68 120.0 . . ?
C207 C68 C19 120.0 . . ?
C19 C68 H68 120.0 . . ?
C112 C19 H19 120.0 . . ?
C68 C19 C112 120.0 . . ?
C68 C19 H19 120.0 . . ?
F6 C113 C58 117(2) . . ?
F6 C113 F35 111(3) . . ?
F6 C113 F44 105(3) . . ?
F35 C113 C58 113(2) . . ?
F35 C113 F44 99(2) . . ?
F44 C113 C58 110(2) . . ?
C132 C116 P010 116.1(11) . . ?
C132 C116 C184 120.0 . . ?
C184 C116 P010 123.8(11) . . ?
C116 C132 H132 120.0 . . ?
C116 C132 C188 120.0 . . ?
C188 C132 H132 120.0 . . ?
C132 C188 H188 120.0 . . ?
C132 C188 C217 120.0 . . ?
C217 C188 H188 120.0 . . ?
C188 C217 H217 120.0 . . ?
C256 C217 C188 120.0 . . ?
C256 C217 H217 120.0 . . ?
C217 C256 H256 120.0 . . ?
C217 C256 C184 120.0 . . ?
C184 C256 H256 120.0 . . ?
C116 C184 H184 120.0 . . ?
C256 C184 C116 120.0 . . ?
C256 C184 H184 120.0 . . ?
C209 C133 P019 124.3(13) . . ?
C209 C133 C205 120.0 . . ?
C205 C133 P019 115.5(13) . . ?
C133 C209 H209 120.0 . . ?
C133 C209 C180 120.0 . . ?
C180 C209 H209 120.0 . . ?
C209 C180 H180 120.0 . . ?
C335 C180 C209 120.0 . . ?
C335 C180 H180 120.0 . . ?
C180 C335 H335 120.0 . . ?
C180 C335 C280 120.0 . . ?
C280 C335 H335 120.0 . . ?
C335 C280 H280 120.0 . . ?
C335 C280 C205 120.0 . . ?
C205 C280 H280 120.0 . . ?
C133 C205 H205 120.0 . . ?
C280 C205 C133 120.0 . . ?
C280 C205 H205 120.0 . . ?
F3 C135 F20 107(2) . . ?
F3 C135 F23 103(2) . . ?
F3 C135 C53 116.9(19) . . ?
F20 C135 F23 102(2) . . ?
F20 C135 C53 115(2) . . ?
F23 C135 C53 112(2) . . ?
F4 C139 C109 112(2) . . ?
F4 C139 F2 105.7(19) . . ?
F2 C139 C109 108(2) . . ?
F38 C139 C109 114.0(18) . . ?
F38 C139 F4 108(2) . . ?
F38 C139 F2 108(2) . . ?
C235 C140 P010 122.1(10) . . ?
C235 C140 C79 120.0 . . ?
C79 C140 P010 117.9(10) . . ?
C140 C235 H235 120.0 . . ?
C200 C235 C140 120.0 . . ?
C200 C235 H235 120.0 . . ?
C235 C200 H200 120.0 . . ?
C235 C200 C219 120.0 . . ?
C219 C200 H200 120.0 . . ?
C200 C219 H219 120.0 . . ?
C97 C219 C200 120.0 . . ?
C97 C219 H219 120.0 . . ?
C219 C97 H97 120.0 . . ?
C79 C97 C219 120.0 . . ?
C79 C97 H97 120.0 . . ?
C140 C79 H79 120.0 . . ?
C97 C79 C140 120.0 . . ?
C97 C79 H79 120.0 . . ?
C199 C143 P018 122.8(12) . . ?
C199 C143 C234 120.0 . . ?
C234 C143 P018 117.1(12) . . ?
C143 C199 H199 120.0 . . ?
C143 C199 C232 120.0 . . ?
C232 C199 H199 120.0 . . ?
C199 C232 H232 120.0 . . ?
C199 C232 C316 120.0 . . ?
C316 C232 H232 120.0 . . ?
C232 C316 H316 120.0 . . ?
C268 C316 C232 120.0 . . ?
C268 C316 H316 120.0 . . ?
C316 C268 H268 120.0 . . ?
C234 C268 C316 120.0 . . ?
C234 C268 H268 120.0 . . ?
C143 C234 H234 120.0 . . ?
C268 C234 C143 120.0 . . ?
C268 C234 H234 120.0 . . ?
C123 C145 P018 119.0(10) . . ?
C123 C145 C177 120.0 . . ?
C177 C145 P018 120.9(10) . . ?
C145 C123 H123 120.0 . . ?
C121 C123 C145 120.0 . . ?
C121 C123 H123 120.0 . . ?
C123 C121 H121 120.0 . . ?
C123 C121 C182 120.0 . . ?
C182 C121 H121 120.0 . . ?
C121 C182 H182 120.0 . . ?
C121 C182 C249 120.0 . . ?
C249 C182 H182 120.0 . . ?
C182 C249 H249 120.0 . . ?
C182 C249 C177 120.0 . . ?
C177 C249 H249 120.0 . . ?
C145 C177 H177 120.0 . . ?
C249 C177 C145 120.0 . . ?
C249 C177 H177 120.0 . . ?
C213 C148 P01C 116.3(13) . . ?
C213 C148 C290 120.0 . . ?
C290 C148 P01C 123.2(13) . . ?
C148 C213 H213 120.0 . . ?
C148 C213 C194 120.0 . . ?
C194 C213 H213 120.0 . . ?
C213 C194 H194 120.0 . . ?
C283 C194 C213 120.0 . . ?
C283 C194 H194 120.0 . . ?
C194 C283 H283 120.0 . . ?
C194 C283 C5 120.0 . . ?
C5 C283 H283 120.0 . . ?
C283 C5 H5 120.0 . . ?
C283 C5 C290 120.0 . . ?
C290 C5 H5 120.0 . . ?
C148 C290 H290 120.0 . . ?
C5 C290 C148 120.0 . . ?
C5 C290 H290 120.0 . . ?
C226 C149 P011 116.6(10) . . ?
C226 C149 C159 120.0 . . ?
C159 C149 P011 123.3(10) . . ?
C149 C226 H226 120.0 . . ?
C149 C226 C214 120.0 . . ?
C214 C226 H226 120.0 . . ?
C226 C214 H214 120.0 . . ?
C228 C214 C226 120.0 . . ?
C228 C214 H214 120.0 . . ?
C214 C228 H228 120.0 . . ?
C214 C228 C114 120.0 . . ?
C114 C228 H228 120.0 . . ?
C228 C114 H114 120.0 . . ?
C228 C114 C159 120.0 . . ?
C159 C114 H114 120.0 . . ?
C149 C159 H159 120.0 . . ?
C114 C159 C149 120.0 . . ?
C114 C159 H159 120.0 . . ?
C78 C157 P00Y 117.4(10) . . ?
C78 C157 C222 120.0 . . ?
C222 C157 P00Y 122.5(10) . . ?
C157 C78 H78 120.0 . . ?
C178 C78 C157 120.0 . . ?
C178 C78 H78 120.0 . . ?
C78 C178 H178 120.0 . . ?
C78 C178 C229 120.0 . . ?
C229 C178 H178 120.0 . . ?
C178 C229 H229 120.0 . . ?
C319 C229 C178 120.0 . . ?
C319 C229 H229 120.0 . . ?
C229 C319 H319 120.0 . . ?
C229 C319 C222 120.0 . . ?
C222 C319 H319 120.0 . . ?
C157 C222 H222 120.0 . . ?
C319 C222 C157 120.0 . . ?
C319 C222 H222 120.0 . . ?
C174 C164 P016 124.3(11) . . ?
C174 C164 C240 120.0 . . ?
C240 C164 P016 115.6(11) . . ?
C164 C174 H174 120.0 . . ?
C208 C174 C164 120.0 . . ?
C208 C174 H174 120.0 . . ?
C174 C208 H208 120.0 . . ?
C174 C208 C293 120.0 . . ?
C293 C208 H208 120.0 . . ?
C208 C293 H293 120.0 . . ?
C208 C293 C364 120.0 . . ?
C364 C293 H293 120.0 . . ?
C293 C364 H364 120.0 . . ?
C240 C364 C293 120.0 . . ?
C240 C364 H364 120.0 . . ?
C164 C240 H240 120.0 . . ?
C364 C240 C164 120.0 . . ?
C364 C240 H240 120.0 . . ?
F150 C181 C82 117.0(19) . . ?
F152 C181 C82 120(2) . . ?
F152 C181 F150 110(3) . . ?
F152 C181 F190 99(2) . . ?
F190 C181 C82 108(2) . . ?
F190 C181 F150 98(2) . . ?
F83 C181 C82 113(2) . . ?
F83 C181 F195 92(3) . . ?
F195 C181 C82 111(2) . . ?
F199 C181 C82 114(2) . . ?
F199 C181 F83 115(3) . . ?
F199 C181 F195 110(3) . . ?
F12 C191 F28 107(3) . . ?
F12 C191 F48 109(3) . . ?
F12 C191 C115 116(2) . . ?
F28 C191 C115 110(2) . . ?
F48 C191 F28 104(2) . . ?
F48 C191 C115 110(3) . . ?
F39 C198 C74 117(2) . . ?
F39 C198 F137 100(3) . . ?
F109 C198 C74 119(3) . . ?
F109 C198 F39 114(3) . . ?
F109 C198 F137 96(3) . . ?
F137 C198 C74 107(3) . . ?
C251 C211 P01B 128.1(14) . . ?
C251 C211 C264 120.0 . . ?
C264 C211 P01B 111.9(14) . . ?
C211 C251 H251 120.0 . . ?
C271 C251 C211 120.0 . . ?
C271 C251 H251 120.0 . . ?
C251 C271 H271 120.0 . . ?
C285 C271 C251 120.0 . . ?
C285 C271 H271 120.0 . . ?
C271 C285 H285 120.0 . . ?
C303 C285 C271 120.0 . . ?
C303 C285 H285 120.0 . . ?
C285 C303 H303 120.0 . . ?
C285 C303 C264 120.0 . . ?
C264 C303 H303 120.0 . . ?
C211 C264 H264 120.0 . . ?
C303 C264 C211 120.0 . . ?
C303 C264 H264 120.0 . . ?
C309 C231 P01C 121.8(15) . . ?
C309 C231 C13 120.0 . . ?
C13 C231 P01C 117.2(15) . . ?
C231 C309 H309 120.0 . . ?
C244 C309 C231 120.0 . . ?
C244 C309 H309 120.0 . . ?
C309 C244 H244 120.0 . . ?
C309 C244 C7 120.0 . . ?
C7 C244 H244 120.0 . . ?
C244 C7 H7 120.0 . . ?
C247 C7 C244 120.0 . . ?
C247 C7 H7 120.0 . . ?
C7 C247 H247 120.0 . . ?
C7 C247 C13 120.0 . . ?
C13 C247 H247 120.0 . . ?
C231 C13 H13 120.0 . . ?
C247 C13 C231 120.0 . . ?
C247 C13 H13 120.0 . . ?
F5 C254 C179 112(3) . . ?
F36 C254 F5 106(3) . . ?
F36 C254 F50 102(3) . . ?
F36 C254 C179 116(3) . . ?
F50 C254 F5 106(3) . . ?
F50 C254 C179 113(3) . . ?
C102 C261 H261 120.0 . . ?
C102 C261 C216 120.0 . . ?
C216 C261 H261 120.0 . . ?
C261 C102 P01B 117.7(13) . . ?
C261 C102 C245 120.0 . . ?
C245 C102 P01B 121.9(13) . . ?
C102 C245 H245 120.0 . . ?
C102 C245 C11 120.0 . . ?
C11 C245 H245 120.0 . . ?
C245 C11 H11 120.0 . . ?
C308 C11 C245 120.0 . . ?
C308 C11 H11 120.0 . . ?
C11 C308 H308 120.0 . . ?
C11 C308 C216 120.0 . . ?
C216 C308 H308 120.0 . . ?
C261 C216 H216 120.0 . . ?
C308 C216 C261 120.0 . . ?
C308 C216 H216 120.0 . . ?
C138 C295 P01C 122.3(15) . . ?
C138 C295 C322 120.0 . . ?
C322 C295 P01C 117.6(15) . . ?
C295 C138 H138 120.0 . . ?
C295 C138 C14 120.0 . . ?
C14 C138 H138 120.0 . . ?
C138 C14 H14 120.0 . . ?
C288 C14 C138 120.0 . . ?
C288 C14 H14 120.0 . . ?
C14 C288 H288 120.0 . . ?
C324 C288 C14 120.0 . . ?
C324 C288 H288 120.0 . . ?
C288 C324 H324 120.0 . . ?
C322 C324 C288 120.0 . . ?
C322 C324 H324 120.0 . . ?
C295 C322 H322 120.0 . . ?
C324 C322 C295 120.0 . . ?
C324 C322 H322 120.0 . . ?
F8 C32 C125 111(2) . . ?
F8 C32 F15 104(2) . . ?
F224 C32 F8 109(3) . . ?
F224 C32 C125 115(3) . . ?
F224 C32 F15 108(3) . . ?
F15 C32 C125 109(2) . . ?
F16 C4 C52 114(2) . . ?
F16 C4 F14 107(2) . . ?
F55 C4 F16 105(3) . . ?
F55 C4 C52 115(2) . . ?
F55 C4 F14 104(3) . . ?
F14 C4 C52 110(3) . . ?
F11 C8 C46 113.5(17) . . ?
F175 C8 F11 103(2) . . ?
F175 C8 C46 114.6(18) . . ?
F17 C8 F11 106(2) . . ?
F17 C8 C46 116.5(18) . . ?
F17 C8 F175 101(2) . . ?
C259 C9 H9 120.0 . . ?
C259 C9 C189 120.0 . . ?
C189 C9 H9 120.0 . . ?
C9 C259 H259 120.0 . . ?
C10 C259 C9 120.0 . . ?
C10 C259 H259 120.0 . . ?
C259 C10 H10 120.0 . . ?
C259 C10 C227 120.0 . . ?
C227 C10 H10 120.0 . . ?
C10 C227 H227 120.0 . . ?
C15 C227 C10 120.0 . . ?
C15 C227 H227 120.0 . . ?
C227 C15 H15 120.0 . . ?
C227 C15 C189 120.0 . . ?
C189 C15 H15 120.0 . . ?
C9 C189 P01B 121.0(12) . . ?
C15 C189 P01B 119.0(12) . . ?
C15 C189 C9 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
Au01 Au03 2.7102(11) . ?
Au01 Au05 2.6767(11) . ?
Au01 Au07 2.6798(11) . ?
Au01 Au09 2.7047(11) . ?
Au01 Ag0B 2.7910(16) . ?
Au01 Ag0C 2.8520(16) . ?
Au01 Ag0E 2.7875(17) . ?
Au01 Ag0G 2.7624(17) . ?
Au01 Ag0I 2.8746(16) . ?
Au01 Ag0K 2.7482(16) . ?
Au01 Ag0M 2.8618(16) . ?
Au01 Ag0P 2.757(2) . ?
Au02 Au04 2.6999(12) . ?
Au02 Au06 2.6897(11) . ?
Au02 Au08 2.6755(11) . ?
Au02 Au0A 2.7030(11) . ?
Au02 Ag0B 2.7995(16) . ?
Au02 Ag0D 2.7830(17) . ?
Au02 Ag0F 2.8621(17) . ?
Au02 Ag0H 2.8754(16) . ?
Au02 Ag0J 2.7617(18) . ?
Au02 Ag0L 2.7506(16) . ?
Au02 Ag0N 2.8603(16) . ?
Au02 Ag0O 2.758(2) . ?
Au03 Au07 2.8854(11) . ?
Au03 Ag0C 2.8544(18) . ?
Au03 Ag0E 2.8836(18) . ?
Au03 Ag0M 2.8495(17) . ?
Au03 Ag0P 2.921(2) . ?
Au03 P010 2.284(6) . ?
Au04 Au08 2.8842(11) . ?
Au04 Ag0D 2.8665(17) . ?
Au04 Ag0F 2.8481(18) . ?
Au04 Ag0N 2.8572(17) . ?
Au04 Ag0O 2.927(2) . ?
Au04 P00Y 2.298(6) . ?
Au05 Au09 2.9331(11) . ?
Au05 Ag0G 2.9115(19) . ?
Au05 Ag0I 2.8356(19) . ?
Au05 Ag0M 2.8548(18) . ?
Au05 Ag0P 2.934(2) . ?
Au05 P017 2.286(6) . ?
Au06 Au0A 2.9285(11) . ?
Au06 Ag0H 2.8414(19) . ?
Au06 Ag0J 2.9151(19) . ?
Au06 Ag0N 2.8700(18) . ?
Au06 Ag0O 2.935(2) . ?
Au06 P013 2.288(6) . ?
Au07 Au09 2.9344(13) . ?
Au07 Ag0E 2.8969(19) . ?
Au07 Ag0K 2.8898(19) . ?
Au07 Ag0P 2.9300(19) . ?
Au07 P016 2.290(6) . ?
Au08 Au0A 2.9342(13) . ?
Au08 Ag0D 2.9119(19) . ?
Au08 Ag0L 2.901(2) . ?
Au08 Ag0O 2.9390(18) . ?
Au08 P011 2.292(6) . ?
Au09 Ag0G 2.9291(19) . ?
Au09 Ag0K 2.968(2) . ?
Au09 Ag0P 2.9047(19) . ?
Au09 P019 2.312(6) . ?
Au0A Ag0J 2.9153(19) . ?
Au0A Ag0L 2.967(2) . ?
Au0A Ag0O 2.939(2) . ?
Au0A P018 2.305(6) . ?
Ag0B Ag0C 2.8707(19) . ?
Ag0B Ag0D 2.850(2) . ?
Ag0B Ag0E 2.856(2) . ?
Ag0B Ag0F 2.8676(19) . ?
Ag0B Ag0G 2.908(2) . ?
Ag0B Ag0H 2.9125(19) . ?
Ag0B Ag0I 2.908(2) . ?
Ag0B Ag0J 2.912(2) . ?
Ag0B Ag0K 2.9209(19) . ?
Ag0B Ag0L 2.930(2) . ?
Ag0C Ag0E 2.9150(19) . ?
Ag0C Ag0H 2.928(2) . ?
Ag0C Ag0I 2.900(2) . ?
Ag0C Ag0M 2.956(2) . ?
Ag0C S00S 2.489(5) . ?
Ag0C Cl 2.700(5) . ?
Ag0D Ag0F 2.9243(19) . ?
Ag0D Ag0G 2.996(2) . ?
Ag0D Ag0L 2.905(2) . ?
Ag0D S00T 2.444(6) . ?
Ag0E Ag0J 2.973(2) . ?
Ag0E Ag0K 2.910(2) . ?
Ag0E S00W 2.463(6) . ?
Ag0F Ag0H 2.890(2) . ?
Ag0F Ag0I 2.927(2) . ?
Ag0F Ag0N 2.948(2) . ?
Ag0F S00V 2.478(6) . ?
Ag0F Cl1 2.713(5) . ?
Ag0G Ag0I 2.9631(19) . ?
Ag0G Ag0K 2.903(2) . ?
Ag0G S00T 2.467(6) . ?
Ag0H Ag0J 2.9733(19) . ?
Ag0H Ag0N 2.995(2) . ?
Ag0H S00S 2.484(6) . ?
Ag0H Cl1 2.712(5) . ?
Ag0I Ag0M 3.019(2) . ?
Ag0I S00V 2.476(6) . ?
Ag0I Cl 2.712(5) . ?
Ag0J Ag0L 2.897(2) . ?
Ag0J S00W 2.469(6) . ?
Ag0K Ag0L 3.056(3) . ?
Ag0K Cl00 2.452(5) . ?
Ag0L Cl00 2.447(6) . ?
Ag0M Ag0P 2.920(2) . ?
Ag0M Cl 2.669(6) . ?
Ag0M S012 2.459(7) . ?
Ag0N Ag0O 2.905(2) . ?
Ag0N Cl1 2.648(6) . ?
Ag0N S01A 2.454(7) . ?
Ag0O Cl3 2.465(7) . ?
Ag0P Cl2 2.459(7) . ?
Ag0Q S012 2.452(8) . ?
Ag0Q Cl2 2.619(7) . ?
Ag0Q P01B 2.383(10) . ?
Ag0R Cl3 2.597(7) . ?
Ag0R S01A 2.400(8) . ?
Ag0R P01C 2.400(10) . ?
S00S C33 1.783(10) . ?
S00T C27 1.776(9) . ?
S00V C1 1.791(10) . ?
S00W C41 1.789(10) . ?
P00Y C21 1.798(10) . ?
P00Y C112 1.787(13) . ?
P00Y C157 1.809(14) . ?
P010 C30 1.814(11) . ?
P010 C116 1.827(14) . ?
P010 C140 1.809(13) . ?
P011 C40 1.824(11) . ?
P011 C85 1.840(13) . ?
P011 C149 1.799(15) . ?
S012 C70 1.754(12) . ?
P013 C34 1.808(13) . ?
P013 C45 1.824(14) . ?
P013 C86 1.848(11) . ?
P016 C71 1.845(12) . ?
P016 C99 1.807(14) . ?
P016 C164 1.783(16) . ?
P017 C43 1.802(12) . ?
P017 C72 1.832(11) . ?
P017 C105 1.839(14) . ?
P018 C24 1.837(14) . ?
P018 C143 1.792(15) . ?
P018 C145 1.799(12) . ?
P019 C18 1.848(13) . ?
P019 C84 1.799(12) . ?
P019 C133 1.815(15) . ?
S01A C49 1.756(12) . ?
P01B C211 1.82(2) . ?
P01B C102 1.812(16) . ?
P01B C189 1.804(17) . ?
P01C C148 1.81(2) . ?
P01C C231 1.760(17) . ?
P01C C295 1.84(2) . ?
C27 C26 1.3900 . ?
C27 C55 1.3900 . ?
C26 H26 0.9500 . ?
C26 C109 1.3900 . ?
C109 C48 1.3900 . ?
C109 C139 1.49(3) . ?
C48 H48 0.9500 . ?
C48 C64 1.3900 . ?
C64 C55 1.3900 . ?
C64 C77 1.46(3) . ?
C55 H55 0.9500 . ?
F1 C77 1.30(3) . ?
F9 C77 1.32(3) . ?
F10 C77 1.35(3) . ?
F6 C113 1.24(3) . ?
F4 C139 1.29(3) . ?
F3 C135 1.30(3) . ?
F5 C254 1.36(4) . ?
F7 C101 1.30(3) . ?
F12 C191 1.28(3) . ?
F8 C32 1.35(3) . ?
F2 C139 1.35(3) . ?
F11 C8 1.304(10) . ?
F13 C101 1.35(3) . ?
F16 C4 1.32(3) . ?
C18 C12 1.3900 . ?
C18 C103 1.3900 . ?
C12 H12 0.9500 . ?
C12 C22 1.3900 . ?
C22 H22 0.9500 . ?
C22 C161 1.3900 . ?
C161 H161 0.9500 . ?
C161 C93 1.3900 . ?
C93 H93 0.9500 . ?
C93 C103 1.3900 . ?
C103 H103 0.9500 . ?
F20 C135 1.30(3) . ?
C21 C92 1.3900 . ?
C21 C129 1.3900 . ?
C92 H92 0.9500 . ?
C92 C65 1.3900 . ?
C65 H65 0.9500 . ?
C65 C124 1.3900 . ?
C124 H124 0.9500 . ?
C124 C166 1.3900 . ?
C166 H166 0.9500 . ?
C166 C129 1.3900 . ?
C129 H129 0.9500 . ?
F23 C135 1.37(3) . ?
C24 C110 1.3900 . ?
C24 C17 1.3900 . ?
C110 H110 0.9500 . ?
C110 C170 1.3900 . ?
C170 H170 0.9500 . ?
C170 C165 1.3900 . ?
C165 H165 0.9500 . ?
C165 C3 1.3900 . ?
C3 H3 0.9500 . ?
C3 C17 1.3900 . ?
C17 H17 0.9500 . ?
C1 C59 1.3900 . ?
C1 C61 1.3900 . ?
C59 H59 0.9500 . ?
C59 C53 1.3900 . ?
C53 C51 1.3900 . ?
C53 C135 1.43(3) . ?
C51 H51 0.9500 . ?
C51 C74 1.3900 . ?
C74 C61 1.3900 . ?
C74 C198 1.48(3) . ?
C61 H61 0.9500 . ?
F28 C191 1.34(3) . ?
F29 C101 1.32(3) . ?
C30 C187 1.3900 . ?
C30 C67 1.3900 . ?
C187 H187 0.9500 . ?
C187 C203 1.3900 . ?
C203 H203 0.9500 . ?
C203 C153 1.3900 . ?
C153 H153 0.9500 . ?
C153 C89 1.3900 . ?
C89 H89 0.9500 . ?
C89 C67 1.3900 . ?
C67 H67 0.9500 . ?
C33 C31 1.3900 . ?
C33 C47 1.3900 . ?
C31 H31 0.9500 . ?
C31 C82 1.3900 . ?
C82 C25 1.3900 . ?
C82 C181 1.48(2) . ?
C25 H25 0.9500 . ?
C25 C58 1.3900 . ?
C58 C47 1.3900 . ?
C58 C113 1.46(3) . ?
C47 H47 0.9500 . ?
C34 C42 1.3900 . ?
C34 C117 1.3900 . ?
C42 H42 0.9500 . ?
C42 C81 1.3900 . ?
C81 H81 0.9500 . ?
C81 C75 1.3900 . ?
C75 H75 0.9500 . ?
C75 C168 1.3900 . ?
C168 H168 0.9500 . ?
C168 C117 1.3900 . ?
C117 H117 0.9500 . ?
F35 C113 1.28(3) . ?
F36 C254 1.31(3) . ?
F38 C139 1.29(3) . ?
F39 C198 1.27(3) . ?
C40 C76 1.3900 . ?
C40 C57 1.3900 . ?
C76 H76 0.9500 . ?
C76 C96 1.3900 . ?
C96 H96 0.9500 . ?
C96 C88 1.3900 . ?
C88 H88 0.9500 . ?
C88 C134 1.3900 . ?
C134 H134 0.9500 . ?
C134 C57 1.3900 . ?
C57 H57 0.9500 . ?
C41 C6 1.3900 . ?
C41 C98 1.3900 . ?
C6 H6 0.9500 . ?
C6 C60 1.3900 . ?
C60 C91 1.3900 . ?
C60 C101 1.51(3) . ?
C91 H91 0.9500 . ?
C91 C52 1.3900 . ?
C52 C98 1.3900 . ?
C52 C4 1.45(3) . ?
C98 H98 0.9500 . ?
C43 C37 1.3900 . ?
C43 C122 1.3900 . ?
C37 H37 0.9500 . ?
C37 C63 1.3900 . ?
C63 H63 0.9500 . ?
C63 C20 1.3900 . ?
C20 H20 0.9500 . ?
C20 C16 1.3900 . ?
C16 H16 0.9500 . ?
C16 C122 1.3900 . ?
C122 H122 0.9500 . ?
F44 C113 1.35(3) . ?
C45 C87 1.3900 . ?
C45 C172 1.3900 . ?
C87 H87 0.9500 . ?
C87 C185 1.3900 . ?
C185 H185 0.9500 . ?
C185 C186 1.3900 . ?
C186 H186 0.9500 . ?
C186 C246 1.3900 . ?
C246 H246 0.9500 . ?
C246 C172 1.3900 . ?
C172 H172 0.9500 . ?
F48 C191 1.30(3) . ?
C49 C107 1.3900 . ?
C49 C66 1.3900 . ?
C107 H107 0.9500 . ?
C107 C125 1.3900 . ?
C125 C2 1.3900 . ?
C125 C32 1.50(3) . ?
C2 H2 0.9500 . ?
C2 C46 1.3900 . ?
C46 C66 1.3900 . ?
C46 C8 1.42(3) . ?
C66 H66 0.9500 . ?
F50 C254 1.31(4) . ?
F55 C4 1.32(3) . ?
C70 C120 1.3900 . ?
C70 C126 1.3900 . ?
C120 H120 0.9500 . ?
C120 C115 1.3900 . ?
C115 C90 1.3900 . ?
C115 C191 1.52(3) . ?
C90 H90 0.9500 . ?
C90 C179 1.3900 . ?
C179 C126 1.3900 . ?
C179 C254 1.41(3) . ?
C126 H126 0.9500 . ?
C71 C56 1.3900 . ?
C71 C131 1.3900 . ?
C56 H56 0.9500 . ?
C56 C142 1.3900 . ?
C142 H142 0.9500 . ?
C142 C136 1.3900 . ?
C136 H136 0.9500 . ?
C136 C141 1.3900 . ?
C141 H141 0.9500 . ?
C141 C131 1.3900 . ?
C131 H131 0.9500 . ?
C72 C62 1.3900 . ?
C72 C173 1.3900 . ?
C62 H62 0.9500 . ?
C62 C94 1.3900 . ?
C94 H94 0.9500 . ?
C94 C144 1.3900 . ?
C144 H144 0.9500 . ?
C144 C230 1.3900 . ?
C230 H230 0.9500 . ?
C230 C173 1.3900 . ?
C173 H173 0.9500 . ?
C84 C111 1.3900 . ?
C84 C118 1.3900 . ?
C111 H111 0.9500 . ?
C111 C221 1.3900 . ?
C221 H221 0.9500 . ?
C221 C192 1.3900 . ?
C192 H192 0.9500 . ?
C192 C169 1.3900 . ?
C169 H169 0.9500 . ?
C169 C118 1.3900 . ?
C118 H118 0.9500 . ?
C85 C106 1.3900 . ?
C85 C104 1.3900 . ?
C106 H106 0.9500 . ?
C106 C155 1.3900 . ?
C155 H155 0.9500 . ?
C155 C193 1.3900 . ?
C193 H193 0.9500 . ?
C193 C160 1.3900 . ?
C160 H160 0.9500 . ?
C160 C104 1.3900 . ?
C104 H104 0.9500 . ?
C86 C119 1.3900 . ?
C86 C54 1.3900 . ?
C119 H119 0.9500 . ?
C119 C279 1.3900 . ?
C279 H279 0.9500 . ?
C279 C128 1.3900 . ?
C128 H128 0.9500 . ?
C128 C108 1.3900 . ?
C108 H108 0.9500 . ?
C108 C54 1.3900 . ?
C54 H54 0.9500 . ?
C99 C196 1.3900 . ?
C99 C130 1.3900 . ?
C196 H196 0.9500 . ?
C196 C252 1.3900 . ?
C252 H252 0.9500 . ?
C252 C171 1.3900 . ?
C171 H171 0.9500 . ?
C171 C162 1.3900 . ?
C162 H162 0.9500 . ?
C162 C130 1.3900 . ?
C130 H130 0.9500 . ?
C105 C95 1.3900 . ?
C105 C167 1.3900 . ?
C95 H95 0.9500 . ?
C95 C282 1.3900 . ?
C282 H282 0.9500 . ?
C282 C195 1.3900 . ?
C195 H195 0.9500 . ?
C195 C201 1.3900 . ?
C201 H201 0.9500 . ?
C201 C167 1.3900 . ?
C167 H167 0.9500 . ?
F109 C198 1.25(3) . ?
C112 C158 1.3900 . ?
C112 C19 1.3900 . ?
C158 H158 0.9500 . ?
C158 C218 1.3900 . ?
C218 H218 0.9500 . ?
C218 C207 1.3900 . ?
C207 H207 0.9500 . ?
C207 C68 1.3900 . ?
C68 H68 0.9500 . ?
C68 C19 1.3900 . ?
C19 H19 0.9500 . ?
C116 C132 1.3900 . ?
C116 C184 1.3900 . ?
C132 H132 0.9500 . ?
C132 C188 1.3900 . ?
C188 H188 0.9500 . ?
C188 C217 1.3900 . ?
C217 H217 0.9500 . ?
C217 C256 1.3900 . ?
C256 H256 0.9500 . ?
C256 C184 1.3900 . ?
C184 H184 0.9500 . ?
C133 C209 1.3900 . ?
C133 C205 1.3900 . ?
C209 H209 0.9500 . ?
C209 C180 1.3900 . ?
C180 H180 0.9500 . ?
C180 C335 1.3900 . ?
C335 H335 0.9500 . ?
C335 C280 1.3900 . ?
C280 H280 0.9500 . ?
C280 C205 1.3900 . ?
C205 H205 0.9500 . ?
F137 C198 1.36(4) . ?
C140 C235 1.3900 . ?
C140 C79 1.3900 . ?
C235 H235 0.9500 . ?
C235 C200 1.3900 . ?
C200 H200 0.9500 . ?
C200 C219 1.3900 . ?
C219 H219 0.9500 . ?
C219 C97 1.3900 . ?
C97 H97 0.9500 . ?
C97 C79 1.3900 . ?
C79 H79 0.9500 . ?
C143 C199 1.3900 . ?
C143 C234 1.3900 . ?
C199 H199 0.9500 . ?
C199 C232 1.3900 . ?
C232 H232 0.9500 . ?
C232 C316 1.3900 . ?
C316 H316 0.9500 . ?
C316 C268 1.3900 . ?
C268 H268 0.9500 . ?
C268 C234 1.3900 . ?
C234 H234 0.9500 . ?
C145 C123 1.3900 . ?
C145 C177 1.3900 . ?
C123 H123 0.9500 . ?
C123 C121 1.3900 . ?
C121 H121 0.9500 . ?
C121 C182 1.3900 . ?
C182 H182 0.9500 . ?
C182 C249 1.3900 . ?
C249 H249 0.9500 . ?
C249 C177 1.3900 . ?
C177 H177 0.9500 . ?
C148 C213 1.3900 . ?
C148 C290 1.3900 . ?
C213 H213 0.9500 . ?
C213 C194 1.3900 . ?
C194 H194 0.9500 . ?
C194 C283 1.3900 . ?
C283 H283 0.9500 . ?
C283 C5 1.3900 . ?
C5 H5 0.9500 . ?
C5 C290 1.3900 . ?
C290 H290 0.9500 . ?
C149 C226 1.3900 . ?
C149 C159 1.3900 . ?
C226 H226 0.9500 . ?
C226 C214 1.3900 . ?
C214 H214 0.9500 . ?
C214 C228 1.3900 . ?
C228 H228 0.9500 . ?
C228 C114 1.3900 . ?
C114 H114 0.9500 . ?
C114 C159 1.3900 . ?
C159 H159 0.9500 . ?
F150 C181 1.301(6) . ?
F152 C181 1.298(6) . ?
C157 C78 1.3900 . ?
C157 C222 1.3900 . ?
C78 H78 0.9500 . ?
C78 C178 1.3900 . ?
C178 H178 0.9500 . ?
C178 C229 1.3900 . ?
C229 H229 0.9500 . ?
C229 C319 1.3900 . ?
C319 H319 0.9500 . ?
C319 C222 1.3900 . ?
C222 H222 0.9500 . ?
C164 C174 1.3900 . ?
C164 C240 1.3900 . ?
C174 H174 0.9500 . ?
C174 C208 1.3900 . ?
C208 H208 0.9500 . ?
C208 C293 1.3900 . ?
C293 H293 0.9500 . ?
C293 C364 1.3900 . ?
C364 H364 0.9500 . ?
C364 C240 1.3900 . ?
C240 H240 0.9500 . ?
F175 C8 1.301(10) . ?
C181 F190 1.301(6) . ?
C181 F83 1.300(10) . ?
C181 F195 1.302(10) . ?
C181 F199 1.295(10) . ?
C211 C251 1.3900 . ?
C211 C264 1.3900 . ?
C251 H251 0.9500 . ?
C251 C271 1.3900 . ?
C271 H271 0.9500 . ?
C271 C285 1.3900 . ?
C285 H285 0.9500 . ?
C285 C303 1.3900 . ?
C303 H303 0.9500 . ?
C303 C264 1.3900 . ?
C264 H264 0.9500 . ?
F224 C32 1.29(4) . ?
C231 C309 1.3900 . ?
C231 C13 1.3900 . ?
C309 H309 0.9500 . ?
C309 C244 1.3900 . ?
C244 H244 0.9500 . ?
C244 C7 1.3900 . ?
C7 H7 0.9500 . ?
C7 C247 1.3900 . ?
C247 H247 0.9500 . ?
C247 C13 1.3900 . ?
C13 H13 0.9500 . ?
C261 H261 0.9500 . ?
C261 C102 1.3900 . ?
C261 C216 1.3900 . ?
C102 C245 1.3900 . ?
C245 H245 0.9500 . ?
C245 C11 1.3900 . ?
C11 H11 0.9500 . ?
C11 C308 1.3900 . ?
C308 H308 0.9500 . ?
C308 C216 1.3900 . ?
C216 H216 0.9500 . ?
C295 C138 1.3900 . ?
C295 C322 1.3900 . ?
C138 H138 0.9500 . ?
C138 C14 1.3900 . ?
C14 H14 0.9500 . ?
C14 C288 1.3900 . ?
C288 H288 0.9500 . ?
C288 C324 1.3900 . ?
C324 H324 0.9500 . ?
C324 C322 1.3900 . ?
C322 H322 0.9500 . ?
F15 C32 1.36(3) . ?
F14 C4 1.34(4) . ?
F17 C8 1.301(10) . ?
C9 H9 0.9500 . ?
C9 C259 1.3900 . ?
C9 C189 1.3900 . ?
C259 H259 0.9500 . ?
C259 C10 1.3900 . ?
C10 H10 0.9500 . ?
C10 C227 1.3900 . ?
C227 H227 0.9500 . ?
C227 C15 1.3900 . ?
C15 H15 0.9500 . ?
C15 C189 1.3900 . ?
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
Au03 P010 C30 C187 -124.1(9) . . . . ?
Au03 P010 C30 C67 54.3(10) . . . . ?
Au03 P010 C116 C132 55.6(11) . . . . ?
Au03 P010 C116 C184 -121.2(10) . . . . ?
Au03 P010 C140 C235 -179.6(8) . . . . ?
Au03 P010 C140 C79 -0.3(12) . . . . ?
Au04 P00Y C21 C92 51.5(10) . . . . ?
Au04 P00Y C21 C129 -124.4(8) . . . . ?
Au04 P00Y C112 C158 -174.5(8) . . . . ?
Au04 P00Y C112 C19 5.9(12) . . . . ?
Au04 P00Y C157 C78 48.5(10) . . . . ?
Au04 P00Y C157 C222 -129.2(9) . . . . ?
Au05 P017 C43 C37 64.1(9) . . . . ?
Au05 P017 C43 C122 -118.9(9) . . . . ?
Au05 P017 C72 C62 32.9(12) . . . . ?
Au05 P017 C72 C173 -148.0(8) . . . . ?
Au05 P017 C105 C95 21.8(12) . . . . ?
Au05 P017 C105 C167 -155.4(9) . . . . ?
Au06 P013 C34 C42 62.2(9) . . . . ?
Au06 P013 C34 C117 -120.3(8) . . . . ?
Au06 P013 C45 C87 -156.7(9) . . . . ?
Au06 P013 C45 C172 18.4(12) . . . . ?
Au06 P013 C86 C119 -143.8(8) . . . . ?
Au06 P013 C86 C54 36.8(11) . . . . ?
Au07 P016 C71 C56 16.4(11) . . . . ?
Au07 P016 C71 C131 -168.0(7) . . . . ?
Au07 P016 C99 C196 -153.7(8) . . . . ?
Au07 P016 C99 C130 31.1(12) . . . . ?
Au07 P016 C164 C174 -118.9(12) . . . . ?
Au07 P016 C164 C240 57.3(12) . . . . ?
Au08 P011 C40 C76 -167.0(7) . . . . ?
Au08 P011 C40 C57 14.4(11) . . . . ?
Au08 P011 C85 C106 -154.0(7) . . . . ?
Au08 P011 C85 C104 29.0(10) . . . . ?
Au08 P011 C149 C226 53.5(11) . . . . ?
Au08 P011 C149 C159 -124.0(10) . . . . ?
Au09 P019 C18 C12 42.3(10) . . . . ?
Au09 P019 C18 C103 -133.3(8) . . . . ?
Au09 P019 C84 C111 -152.2(8) . . . . ?
Au09 P019 C84 C118 30.7(13) . . . . ?
Au09 P019 C133 C209 -119.6(10) . . . . ?
Au09 P019 C133 C205 66.0(10) . . . . ?
Au0A P018 C24 C110 -135.2(8) . . . . ?
Au0A P018 C24 C17 40.6(11) . . . . ?
Au0A P018 C143 C199 -120.5(10) . . . . ?
Au0A P018 C143 C234 62.3(11) . . . . ?
Au0A P018 C145 C123 32.5(13) . . . . ?
Au0A P018 C145 C177 -152.2(9) . . . . ?
Ag0C S00S C33 C31 -125.8(8) . . . . ?
Ag0C S00S C33 C47 53.3(10) . . . . ?
Ag0D S00T C27 C26 97.4(7) . . . . ?
Ag0D S00T C27 C55 -85.3(8) . . . . ?
Ag0E S00W C41 C6 -82.5(9) . . . . ?
Ag0E S00W C41 C98 100.2(8) . . . . ?
Ag0F S00V C1 C59 54.8(10) . . . . ?
Ag0F S00V C1 C61 -123.0(8) . . . . ?
Ag0G S00T C27 C26 176.7(6) . . . . ?
Ag0G S00T C27 C55 -6.0(10) . . . . ?
Ag0H S00S C33 C31 157.3(7) . . . . ?
Ag0H S00S C33 C47 -23.7(11) . . . . ?
Ag0I S00V C1 C59 -22.4(11) . . . . ?
Ag0I S00V C1 C61 159.8(8) . . . . ?
Ag0J S00W C41 C6 -4.3(11) . . . . ?
Ag0J S00W C41 C98 178.4(7) . . . . ?
Ag0M S012 C70 C120 55.9(10) . . . . ?
Ag0M S012 C70 C126 -125.1(9) . . . . ?
Ag0N S01A C49 C107 -125.1(8) . . . . ?
Ag0N S01A C49 C66 56.2(10) . . . . ?
Ag0Q S012 C70 C120 -162.4(7) . . . . ?
Ag0Q S012 C70 C126 16.6(11) . . . . ?
Ag0Q P01B C211 C251 131.0(10) . . . . ?
Ag0Q P01B C211 C264 -46.8(10) . . . . ?
Ag0Q P01B C102 C261 -29.6(15) . . . . ?
Ag0Q P01B C102 C245 157.5(10) . . . . ?
Ag0Q P01B C189 C9 146.1(9) . . . . ?
Ag0Q P01B C189 C15 -34.6(10) . . . . ?
Ag0R S01A C49 C107 24.5(11) . . . . ?
Ag0R S01A C49 C66 -154.2(7) . . . . ?
Ag0R P01C C148 C213 33.1(17) . . . . ?
Ag0R P01C C148 C290 -154.6(10) . . . . ?
Ag0R P01C C231 C309 -105.5(11) . . . . ?
Ag0R P01C C231 C13 63.0(13) . . . . ?
Ag0R P01C C295 C138 -153.7(9) . . . . ?
Ag0R P01C C295 C322 23.4(13) . . . . ?
S00S C33 C31 C82 179.1(11) . . . . ?
S00S C33 C47 C58 -179.0(12) . . . . ?
S00T C27 C26 C109 177.4(11) . . . . ?
S00T C27 C55 C64 -177.3(11) . . . . ?
S00V C1 C59 C53 -177.8(13) . . . . ?
S00V C1 C61 C74 178.0(12) . . . . ?
S00W C41 C6 C60 -177.2(12) . . . . ?
S00W C41 C98 C52 177.3(11) . . . . ?
P00Y C21 C92 C65 -176.0(12) . . . . ?
P00Y C21 C129 C166 175.8(12) . . . . ?
P00Y C112 C158 C218 -179.6(13) . . . . ?
P00Y C112 C19 C68 179.6(13) . . . . ?
P00Y C157 C78 C178 -177.8(13) . . . . ?
P00Y C157 C222 C319 177.7(13) . . . . ?
P010 C30 C187 C203 178.3(13) . . . . ?
P010 C30 C67 C89 -178.4(13) . . . . ?
P010 C116 C132 C188 -176.9(12) . . . . ?
P010 C116 C184 C256 176.7(13) . . . . ?
P010 C140 C235 C200 179.3(13) . . . . ?
P010 C140 C79 C97 -179.3(12) . . . . ?
P011 C40 C76 C96 -178.6(12) . . . . ?
P011 C40 C57 C134 178.6(12) . . . . ?
P011 C85 C106 C155 -177.0(11) . . . . ?
P011 C85 C104 C160 177.0(11) . . . . ?
P011 C149 C226 C214 -177.6(14) . . . . ?
P011 C149 C159 C114 177.4(15) . . . . ?
S012 C70 C120 C115 179.1(12) . . . . ?
S012 C70 C126 C179 -179.0(12) . . . . ?
P013 C34 C42 C81 177.6(11) . . . . ?
P013 C34 C117 C168 -177.5(12) . . . . ?
P013 C45 C87 C185 175.0(14) . . . . ?
P013 C45 C172 C246 -175.2(13) . . . . ?
P013 C86 C119 C279 -179.3(13) . . . . ?
P013 C86 C54 C108 179.4(12) . . . . ?
P016 C71 C56 C142 175.7(12) . . . . ?
P016 C71 C131 C141 -175.5(12) . . . . ?
P016 C99 C196 C252 -175.1(13) . . . . ?
P016 C99 C130 C162 175.3(12) . . . . ?
P016 C164 C174 C208 176.0(16) . . . . ?
P016 C164 C240 C364 -176.4(15) . . . . ?
P017 C43 C37 C63 177.1(12) . . . . ?
P017 C43 C122 C16 -177.0(12) . . . . ?
P017 C72 C62 C94 179.1(12) . . . . ?
P017 C72 C173 C230 -179.1(13) . . . . ?
P017 C105 C95 C282 -177.3(13) . . . . ?
P017 C105 C167 C201 177.1(13) . . . . ?
P018 C24 C110 C170 175.8(13) . . . . ?
P018 C24 C17 C3 -175.9(13) . . . . ?
P018 C143 C199 C232 -177.1(14) . . . . ?
P018 C143 C234 C268 177.3(14) . . . . ?
P018 C145 C123 C121 175.4(14) . . . . ?
P018 C145 C177 C249 -175.3(14) . . . . ?
P019 C18 C12 C22 -175.8(13) . . . . ?
P019 C18 C103 C93 175.5(14) . . . . ?
P019 C84 C111 C221 -177.1(13) . . . . ?
P019 C84 C118 C169 177.1(13) . . . . ?
P019 C133 C209 C180 -174.2(14) . . . . ?
P019 C133 C205 C280 174.7(13) . . . . ?
S01A C49 C107 C125 -178.7(12) . . . . ?
S01A C49 C66 C46 178.7(12) . . . . ?
P01B C211 C251 C271 -177.6(15) . . . . ?
P01B C211 C264 C303 178.0(13) . . . . ?
P01B C102 C245 C11 172.8(17) . . . . ?
P01C C148 C213 C194 172.5(17) . . . . ?
P01C C148 C290 C5 -172.0(19) . . . . ?
P01C C231 C309 C244 168.1(15) . . . . ?
P01C C231 C13 C247 -168.7(15) . . . . ?
P01C C295 C138 C14 177.1(16) . . . . ?
P01C C295 C322 C324 -177.2(15) . . . . ?
C27 C26 C109 C48 0.0 . . . . ?
C27 C26 C109 C139 -177.8(18) . . . . ?
C26 C27 C55 C64 0.0 . . . . ?
C26 C109 C48 C64 0.0 . . . . ?
C26 C109 C139 F4 -155.5(16) . . . . ?
C26 C109 C139 F2 88.1(19) . . . . ?
C26 C109 C139 F38 -32(3) . . . . ?
C109 C48 C64 C55 0.0 . . . . ?
C109 C48 C64 C77 177.0(17) . . . . ?
C48 C109 C139 F4 27(3) . . . . ?
C48 C109 C139 F2 -90(2) . . . . ?
C48 C109 C139 F38 150.4(18) . . . . ?
C48 C64 C55 C27 0.0 . . . . ?
C48 C64 C77 F1 169.2(16) . . . . ?
C48 C64 C77 F9 -68(2) . . . . ?
C48 C64 C77 F10 51(3) . . . . ?
C55 C27 C26 C109 0.0 . . . . ?
C55 C64 C77 F1 -14(3) . . . . ?
C55 C64 C77 F9 109(2) . . . . ?
C55 C64 C77 F10 -132.3(18) . . . . ?
C77 C64 C55 C27 -176.9(18) . . . . ?
C18 P019 C84 C111 83.1(12) . . . . ?
C18 P019 C84 C118 -94.0(12) . . . . ?
C18 P019 C133 C209 3.7(13) . . . . ?
C18 P019 C133 C205 -170.7(9) . . . . ?
C18 C12 C22 C161 0.0 . . . . ?
C12 C18 C103 C93 0.0 . . . . ?
C12 C22 C161 C93 0.0 . . . . ?
C22 C161 C93 C103 0.0 . . . . ?
C161 C93 C103 C18 0.0 . . . . ?
C103 C18 C12 C22 0.0 . . . . ?
C21 P00Y C112 C158 -53.8(11) . . . . ?
C21 P00Y C112 C19 126.6(10) . . . . ?
C21 P00Y C157 C78 -71.4(11) . . . . ?
C21 P00Y C157 C222 110.8(11) . . . . ?
C21 C92 C65 C124 0.0 . . . . ?
C92 C21 C129 C166 0.0 . . . . ?
C92 C65 C124 C166 0.0 . . . . ?
C65 C124 C166 C129 0.0 . . . . ?
C124 C166 C129 C21 0.0 . . . . ?
C129 C21 C92 C65 0.0 . . . . ?
C24 P018 C143 C199 2.3(13) . . . . ?
C24 P018 C143 C234 -174.9(9) . . . . ?
C24 P018 C145 C123 -93.7(12) . . . . ?
C24 P018 C145 C177 81.7(12) . . . . ?
C24 C110 C170 C165 0.0 . . . . ?
C110 C24 C17 C3 0.0 . . . . ?
C110 C170 C165 C3 0.0 . . . . ?
C170 C165 C3 C17 0.0 . . . . ?
C165 C3 C17 C24 0.0 . . . . ?
C17 C24 C110 C170 0.0 . . . . ?
C1 C59 C53 C51 0.0 . . . . ?
C1 C59 C53 C135 179(2) . . . . ?
C59 C1 C61 C74 0.0 . . . . ?
C59 C53 C51 C74 0.0 . . . . ?
C59 C53 C135 F3 -8(4) . . . . ?
C59 C53 C135 F20 -134.8(19) . . . . ?
C59 C53 C135 F23 110(2) . . . . ?
C53 C51 C74 C61 0.0 . . . . ?
C53 C51 C74 C198 -173(2) . . . . ?
C51 C53 C135 F3 171(2) . . . . ?
C51 C53 C135 F20 44(3) . . . . ?
C51 C53 C135 F23 -71(3) . . . . ?
C51 C74 C61 C1 0.0 . . . . ?
C51 C74 C198 F39 156(3) . . . . ?
C51 C74 C198 F109 14(4) . . . . ?
C51 C74 C198 F137 -93(2) . . . . ?
C61 C1 C59 C53 0.0 . . . . ?
C61 C74 C198 F39 -17(5) . . . . ?
C61 C74 C198 F109 -159(3) . . . . ?
C61 C74 C198 F137 94(2) . . . . ?
C30 P010 C116 C132 -63.8(12) . . . . ?
C30 P010 C116 C184 119.4(11) . . . . ?
C30 P010 C140 C235 -59.0(11) . . . . ?
C30 P010 C140 C79 120.3(10) . . . . ?
C30 C187 C203 C153 0.0 . . . . ?
C187 C30 C67 C89 0.0 . . . . ?
C187 C203 C153 C89 0.0 . . . . ?
C203 C153 C89 C67 0.0 . . . . ?
C153 C89 C67 C30 0.0 . . . . ?
C67 C30 C187 C203 0.0 . . . . ?
C33 C31 C82 C25 0.0 . . . . ?
C33 C31 C82 C181 179.5(18) . . . . ?
C31 C33 C47 C58 0.0 . . . . ?
C31 C82 C25 C58 0.0 . . . . ?
C31 C82 C181 F150 23(3) . . . . ?
C31 C82 C181 F152 160(2) . . . . ?
C31 C82 C181 F190 -86.7(18) . . . . ?
C31 C82 C181 F83 100(2) . . . . ?
C31 C82 C181 F195 -158(3) . . . . ?
C31 C82 C181 F199 -33(4) . . . . ?
C82 C25 C58 C47 0.0 . . . . ?
C82 C25 C58 C113 177(2) . . . . ?
C25 C82 C181 F150 -158(2) . . . . ?
C25 C82 C181 F152 -20(3) . . . . ?
C25 C82 C181 F190 92.8(18) . . . . ?
C25 C82 C181 F83 -80(2) . . . . ?
C25 C82 C181 F195 22(3) . . . . ?
C25 C82 C181 F199 147(3) . . . . ?
C25 C58 C47 C33 0.0 . . . . ?
C25 C58 C113 F6 177(2) . . . . ?
C25 C58 C113 F35 -52(3) . . . . ?
C25 C58 C113 F44 58(3) . . . . ?
C47 C33 C31 C82 0.0 . . . . ?
C47 C58 C113 F6 -6(4) . . . . ?
C47 C58 C113 F35 125(2) . . . . ?
C47 C58 C113 F44 -125.0(18) . . . . ?
C34 P013 C45 C87 76.6(12) . . . . ?
C34 P013 C45 C172 -108.3(11) . . . . ?
C34 P013 C86 C119 -22.5(12) . . . . ?
C34 P013 C86 C54 158.2(10) . . . . ?
C34 C42 C81 C75 0.0 . . . . ?
C42 C34 C117 C168 0.0 . . . . ?
C42 C81 C75 C168 0.0 . . . . ?
C81 C75 C168 C117 0.0 . . . . ?
C75 C168 C117 C34 0.0 . . . . ?
C117 C34 C42 C81 0.0 . . . . ?
C40 P011 C85 C106 80.3(11) . . . . ?
C40 P011 C85 C104 -96.7(9) . . . . ?
C40 P011 C149 C226 178.6(10) . . . . ?
C40 P011 C149 C159 1.1(13) . . . . ?
C40 C76 C96 C88 0.0 . . . . ?
C76 C40 C57 C134 0.0 . . . . ?
C76 C96 C88 C134 0.0 . . . . ?
C96 C88 C134 C57 0.0 . . . . ?
C88 C134 C57 C40 0.0 . . . . ?
C57 C40 C76 C96 0.0 . . . . ?
C41 C6 C60 C91 0.0 . . . . ?
C41 C6 C60 C101 178(2) . . . . ?
C6 C41 C98 C52 0.0 . . . . ?
C6 C60 C91 C52 0.0 . . . . ?
C6 C60 C101 F7 -5(3) . . . . ?
C6 C60 C101 F13 -124(2) . . . . ?
C6 C60 C101 F29 118(2) . . . . ?
C60 C91 C52 C98 0.0 . . . . ?
C60 C91 C52 C4 179(2) . . . . ?
C91 C60 C101 F7 173.5(18) . . . . ?
C91 C60 C101 F13 55(3) . . . . ?
C91 C60 C101 F29 -63(3) . . . . ?
C91 C52 C98 C41 0.0 . . . . ?
C91 C52 C4 F16 28(4) . . . . ?
C91 C52 C4 F55 150(2) . . . . ?
C91 C52 C4 F14 -93(2) . . . . ?
C98 C41 C6 C60 0.0 . . . . ?
C98 C52 C4 F16 -153(2) . . . . ?
C98 C52 C4 F55 -31(3) . . . . ?
C98 C52 C4 F14 86(3) . . . . ?
C43 P017 C72 C62 153.0(10) . . . . ?
C43 P017 C72 C173 -27.9(12) . . . . ?
C43 P017 C105 C95 -102.2(11) . . . . ?
C43 P017 C105 C167 80.6(12) . . . . ?
C43 C37 C63 C20 0.0 . . . . ?
C37 C43 C122 C16 0.0 . . . . ?
C37 C63 C20 C16 0.0 . . . . ?
C63 C20 C16 C122 0.0 . . . . ?
C20 C16 C122 C43 0.0 . . . . ?
C122 C43 C37 C63 0.0 . . . . ?
C45 P013 C34 C42 -169.5(9) . . . . ?
C45 P013 C34 C117 8.0(11) . . . . ?
C45 P013 C86 C119 90.5(11) . . . . ?
C45 P013 C86 C54 -88.8(11) . . . . ?
C45 C87 C185 C186 0.0 . . . . ?
C87 C45 C172 C246 0.0 . . . . ?
C87 C185 C186 C246 0.0 . . . . ?
C185 C186 C246 C172 0.0 . . . . ?
C186 C246 C172 C45 0.0 . . . . ?
C172 C45 C87 C185 0.0 . . . . ?
C49 C107 C125 C2 0.0 . . . . ?
C49 C107 C125 C32 -175(2) . . . . ?
C107 C49 C66 C46 0.0 . . . . ?
C107 C125 C2 C46 0.0 . . . . ?
C107 C125 C32 F8 91(3) . . . . ?
C107 C125 C32 F224 -34(3) . . . . ?
C107 C125 C32 F15 -155.3(18) . . . . ?
C125 C2 C46 C66 0.0 . . . . ?
C125 C2 C46 C8 -179.0(17) . . . . ?
C2 C125 C32 F8 -84(3) . . . . ?
C2 C125 C32 F224 152(2) . . . . ?
C2 C125 C32 F15 30(3) . . . . ?
C2 C46 C66 C49 0.0 . . . . ?
C2 C46 C8 F11 127.8(16) . . . . ?
C2 C46 C8 F175 -113.6(18) . . . . ?
C2 C46 C8 F17 4(2) . . . . ?
C66 C49 C107 C125 0.0 . . . . ?
C66 C46 C8 F11 -51(2) . . . . ?
C66 C46 C8 F175 67(2) . . . . ?
C66 C46 C8 F17 -175.0(15) . . . . ?
C70 C120 C115 C90 0.0 . . . . ?
C70 C120 C115 C191 174.6(19) . . . . ?
C120 C70 C126 C179 0.0 . . . . ?
C120 C115 C90 C179 0.0 . . . . ?
C120 C115 C191 F12 -51(3) . . . . ?
C120 C115 C191 F28 -172.4(16) . . . . ?
C120 C115 C191 F48 74(2) . . . . ?
C115 C90 C179 C126 0.0 . . . . ?
C115 C90 C179 C254 175(2) . . . . ?
C90 C115 C191 F12 124(2) . . . . ?
C90 C115 C191 F28 2(3) . . . . ?
C90 C115 C191 F48 -112(2) . . . . ?
C90 C179 C126 C70 0.0 . . . . ?
C90 C179 C254 F5 -88(3) . . . . ?
C90 C179 C254 F36 34(4) . . . . ?
C90 C179 C254 F50 152(2) . . . . ?
C126 C70 C120 C115 0.0 . . . . ?
C126 C179 C254 F5 87(3) . . . . ?
C126 C179 C254 F36 -151(2) . . . . ?
C126 C179 C254 F50 -32(4) . . . . ?
C71 P016 C99 C196 80.8(11) . . . . ?
C71 P016 C99 C130 -94.4(11) . . . . ?
C71 P016 C164 C174 6.2(15) . . . . ?
C71 P016 C164 C240 -177.6(11) . . . . ?
C71 C56 C142 C136 0.0 . . . . ?
C56 C71 C131 C141 0.0 . . . . ?
C56 C142 C136 C141 0.0 . . . . ?
C142 C136 C141 C131 0.0 . . . . ?
C136 C141 C131 C71 0.0 . . . . ?
C131 C71 C56 C142 0.0 . . . . ?
C72 P017 C43 C37 -58.1(10) . . . . ?
C72 P017 C43 C122 118.9(10) . . . . ?
C72 P017 C105 C95 148.5(10) . . . . ?
C72 P017 C105 C167 -28.7(12) . . . . ?
C72 C62 C94 C144 0.0 . . . . ?
C62 C72 C173 C230 0.0 . . . . ?
C62 C94 C144 C230 0.0 . . . . ?
C94 C144 C230 C173 0.0 . . . . ?
C144 C230 C173 C72 0.0 . . . . ?
C173 C72 C62 C94 0.0 . . . . ?
C84 P019 C18 C12 170.4(9) . . . . ?
C84 P019 C18 C103 -5.2(12) . . . . ?
C84 P019 C133 C209 111.8(12) . . . . ?
C84 P019 C133 C205 -62.6(11) . . . . ?
C84 C111 C221 C192 0.0 . . . . ?
C111 C84 C118 C169 0.0 . . . . ?
C111 C221 C192 C169 0.0 . . . . ?
C221 C192 C169 C118 0.0 . . . . ?
C192 C169 C118 C84 0.0 . . . . ?
C118 C84 C111 C221 0.0 . . . . ?
C85 P011 C40 C76 -41.5(11) . . . . ?
C85 P011 C40 C57 139.9(9) . . . . ?
C85 P011 C149 C226 -71.2(11) . . . . ?
C85 P011 C149 C159 111.3(12) . . . . ?
C85 C106 C155 C193 0.0 . . . . ?
C106 C85 C104 C160 0.0 . . . . ?
C106 C155 C193 C160 0.0 . . . . ?
C155 C193 C160 C104 0.0 . . . . ?
C193 C160 C104 C85 0.0 . . . . ?
C104 C85 C106 C155 0.0 . . . . ?
C86 P013 C34 C42 -60.3(10) . . . . ?
C86 P013 C34 C117 117.2(10) . . . . ?
C86 P013 C45 C87 -31.7(12) . . . . ?
C86 P013 C45 C172 143.5(11) . . . . ?
C86 C119 C279 C128 0.0 . . . . ?
C119 C86 C54 C108 0.0 . . . . ?
C119 C279 C128 C108 0.0 . . . . ?
C279 C128 C108 C54 0.0 . . . . ?
C128 C108 C54 C86 0.0 . . . . ?
C54 C86 C119 C279 0.0 . . . . ?
C99 P016 C71 C56 141.7(10) . . . . ?
C99 P016 C71 C131 -42.7(11) . . . . ?
C99 P016 C164 C174 117.0(13) . . . . ?
C99 P016 C164 C240 -66.8(12) . . . . ?
C99 C196 C252 C171 0.0 . . . . ?
C196 C99 C130 C162 0.0 . . . . ?
C196 C252 C171 C162 0.0 . . . . ?
C252 C171 C162 C130 0.0 . . . . ?
C171 C162 C130 C99 0.0 . . . . ?
C130 C99 C196 C252 0.0 . . . . ?
C101 C60 C91 C52 -178.4(19) . . . . ?
C105 P017 C43 C37 -168.7(9) . . . . ?
C105 P017 C43 C122 8.3(11) . . . . ?
C105 P017 C72 C62 -95.1(11) . . . . ?
C105 P017 C72 C173 84.0(11) . . . . ?
C105 C95 C282 C195 0.0 . . . . ?
C95 C105 C167 C201 0.0 . . . . ?
C95 C282 C195 C201 0.0 . . . . ?
C282 C195 C201 C167 0.0 . . . . ?
C195 C201 C167 C105 0.0 . . . . ?
C167 C105 C95 C282 0.0 . . . . ?
C112 P00Y C21 C92 -73.7(11) . . . . ?
C112 P00Y C21 C129 110.4(11) . . . . ?
C112 P00Y C157 C78 177.7(9) . . . . ?
C112 P00Y C157 C222 -0.1(13) . . . . ?
C112 C158 C218 C207 0.0 . . . . ?
C158 C112 C19 C68 0.0 . . . . ?
C158 C218 C207 C68 0.0 . . . . ?
C218 C207 C68 C19 0.0 . . . . ?
C207 C68 C19 C112 0.0 . . . . ?
C19 C112 C158 C218 0.0 . . . . ?
C113 C58 C47 C33 -178(2) . . . . ?
C116 P010 C30 C187 -3.8(12) . . . . ?
C116 P010 C30 C67 174.6(10) . . . . ?
C116 P010 C140 C235 54.2(11) . . . . ?
C116 P010 C140 C79 -126.5(10) . . . . ?
C116 C132 C188 C217 0.0 . . . . ?
C132 C116 C184 C256 0.0 . . . . ?
C132 C188 C217 C256 0.0 . . . . ?
C188 C217 C256 C184 0.0 . . . . ?
C217 C256 C184 C116 0.0 . . . . ?
C184 C116 C132 C188 0.0 . . . . ?
C133 P019 C18 C12 -81.2(11) . . . . ?
C133 P019 C18 C103 103.2(11) . . . . ?
C133 P019 C84 C111 -26.8(13) . . . . ?
C133 P019 C84 C118 156.1(11) . . . . ?
C133 C209 C180 C335 0.0 . . . . ?
C209 C133 C205 C280 0.0 . . . . ?
C209 C180 C335 C280 0.0 . . . . ?
C180 C335 C280 C205 0.0 . . . . ?
C335 C280 C205 C133 0.0 . . . . ?
C205 C133 C209 C180 0.0 . . . . ?
C135 C53 C51 C74 -179(2) . . . . ?
C139 C109 C48 C64 177.8(18) . . . . ?
C140 P010 C30 C187 110.7(11) . . . . ?
C140 P010 C30 C67 -70.9(11) . . . . ?
C140 P010 C116 C132 -175.0(10) . . . . ?
C140 P010 C116 C184 8.3(12) . . . . ?
C140 C235 C200 C219 0.0 . . . . ?
C235 C140 C79 C97 0.0 . . . . ?
C235 C200 C219 C97 0.0 . . . . ?
C200 C219 C97 C79 0.0 . . . . ?
C219 C97 C79 C140 0.0 . . . . ?
C79 C140 C235 C200 0.0 . . . . ?
C143 P018 C24 C110 102.7(11) . . . . ?
C143 P018 C24 C17 -81.4(11) . . . . ?
C143 P018 C145 C123 156.3(11) . . . . ?
C143 P018 C145 C177 -28.3(14) . . . . ?
C143 C199 C232 C316 0.0 . . . . ?
C199 C143 C234 C268 0.0 . . . . ?
C199 C232 C316 C268 0.0 . . . . ?
C232 C316 C268 C234 0.0 . . . . ?
C316 C268 C234 C143 0.0 . . . . ?
C234 C143 C199 C232 0.0 . . . . ?
C145 P018 C24 C110 -6.5(12) . . . . ?
C145 P018 C24 C17 169.3(10) . . . . ?
C145 P018 C143 C199 112.1(12) . . . . ?
C145 P018 C143 C234 -65.1(12) . . . . ?
C145 C123 C121 C182 0.0 . . . . ?
C123 C145 C177 C249 0.0 . . . . ?
C123 C121 C182 C249 0.0 . . . . ?
C121 C182 C249 C177 0.0 . . . . ?
C182 C249 C177 C145 0.0 . . . . ?
C177 C145 C123 C121 0.0 . . . . ?
C148 P01C C231 C309 127.2(13) . . . . ?
C148 P01C C231 C13 -64.4(14) . . . . ?
C148 P01C C295 C138 -22.4(15) . . . . ?
C148 P01C C295 C322 154.8(11) . . . . ?
C148 C213 C194 C283 0.0 . . . . ?
C213 C148 C290 C5 0.0 . . . . ?
C213 C194 C283 C5 0.0 . . . . ?
C194 C283 C5 C290 0.0 . . . . ?
C283 C5 C290 C148 0.0 . . . . ?
C290 C148 C213 C194 0.0 . . . . ?
C149 P011 C40 C76 69.3(11) . . . . ?
C149 P011 C40 C57 -109.3(10) . . . . ?
C149 P011 C85 C106 -30.5(11) . . . . ?
C149 P011 C85 C104 152.5(9) . . . . ?
C149 C226 C214 C228 0.0 . . . . ?
C226 C149 C159 C114 0.0 . . . . ?
C226 C214 C228 C114 0.0 . . . . ?
C214 C228 C114 C159 0.0 . . . . ?
C228 C114 C159 C149 0.0 . . . . ?
C159 C149 C226 C214 0.0 . . . . ?
C157 P00Y C21 C92 171.0(10) . . . . ?
C157 P00Y C21 C129 -4.9(12) . . . . ?
C157 P00Y C112 C158 60.6(12) . . . . ?
C157 P00Y C112 C19 -119.1(10) . . . . ?
C157 C78 C178 C229 0.0 . . . . ?
C78 C157 C222 C319 0.0 . . . . ?
C78 C178 C229 C319 0.0 . . . . ?
C178 C229 C319 C222 0.0 . . . . ?
C229 C319 C222 C157 0.0 . . . . ?
C222 C157 C78 C178 0.0 . . . . ?
C164 P016 C71 C56 -107.0(11) . . . . ?
C164 P016 C71 C131 68.6(12) . . . . ?
C164 P016 C99 C196 -31.2(12) . . . . ?
C164 P016 C99 C130 153.7(10) . . . . ?
C164 C174 C208 C293 0.0 . . . . ?
C174 C164 C240 C364 0.0 . . . . ?
C174 C208 C293 C364 0.0 . . . . ?
C208 C293 C364 C240 0.0 . . . . ?
C293 C364 C240 C164 0.0 . . . . ?
C240 C164 C174 C208 0.0 . . . . ?
C181 C82 C25 C58 -179.5(18) . . . . ?
C191 C115 C90 C179 -174(2) . . . . ?
C198 C74 C61 C1 173(3) . . . . ?
C211 P01B C102 C261 -145.4(13) . . . . ?
C211 P01B C102 C245 41.6(16) . . . . ?
C211 P01B C189 C9 -98.5(11) . . . . ?
C211 P01B C189 C15 80.8(11) . . . . ?
C211 C251 C271 C285 0.0 . . . . ?
C251 C211 C264 C303 0.0 . . . . ?
C251 C271 C285 C303 0.0 . . . . ?
C271 C285 C303 C264 0.0 . . . . ?
C285 C303 C264 C211 0.0 . . . . ?
C264 C211 C251 C271 0.0 . . . . ?
C231 P01C C148 C213 155.6(14) . . . . ?
C231 P01C C148 C290 -32.1(16) . . . . ?
C231 P01C C295 C138 86.4(13) . . . . ?
C231 P01C C295 C322 -96.4(13) . . . . ?
C231 C309 C244 C7 0.0 . . . . ?
C309 C231 C13 C247 0.0 . . . . ?
C309 C244 C7 C247 0.0 . . . . ?
C244 C7 C247 C13 0.0 . . . . ?
C7 C247 C13 C231 0.0 . . . . ?
C13 C231 C309 C244 0.0 . . . . ?
C254 C179 C126 C70 -175(3) . . . . ?
C261 C102 C245 C11 0.0 . . . . ?
C102 P01B C211 C251 -103.7(13) . . . . ?
C102 P01B C211 C264 78.5(12) . . . . ?
C102 P01B C189 C9 8.0(12) . . . . ?
C102 P01B C189 C15 -172.7(12) . . . . ?
C102 C261 C216 C308 0.0 . . . . ?
C102 C245 C11 C308 0.0 . . . . ?
C245 C11 C308 C216 0.0 . . . . ?
C11 C308 C216 C261 0.0 . . . . ?
C216 C261 C102 P01B -173.1(17) . . . . ?
C216 C261 C102 C245 0.0 . . . . ?
C295 P01C C148 C213 -94.9(15) . . . . ?
C295 P01C C148 C290 77.3(15) . . . . ?
C295 P01C C231 C309 15.5(15) . . . . ?
C295 P01C C231 C13 -176.0(12) . . . . ?
C295 C138 C14 C288 0.0 . . . . ?
C138 C295 C322 C324 0.0 . . . . ?
C138 C14 C288 C324 0.0 . . . . ?
C14 C288 C324 C322 0.0 . . . . ?
C288 C324 C322 C295 0.0 . . . . ?
C322 C295 C138 C14 0.0 . . . . ?
C32 C125 C2 C46 175(2) . . . . ?
C4 C52 C98 C41 -179(2) . . . . ?
C8 C46 C66 C49 179.0(17) . . . . ?
C9 C259 C10 C227 0.0 . . . . ?
C259 C9 C189 P01B 179.3(7) . . . . ?
C259 C9 C189 C15 0.0 . . . . ?
C259 C10 C227 C15 0.0 . . . . ?
C10 C227 C15 C189 0.0 . . . . ?
C227 C15 C189 P01B -179.3(7) . . . . ?
C227 C15 C189 C9 0.0 . . . . ?
C189 P01B C211 C251 6.7(15) . . . . ?
C189 P01B C211 C264 -171.1(10) . . . . ?
C189 P01B C102 C261 108.1(11) . . . . ?
C189 P01B C102 C245 -64.9(14) . . . . ?
C189 C9 C259 C10 0.0 . . . . ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 0.156 0.030 7.1 0.0 ?
2 -0.290 -0.113 0.552 5469.7 1054.3 '4 C11H24Cl10'
3 0.000 0.844 0.970 7.1 0.0 ?
4 0.500 0.344 0.530 7.1 0.0 ?
5 0.500 0.656 0.470 7.1 0.0 ?
