#------------------------------------------------------------------------------
#$Date: 2021-09-06 14:24:37 +0300 (Mon, 06 Sep 2021) $
#$Revision: 268799 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/70/79/7707912.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_7707912
loop_
_publ_author_name
'Weller, Ruth'
'Ruppach, Lutz'
'Shlyaykher, Alena'
'Tambornino, Frank'
'Werncke, C. Gunnar'
_publ_section_title
;
 Homoleptic quasilinear metal(i/ii) silylamides of Cr-Co with phenyl and
 allyl functions - impact of the oxidation state on secondary ligand
 interactions.
;
_journal_issue                   31
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10947
_journal_page_last               10963
_journal_paper_doi               10.1039/d1dt01543e
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety
'C46 H73 Co N3 Si2, C20 H40 K O8, 0.7(O1), C4 H8 O0.3'
_chemical_formula_sum            'C70 H121 Co K N3 O9 Si2'
_chemical_formula_weight         1302.90
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_audit_creation_date             2021-06-02
_audit_creation_method
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_audit_update_record
;
2021-06-12 deposited with the CCDC.	2021-07-07 downloaded from the CCDC.
;
_cell_angle_alpha                102.682(2)
_cell_angle_beta                 100.886(2)
_cell_angle_gamma                94.621(2)
_cell_formula_units_Z            2
_cell_length_a                   13.0565(5)
_cell_length_b                   15.5862(7)
_cell_length_c                   19.4665(8)
_cell_measurement_reflns_used    9881
_cell_measurement_temperature    100
_cell_measurement_theta_max      30.811
_cell_measurement_theta_min      1.933
_cell_volume                     3764.4(3)
_computing_cell_refinement       'SAINT V8.38A (?, 2016)'
_computing_data_collection       'SAINT V8.38A (?, 2016)'
_computing_data_reduction        'SAINT V8.38A (?, 2016)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100.03
_diffrn_detector                 'Bruker APEX2 area detector'
_diffrn_detector_area_resol_mean 7.9
_diffrn_detector_type            'CCD area detector'
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.843
_diffrn_measurement_device       'three-circle diffractometer'
_diffrn_measurement_device_type  'Bruker SMART APEX2 area detector'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_monochromator  'mirror optics'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0429
_diffrn_reflns_av_unetI/netI     0.0479
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.843
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            77935
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.843
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.811
_diffrn_reflns_theta_min         1.933
_diffrn_source                   'microfocus sealed X-ray tube'
_diffrn_source_type              'Incoatec I\ms'
_exptl_absorpt_coefficient_mu    0.367
_exptl_absorpt_correction_T_max  0.7461
_exptl_absorpt_correction_T_min  0.7109
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1548 before and 0.0477 after correction. The Ratio of minimum to maximum transmission is 0.9528. The λ/2 correction factor is Not present.'
_exptl_crystal_colour            'clear dark red'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   dark
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.149
_exptl_crystal_description       block
_exptl_crystal_F_000             1416
_exptl_crystal_size_max          0.358
_exptl_crystal_size_mid          0.238
_exptl_crystal_size_min          0.203
_exptl_crystal_size_rad          0.062
_refine_diff_density_max         0.722
_refine_diff_density_min         -0.705
_refine_diff_density_rms         0.067
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.032
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     884
_refine_ls_number_reflns         19892
_refine_ls_number_restraints     26
_refine_ls_restrained_S_all      1.033
_refine_ls_R_factor_all          0.0910
_refine_ls_R_factor_gt           0.0582
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0479P)²+4.1222P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1229
_refine_ls_wR_factor_ref         0.1374
_reflns_Friedel_coverage         0.000
_reflns_number_gt                14601
_reflns_number_total             19892
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d1dt01543e2.cif
_cod_data_source_block           k18c6_col4_ndipp
_cod_depositor_comments
'Adding full bibliography for 7707896--7707917.cif.'
_cod_database_code               7707912
_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   0.929
_shelx_estimated_absorpt_t_min   0.880
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All C(H,H,H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Shared sites
{O1, C8}
3. Restrained distances
 K1-O00Y \\sim K1-O00Z
 with sigma of 0.02
 O00Y-C024 \\sim O00Z-C3AA
 with sigma of 0.02
 O00Y-C027 \\sim O00Z-C0
 with sigma of 0.02
 C021-C024 \\sim C5AA-C3AA
 with sigma of 0.02
 C021-C02A \\sim C5AA-C0AA
 with sigma of 0.02
 C027-C02A \\sim C0-C0AA
 with sigma of 0.02
 K1-C024 \\sim K1-C3AA
 with sigma of 0.04
 K1-C027 \\sim K1-C0
 with sigma of 0.04
 O00Y-C021 \\sim O00Z-C5AA
 with sigma of 0.04
 O00Y-C02A \\sim O00Z-C0AA
 with sigma of 0.04
 C021-C027 \\sim C5AA-C0
 with sigma of 0.04
 C024-C027 \\sim C3AA-C0
 with sigma of 0.04
 C024-C02A \\sim C3AA-C0AA
 with sigma of 0.04
 K1-O00P \\sim K1-O00Q
 with sigma of 0.02
 O00P-C022 \\sim O00Q-C7AA
 with sigma of 0.02
 O00P-C026 \\sim O00Q-C6AA
 with sigma of 0.02
 C022-C029 \\sim C7AA-C8AA
 with sigma of 0.02
 C026-C02B \\sim C6AA-C1AA
 with sigma of 0.02
 C029-C02B \\sim C8AA-C1AA
 with sigma of 0.02
 K1-C022 \\sim K1-C7AA
 with sigma of 0.04
 K1-C026 \\sim K1-C6AA
 with sigma of 0.04
 O00P-C029 \\sim O00Q-C8AA
 with sigma of 0.04
 O00P-C02B \\sim O00Q-C1AA
 with sigma of 0.04
 C022-C026 \\sim C7AA-C6AA
 with sigma of 0.04
 C022-C02B \\sim C7AA-C1AA
 with sigma of 0.04
 C026-C029 \\sim C6AA-C8AA
 with sigma of 0.04
4. Uiso/Uaniso restraints and constraints
Uanis(C7AA) = Uanis(C8AA) = Uanis(C1AA) = Uanis(C6AA)
Uanis(C029) = Uanis(C022) = Uanis(C02B) = Uanis(C026)
Uiso(O1) = Uiso(C8)
Uanis(C5AA) = Uanis(C3AA) = Uanis(C0) = Uanis(C0AA)
Uanis(C3BA) = Uanis(C4BA) = Uanis(C44)
Uanis(C15) = Uanis(C10)
5. Others
 Fixed Sof: O00P(0.5) O00Y(0.5) H1BC(0.7) H1BD(0.7) H1AA(0.3) H1AB(0.3)
 C4(0.7) H4A(0.7) H4B(0.7) C5(0.7) H5(0.7) H6BC(0.7) H6BD(0.7) H6AA(0.3)
 H6AB(0.3) C2(0.7) H2A(0.7) C021(0.5) H02A(0.5) H02B(0.5) C022(0.5) H02C(0.5)
 H02D(0.5) C3(0.7) H3A(0.7) H3B(0.7) C024(0.5) H02E(0.5) H02F(0.5) C026(0.5)
 H02G(0.5) H02H(0.5) C027(0.5) H02I(0.5) H02J(0.5) C029(0.5) H02K(0.5)
 H02L(0.5) C02A(0.5) H02M(0.5) H02N(0.5) C02B(0.5) H02O(0.5) H02P(0.5)
 C2AA(0.3) H2AA(0.3) C4AA(0.3) H4AA(0.3) H4AB(0.3) C10(0.3) H10(0.3) C15(0.3)
 H15A(0.3) H15B(0.3) O00Z(0.5) C0(0.5) H0A(0.5) H0B(0.5) C3AA(0.5) H3AA(0.5)
 H3AB(0.5) C0AA(0.5) H0AA(0.5) H0AB(0.5) C5AA(0.5) H5AA(0.5) H5AB(0.5)
 C6AA(0.5) H6AC(0.5) H6AD(0.5) O00Q(0.5) C7AA(0.5) H7AA(0.5) H7AB(0.5)
 C8AA(0.5) H8AA(0.5) H8AB(0.5) C1AA(0.5) H1AC(0.5) H1AD(0.5) O1(0.7) C1BA(0.7)
 H1BA(0.7) H1BB(0.7) C2BA(0.7) H2BA(0.7) H2BB(0.7) C9AA(0.7) H9AA(0.7)
 H9AB(0.7) C0BA(0.7) H0BA(0.7) H0BB(0.7) O5(0.3) C3BA(0.3) H3BA(0.3) H3BB(0.3)
 C4BA(0.3) H4BA(0.3) H4BB(0.3) C8(0.3) H8A(0.3) H8B(0.3) C44(0.3) H44A(0.3)
 H44B(0.3)
6.a Ternary CH refined with riding coordinates:
 C00Q(H00Q), C00T(H00T), C00U(H00U), C013(H013)
6.b Secondary CH2 refined with riding coordinates:
 C1(H1BC,H1BD), C1(H1AA,H1AB), C4(H4A,H4B), C01F(H4,H), C01I(H6,HB), C01J(H7,
 HC), C01K(H8,HD), C01M(H9,HG), C01N(H11,HH), C01O(H12,HI), C01Q(H13,HJ),
 C01R(H14,HK), C01S(H15,HL), C01U(H16,HM), C01X(H17,HR), C021(H02A,H02B),
 C022(H02C,H02D), C024(H02E,H02F), C026(H02G,H02H), C027(H02I,H02J), C029(H02K,
 H02L), C02A(H02M,H02N), C02B(H02O,H02P), C15(H15A,H15B), C0(H0A,H0B),
 C3AA(H3AA,H3AB), C0AA(H0AA,H0AB), C5AA(H5AA,H5AB), C6AA(H6AC,H6AD), C7AA(H7AA,
 H7AB), C8AA(H8AA,H8AB), C1AA(H1AC,H1AD), C1BA(H1BA,H1BB), C2BA(H2BA,H2BB),
 C9AA(H9AA,H9AB), C0BA(H0BA,H0BB), C3BA(H3BA,H3BB), C4BA(H4BA,H4BB), C8(H8A,
 H8B), C44(H44A,H44B)
6.c Aromatic/amide H refined with riding coordinates:
 C00H(H00H), C00I(H00I), C00L(H00L), C011(H011), C014(H014), C015(H015),
 C018(H018), C01A(H01M), C01G(H01W), C5(H5), C2(H2A), C2AA(H2AA), C10(H10)
6.d X=CH2 refined with riding coordinates:
 C6(H6BC,H6BD), C6(H6AA,H6AB), C3(H3A,H3B), C4AA(H4AA,H4AB)
6.e Idealised Me refined as rotating group:
 C00W(H00A,H00B,H00C), C00X(H00D,H00E,H00F), C00Z(H00G,H00J,H00M), C010(H01A,
 H01B,H01C), C016(H01D,H01E,H01F), C017(H01G,H01H,H01I), C019(H01J,H01K,H01L),
 C01B(H01N,H01O,H01P), C01C(H01Q,H01R,H01S), C01D(H01T,H01U,H01V), C01H(H01X,
 H01Y,HA), C01L(H01Z,HE,HF), C01V(H01,HN,HO), C01W(H1,HP,HQ), C01Y(H2,HS,HT),
 C01Z(H3,HU,HV)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Co1 Co 0.34130(2) 0.75588(2) 0.24461(2) 0.01815(7) Uani 1 1 d . . . . .
K1 K 0.86522(4) 0.25648(3) 0.30478(3) 0.02815(11) Uani 1 1 d D . . . .
Si1 Si 0.29221(5) 0.86365(4) 0.12367(3) 0.02766(14) Uani 1 1 d . . . . .
Si2 Si 0.39807(5) 0.67989(4) 0.38422(3) 0.02709(14) Uani 1 1 d . . . . .
O005 O 0.72276(14) 0.17655(11) 0.37064(10) 0.0380(4) Uani 1 1 d . . . . .
O006 O 0.65095(13) 0.21782(12) 0.23858(10) 0.0383(4) Uani 1 1 d . . . . .
N1 N 0.33249(14) 0.76952(11) 0.14717(9) 0.0243(4) Uani 1 1 d . . . . .
N3 N 0.25340(13) 0.81200(12) 0.29038(9) 0.0230(4) Uani 1 1 d . . . . .
O009 O 0.94077(15) 0.18423(13) 0.42118(9) 0.0417(4) Uani 1 1 d . . . . .
N2 N 0.42817(13) 0.69592(11) 0.30515(9) 0.0212(3) Uani 1 1 d . . . . .
O00B O 1.07700(14) 0.30530(13) 0.37822(10) 0.0438(4) Uani 1 1 d . . . . .
O00C O 0.78924(15) 0.33099(12) 0.19008(9) 0.0422(4) Uani 1 1 d . . . . .
O00D O 1.00606(15) 0.34039(12) 0.24350(10) 0.0419(4) Uani 1 1 d . . . . .
C7 C 0.18740(15) 0.85850(14) 0.32381(11) 0.0210(4) Uani 1 1 d . . . . .
C00F C 0.21658(16) 0.95018(14) 0.36078(11) 0.0241(4) Uani 1 1 d . . . . .
C00G C 0.08468(16) 0.81780(14) 0.32398(11) 0.0244(4) Uani 1 1 d . . . . .
C00H C 0.01866(17) 0.86720(16) 0.36018(12) 0.0287(5) Uani 1 1 d . . . . .
H00H H -0.049518 0.840037 0.359336 0.034 Uiso 1 1 calc R U . . .
C00I C 0.04920(17) 0.95489(15) 0.39748(12) 0.0295(5) Uani 1 1 d . . . . .
H00I H 0.003256 0.986928 0.422726 0.035 Uiso 1 1 calc R U . . .
C00J C 0.33646(18) 0.69400(14) 0.09151(11) 0.0264(4) Uani 1 1 d . . . . .
C00K C 0.42216(19) 0.51287(15) 0.22139(12) 0.0279(5) Uani 1 1 d . . . . .
C00L C 0.14780(17) 0.99515(15) 0.39741(12) 0.0281(5) Uani 1 1 d . . . . .
H00L H 0.168922 1.055174 0.423125 0.034 Uiso 1 1 calc R U . . .
C00M C 0.52168(16) 0.66554(14) 0.28682(12) 0.0253(4) Uani 1 1 d . . . . .
C00N C 0.4269(2) 0.68424(15) 0.06138(13) 0.0317(5) Uani 1 1 d . . . . .
C00O C 0.24850(19) 0.62799(14) 0.06399(12) 0.0285(5) Uani 1 1 d . . . . .
O00P O 0.9013(9) 0.1055(6) 0.2195(5) 0.103(4) Uani 0.5 1 d D . P A 3
C00Q C 0.14892(18) 0.63307(15) 0.09401(12) 0.0303(5) Uani 1 1 d . . . . .
H00Q H 0.159363 0.689444 0.132259 0.036 Uiso 1 1 calc R U . . .
C00R C 0.62011(17) 0.81865(16) 0.35150(14) 0.0320(5) Uani 1 1 d . . . . .
C00S C 0.52129(18) 0.57775(15) 0.24765(13) 0.0295(5) Uani 1 1 d . . . . .
C00T C 0.04690(17) 0.72271(15) 0.28234(13) 0.0301(5) Uani 1 1 d . . . . .
H00T H 0.107955 0.697204 0.265073 0.036 Uiso 1 1 calc R U . . .
C00U C 0.32064(17) 0.99826(15) 0.35748(13) 0.0293(5) Uani 1 1 d . . . . .
H00U H 0.352105 0.957038 0.322555 0.035 Uiso 1 1 calc R U . . .
C00V C 0.61791(17) 0.72316(16) 0.31102(14) 0.0324(5) Uani 1 1 d . . . . .
C00W C 0.1297(2) 0.55615(17) 0.12935(13) 0.0360(5) Uani 1 1 d . . . . .
H00A H 0.124201 0.499702 0.093881 0.054 Uiso 1 1 calc R U . . .
H00B H 0.064193 0.560118 0.146839 0.054 Uiso 1 1 calc R U . . .
H00C H 0.188401 0.559495 0.169900 0.054 Uiso 1 1 calc R U . . .
C00X C 0.1670(2) 0.89462(16) 0.14956(14) 0.0358(5) Uani 1 1 d . . . . .
H00D H 0.110624 0.845337 0.127466 0.054 Uiso 1 1 calc R U . . .
H00E H 0.148374 0.947260 0.132675 0.054 Uiso 1 1 calc R U . . .
H00F H 0.176205 0.907499 0.202100 0.054 Uiso 1 1 calc R U . . .
O00Y O 0.8332(9) 0.4028(4) 0.3927(5) 0.062(4) Uani 0.5 1 d D . P A 3
C00Z C 0.4198(2) 0.44222(17) 0.26501(14) 0.0379(6) Uani 1 1 d . . . . .
H00G H 0.478084 0.407282 0.259346 0.057 Uiso 1 1 calc R U . . .
H00J H 0.352943 0.403081 0.247539 0.057 Uiso 1 1 calc R U . . .
H00M H 0.426786 0.471137 0.316030 0.057 Uiso 1 1 calc R U . . .
C010 C 0.00935(19) 0.66582(16) 0.32968(15) 0.0369(6) Uani 1 1 d . . . . .
H01A H 0.065803 0.668801 0.371540 0.055 Uiso 1 1 calc R U . . .
H01B H -0.009602 0.604185 0.301817 0.055 Uiso 1 1 calc R U . . .
H01C H -0.052229 0.687979 0.346043 0.055 Uiso 1 1 calc R U . . .
C011 C 0.4260(2) 0.61049(17) 0.00537(13) 0.0382(6) Uani 1 1 d . . . . .
H011 H 0.486777 0.604083 -0.014532 0.046 Uiso 1 1 calc R U . . .
C1 C 0.3961(2) 0.96305(16) 0.16610(13) 0.0350(5) Uani 1 1 d . . . . .
H1BC H 0.407973 0.973284 0.219172 0.042 Uiso 0.7 1 calc R U P B 1
H1BD H 0.462983 0.949213 0.151895 0.042 Uiso 0.7 1 calc R U P B 1
H1AA H 0.358988 1.016165 0.167916 0.042 Uiso 0.3 1 calc R U P C -1
H1AB H 0.421581 0.960228 0.216692 0.042 Uiso 0.3 1 calc R U P C -1
C013 C 0.5245(2) 0.75165(17) 0.08775(15) 0.0390(6) Uani 1 1 d . . . . .
H013 H 0.511698 0.798131 0.128547 0.047 Uiso 1 1 calc R U . . .
C014 C 0.3403(2) 0.54709(16) -0.02183(13) 0.0403(6) Uani 1 1 d . . . . .
H014 H 0.341378 0.497901 -0.060298 0.048 Uiso 1 1 calc R U . . .
C015 C 0.2520(2) 0.55585(16) 0.00762(12) 0.0360(6) Uani 1 1 d . . . . .
H015 H 0.192551 0.511900 -0.010857 0.043 Uiso 1 1 calc R U . . .
C016 C 0.5998(2) 0.87766(17) 0.29890(16) 0.0442(6) Uani 1 1 d . . . . .
H01D H 0.657525 0.878781 0.273281 0.066 Uiso 1 1 calc R U . . .
H01E H 0.595349 0.937960 0.325429 0.066 Uiso 1 1 calc R U . . .
H01F H 0.533508 0.854257 0.264116 0.066 Uiso 1 1 calc R U . . .
C017 C 0.4058(3) 0.46767(17) 0.14128(14) 0.0439(6) Uani 1 1 d . . . . .
H01G H 0.411236 0.512799 0.113698 0.066 Uiso 1 1 calc R U . . .
H01H H 0.335961 0.432976 0.124772 0.066 Uiso 1 1 calc R U . . .
H01I H 0.459663 0.428288 0.134075 0.066 Uiso 1 1 calc R U . . .
C018 C 0.6163(2) 0.54975(17) 0.23362(16) 0.0417(6) Uani 1 1 d . . . . .
H018 H 0.616484 0.490719 0.207318 0.050 Uiso 1 1 calc R U . . .
C019 C 0.3754(2) 0.7815(2) 0.44804(14) 0.0457(7) Uani 1 1 d . . . . .
H01J H 0.436630 0.826667 0.458595 0.069 Uiso 1 1 calc R U . . .
H01K H 0.365045 0.766652 0.492836 0.069 Uiso 1 1 calc R U . . .
H01L H 0.312794 0.804392 0.426169 0.069 Uiso 1 1 calc R U . . .
C01A C 0.7099(2) 0.69143(19) 0.29533(18) 0.0464(7) Uani 1 1 d . . . . .
H01M H 0.774436 0.729783 0.311405 0.056 Uiso 1 1 calc R U . . .
C01B C 0.2781(2) 0.59857(19) 0.36751(15) 0.0426(6) Uani 1 1 d . . . . .
H01N H 0.222448 0.612905 0.332002 0.064 Uiso 1 1 calc R U . . .
H01O H 0.254300 0.601347 0.412673 0.064 Uiso 1 1 calc R U . . .
H01P H 0.294550 0.538678 0.349061 0.064 Uiso 1 1 calc R U . . .
C01C C -0.0387(2) 0.71921(18) 0.21603(14) 0.0393(6) Uani 1 1 d . . . . .
H01Q H -0.099071 0.745325 0.231240 0.059 Uiso 1 1 calc R U . . .
H01R H -0.061021 0.657390 0.189400 0.059 Uiso 1 1 calc R U . . .
H01S H -0.011102 0.752687 0.184914 0.059 Uiso 1 1 calc R U . . .
C01D C 0.0534(2) 0.63653(18) 0.03600(14) 0.0414(6) Uani 1 1 d . . . . .
H01T H 0.065953 0.688287 0.016417 0.062 Uiso 1 1 calc R U . . .
H01U H -0.008917 0.641057 0.057189 0.062 Uiso 1 1 calc R U . . .
H01V H 0.041964 0.582444 -0.002778 0.062 Uiso 1 1 calc R U . . .
C4 C 0.5200(4) 0.6430(4) 0.4364(3) 0.0300(11) Uani 0.7 1 d . . P D 1
H4A H 0.540478 0.591200 0.404822 0.036 Uiso 0.7 1 calc R U P D 1
H4B H 0.578944 0.691560 0.448969 0.036 Uiso 0.7 1 calc R U P D 1
C01F C 0.8642(2) 0.1643(2) 0.46100(14) 0.0455(7) Uani 1 1 d . . . . .
H4 H 0.849398 0.219863 0.491298 0.055 Uiso 1 1 calc R U . . .
H H 0.891647 0.126378 0.493083 0.055 Uiso 1 1 calc R U . . .
C01G C 0.7091(2) 0.60574(19) 0.25705(19) 0.0533(8) Uani 1 1 d . . . . .
H01W H 0.772634 0.585466 0.246907 0.064 Uiso 1 1 calc R U . . .
C01H C 0.2666(3) 0.85075(18) 0.02383(14) 0.0451(7) Uani 1 1 d . . . . .
H01X H 0.328355 0.831827 0.005748 0.068 Uiso 1 1 calc R U . . .
H01Y H 0.252557 0.907592 0.012734 0.068 Uiso 1 1 calc R U . . .
HA H 0.205551 0.806088 0.000708 0.068 Uiso 1 1 calc R U . . .
C01I C 0.7663(2) 0.11786(17) 0.41054(15) 0.0422(6) Uani 1 1 d . . . . .
H6 H 0.781753 0.064795 0.377552 0.051 Uiso 1 1 calc R U . . .
HB H 0.715592 0.098346 0.437709 0.051 Uiso 1 1 calc R U . . .
C01J C 0.8649(3) 0.3377(2) 0.14726(15) 0.0521(7) Uani 1 1 d . . . . .
H7 H 0.838065 0.368021 0.109074 0.062 Uiso 1 1 calc R U . . .
HC H 0.878066 0.277758 0.123846 0.062 Uiso 1 1 calc R U . . .
C01K C 0.6906(2) 0.2869(2) 0.14836(15) 0.0501(7) Uani 1 1 d . . . . .
H8 H 0.699256 0.227357 0.120990 0.060 Uiso 1 1 calc R U . . .
HD H 0.661576 0.320999 0.113515 0.060 Uiso 1 1 calc R U . . .
C01L C 0.6206(2) 0.7107(2) 0.11630(17) 0.0485(7) Uani 1 1 d . . . . .
H01Z H 0.605584 0.680891 0.153340 0.073 Uiso 1 1 calc R U . . .
HE H 0.680197 0.757413 0.137271 0.073 Uiso 1 1 calc R U . . .
HF H 0.637830 0.667562 0.076707 0.073 Uiso 1 1 calc R U . . .
C01M C 1.1131(2) 0.2463(2) 0.42078(17) 0.0538(8) Uani 1 1 d . . . . .
H9 H 1.182267 0.272225 0.452459 0.065 Uiso 1 1 calc R U . . .
HG H 1.122038 0.189597 0.389099 0.065 Uiso 1 1 calc R U . . .
C01N C 0.5841(2) 0.2059(2) 0.28567(18) 0.0558(8) Uani 1 1 d . . . . .
H11 H 0.511523 0.184222 0.257834 0.067 Uiso 1 1 calc R U . . .
HH H 0.583113 0.263112 0.319746 0.067 Uiso 1 1 calc R U . . .
C01O C 0.6234(2) 0.1407(2) 0.32579(18) 0.0531(8) Uani 1 1 d . . . . .
H12 H 0.573342 0.126875 0.355423 0.064 Uiso 1 1 calc R U . . .
HI H 0.629590 0.085119 0.291561 0.064 Uiso 1 1 calc R U . . .
C5 C 0.5029(3) 0.6189(3) 0.50336(19) 0.0303(8) Uani 0.7 1 d . . P D 1
H5 H 0.456948 0.566676 0.499161 0.036 Uiso 0.7 1 calc R U P D 1
C01Q C 1.0358(2) 0.2297(2) 0.46571(16) 0.0525(7) Uani 1 1 d . . . . .
H13 H 1.065051 0.193952 0.499222 0.063 Uiso 1 1 calc R U . . .
HJ H 1.022856 0.286792 0.494698 0.063 Uiso 1 1 calc R U . . .
C01R C 1.1467(2) 0.3230(2) 0.33325(18) 0.0547(8) Uani 1 1 d . . . . .
H14 H 1.156721 0.266796 0.301407 0.066 Uiso 1 1 calc R U . . .
HK H 1.216110 0.351220 0.363383 0.066 Uiso 1 1 calc R U . . .
C01S C 0.9639(3) 0.3886(2) 0.19343(17) 0.0540(8) Uani 1 1 d . . . . .
H15 H 1.014843 0.398403 0.163326 0.065 Uiso 1 1 calc R U . . .
HL H 0.949904 0.447155 0.219365 0.065 Uiso 1 1 calc R U . . .
C6 C 0.5488(3) 0.6667(2) 0.56896(15) 0.0558(8) Uani 1 1 d . . . . .
H6BC H 0.595135 0.719223 0.574592 0.067 Uiso 0.7 1 calc R U P D 1
H6BD H 0.535325 0.648478 0.610201 0.067 Uiso 0.7 1 calc R U P D 1
H6AA H 0.497060 0.628769 0.580153 0.067 Uiso 0.3 1 calc R U P D -1
H6AB H 0.599129 0.706235 0.606616 0.067 Uiso 0.3 1 calc R U P D -1
C01U C 0.6178(2) 0.2785(2) 0.19686(17) 0.0528(7) Uani 1 1 d . . . . .
H16 H 0.616927 0.337073 0.229037 0.063 Uiso 1 1 calc R U . . .
HM H 0.545646 0.257117 0.168096 0.063 Uiso 1 1 calc R U . . .
C01V C 0.7212(2) 0.8566(2) 0.40788(18) 0.0520(8) Uani 1 1 d . . . . .
H01 H 0.735431 0.816858 0.440254 0.078 Uiso 1 1 calc R U . . .
HN H 0.713055 0.915158 0.435805 0.078 Uiso 1 1 calc R U . . .
HO H 0.779964 0.861993 0.383696 0.078 Uiso 1 1 calc R U . . .
C01W C 0.3068(2) 1.0803(2) 0.3296(2) 0.0578(9) Uani 1 1 d . . . . .
H1 H 0.254134 1.065333 0.284225 0.087 Uiso 1 1 calc R U . . .
HP H 0.373950 1.104034 0.321189 0.087 Uiso 1 1 calc R U . . .
HQ H 0.283259 1.124955 0.365096 0.087 Uiso 1 1 calc R U . . .
C01X C 1.1017(2) 0.3832(2) 0.28877(18) 0.0555(8) Uani 1 1 d . . . . .
H17 H 1.089880 0.438813 0.320531 0.067 Uiso 1 1 calc R U . . .
HR H 1.151552 0.398360 0.259425 0.067 Uiso 1 1 calc R U . . .
C01Y C 0.5473(3) 0.7980(3) 0.0293(2) 0.0726(11) Uani 1 1 d . . . . .
H2 H 0.560456 0.753964 -0.011473 0.109 Uiso 1 1 calc R U . . .
HS H 0.609384 0.842424 0.049164 0.109 Uiso 1 1 calc R U . . .
HT H 0.486652 0.827010 0.012830 0.109 Uiso 1 1 calc R U . . .
C01Z C 0.3978(3) 1.0205(3) 0.4290(2) 0.0873(15) Uani 1 1 d . . . . .
H3 H 0.371061 1.063234 0.464128 0.131 Uiso 1 1 calc R U . . .
HU H 0.465710 1.046228 0.423281 0.131 Uiso 1 1 calc R U . . .
HV H 0.406647 0.966350 0.446146 0.131 Uiso 1 1 calc R U . . .
C2 C 0.3690(4) 1.0444(3) 0.1458(2) 0.0483(10) Uani 0.7 1 d . . P E 1
H2A H 0.318269 1.073372 0.168191 0.058 Uiso 0.7 1 calc R U P E 1
C021 C 0.7616(8) 0.5046(4) 0.4700(5) 0.060(2) Uani 0.5 1 d D . P A 3
H02A H 0.684679 0.500420 0.466393 0.072 Uiso 0.5 1 calc R U P A 3
H02B H 0.797102 0.540779 0.518377 0.072 Uiso 0.5 1 calc R U P A 3
C022 C 0.8256(9) 0.0639(6) 0.1546(6) 0.0926(18) Uani 0.5 1 d D . P A 3
H02C H 0.856844 0.060631 0.111669 0.111 Uiso 0.5 1 calc R U P A 3
H02D H 0.763662 0.096588 0.149384 0.111 Uiso 0.5 1 calc R U P A 3
C3 C 0.4067(5) 1.0820(4) 0.1001(3) 0.0819(18) Uani 0.7 1 d . . P E 1
H3A H 0.457595 1.055952 0.076122 0.098 Uiso 0.7 1 calc R U P E 1
H3B H 0.383012 1.135361 0.091015 0.098 Uiso 0.7 1 calc R U P E 1
C024 C 0.7963(5) 0.4129(3) 0.4577(3) 0.0364(11) Uani 0.5 1 d D . P A 3
H02E H 0.853037 0.408841 0.498089 0.044 Uiso 0.5 1 calc R U P A 3
H02F H 0.736633 0.366978 0.452711 0.044 Uiso 0.5 1 calc R U P A 3
C026 C 0.9509(8) 0.0362(6) 0.2440(6) 0.0926(18) Uani 0.5 1 d D . P A 3
H02G H 1.019521 0.032534 0.229561 0.111 Uiso 0.5 1 calc R U P A 3
H02H H 0.963586 0.048450 0.297202 0.111 Uiso 0.5 1 calc R U P A 3
C027 C 0.8453(5) 0.4850(4) 0.3747(3) 0.0409(12) Uani 0.5 1 d D . P A 3
H02I H 0.816510 0.478153 0.322641 0.049 Uiso 0.5 1 calc R U P A 3
H02J H 0.920651 0.508927 0.385434 0.049 Uiso 0.5 1 calc R U P A 3
C029 C 0.7964(8) -0.0254(6) 0.1643(6) 0.0926(18) Uani 0.5 1 d D . P A 3
H02K H 0.732615 -0.026848 0.184830 0.111 Uiso 0.5 1 calc R U P A 3
H02L H 0.782203 -0.069807 0.117564 0.111 Uiso 0.5 1 calc R U P A 3
C02A C 0.7897(8) 0.5432(4) 0.4164(4) 0.076(3) Uani 0.5 1 d D . P A 3
H02M H 0.834405 0.600569 0.438970 0.091 Uiso 0.5 1 calc R U P A 3
H02N H 0.725659 0.554523 0.385072 0.091 Uiso 0.5 1 calc R U P A 3
C02B C 0.8848(10) -0.0442(6) 0.2131(6) 0.0926(18) Uani 0.5 1 d D . P A 3
H02O H 0.860432 -0.068333 0.251085 0.111 Uiso 0.5 1 calc R U P A 3
H02P H 0.922860 -0.088254 0.186772 0.111 Uiso 0.5 1 calc R U P A 3
C2AA C 0.4875(7) 0.9810(5) 0.1387(4) 0.0352(18) Uani 0.3 1 d . . P E -1
H2AA H 0.545798 0.951627 0.153633 0.042 Uiso 0.3 1 calc R U P E -1
C4AA C 0.5015(9) 1.0337(7) 0.0949(5) 0.050(2) Uani 0.3 1 d . . P E -1
H4AA H 0.446140 1.064938 0.078082 0.060 Uiso 0.3 1 calc R U P E -1
H4AB H 0.566671 1.040074 0.080470 0.060 Uiso 0.3 1 calc R U P E -1
C10 C 0.5509(11) 0.6646(10) 0.5009(6) 0.066(3) Uani 0.3 1 d . . P D -1
H10 H 0.606366 0.705806 0.497494 0.079 Uiso 0.3 1 calc R U P D -1
C15 C 0.4948(15) 0.6192(15) 0.4332(11) 0.066(3) Uani 0.3 1 d . . P D -1
H15A H 0.456042 0.564387 0.438190 0.079 Uiso 0.3 1 calc R U P D -1
H15B H 0.545673 0.601060 0.402744 0.079 Uiso 0.3 1 calc R U P D -1
O00Z O 0.8291(10) 0.4068(6) 0.3891(7) 0.111(6) Uani 0.5 1 d D . P A -3
C0 C 0.9111(8) 0.4706(9) 0.4251(7) 0.147(3) Uani 0.5 1 d D . P A -3
H0A H 0.922111 0.514638 0.396637 0.177 Uiso 0.5 1 calc R U P A -3
H0B H 0.976885 0.444139 0.436144 0.177 Uiso 0.5 1 calc R U P A -3
C3AA C 0.7342(7) 0.4377(8) 0.4045(8) 0.147(3) Uani 0.5 1 d D . P A -3
H3AA H 0.692931 0.393448 0.421379 0.177 Uiso 0.5 1 calc R U P A -3
H3AB H 0.690474 0.450327 0.361349 0.177 Uiso 0.5 1 calc R U P A -3
C0AA C 0.8787(7) 0.5098(9) 0.4890(7) 0.147(3) Uani 0.5 1 d D . P A -3
H0AA H 0.920620 0.568030 0.513188 0.177 Uiso 0.5 1 calc R U P A -3
H0AB H 0.884195 0.470782 0.523031 0.177 Uiso 0.5 1 calc R U P A -3
C5AA C 0.7704(10) 0.5193(10) 0.4618(9) 0.147(3) Uani 0.5 1 d D . P A -3
H5AA H 0.765184 0.572671 0.442168 0.177 Uiso 0.5 1 calc R U P A -3
H5AB H 0.729142 0.523133 0.499892 0.177 Uiso 0.5 1 calc R U P A -3
C6AA C 0.9707(6) 0.0650(5) 0.2327(6) 0.0712(13) Uani 0.5 1 d D . P A -3
H6AC H 1.035359 0.084668 0.217896 0.085 Uiso 0.5 1 calc R U P A -3
H6AD H 0.984992 0.078626 0.286033 0.085 Uiso 0.5 1 calc R U P A -3
O00Q O 0.8864(5) 0.1107(4) 0.2064(4) 0.054(2) Uani 0.5 1 d D . P A -3
C7AA C 0.7949(6) 0.0424(6) 0.1682(5) 0.0712(13) Uani 0.5 1 d D . P A -3
H7AA H 0.786447 0.030508 0.115224 0.085 Uiso 0.5 1 calc R U P A -3
H7AB H 0.728667 0.059391 0.181756 0.085 Uiso 0.5 1 calc R U P A -3
C8AA C 0.8302(6) -0.0359(5) 0.1971(6) 0.0712(13) Uani 0.5 1 d D . P A -3
H8AA H 0.811485 -0.033959 0.244372 0.085 Uiso 0.5 1 calc R U P A -3
H8AB H 0.796675 -0.092600 0.163214 0.085 Uiso 0.5 1 calc R U P A -3
C1AA C 0.9422(6) -0.0274(5) 0.2043(5) 0.0712(13) Uani 0.5 1 d D . P A -3
H1AC H 0.975368 -0.061573 0.237826 0.085 Uiso 0.5 1 calc R U P A -3
H1AD H 0.961586 -0.047155 0.157105 0.085 Uiso 0.5 1 calc R U P A -3
O1 O -0.1370(5) 0.7260(4) -0.1068(3) 0.1498(18) Uiso 0.7 1 d . . P F 4
C1BA C -0.1420(6) 0.8189(6) -0.0068(5) 0.099(3) Uani 0.7 1 d . . P G 2
H1BA H -0.094364 0.809476 0.036141 0.119 Uiso 0.7 1 calc R U P G 2
H1BB H -0.196905 0.853709 0.009300 0.119 Uiso 0.7 1 calc R U P G 2
C2BA C -0.1866(5) 0.7399(5) -0.0517(4) 0.095(2) Uani 0.7 1 d . . P G 2
H2BA H -0.178872 0.691791 -0.026057 0.113 Uiso 0.7 1 calc R U P G 2
H2BB H -0.262472 0.741362 -0.069674 0.113 Uiso 0.7 1 calc R U P G 2
C9AA C -0.1095(8) 0.8134(6) -0.1243(5) 0.113(3) Uani 0.7 1 d . . P G 2
H9AA H -0.051941 0.810930 -0.151042 0.136 Uiso 0.7 1 calc R U P G 2
H9AB H -0.171314 0.832261 -0.152514 0.136 Uiso 0.7 1 calc R U P G 2
C0BA C -0.0760(8) 0.8715(6) -0.0519(5) 0.121(3) Uani 0.7 1 d . . P G 2
H0BA H -0.096003 0.931706 -0.050346 0.145 Uiso 0.7 1 calc R U P G 2
H0BB H 0.000858 0.875734 -0.033773 0.145 Uiso 0.7 1 calc R U P G 2
O5 O -0.1938(9) 0.7505(9) -0.1513(6) 0.099(3) Uani 0.3 1 d . . P G -2
C3BA C -0.2628(19) 0.7970(15) -0.1420(13) 0.140(5) Uani 0.3 1 d . . P G -2
H3BA H -0.328568 0.762580 -0.139641 0.168 Uiso 0.3 1 calc R U P G -2
H3BB H -0.277524 0.831053 -0.179397 0.168 Uiso 0.3 1 calc R U P G -2
C4BA C -0.2038(18) 0.8598(15) -0.0642(13) 0.140(5) Uani 0.3 1 d . . P G -2
H4BA H -0.189932 0.921044 -0.069827 0.168 Uiso 0.3 1 calc R U P G -2
H4BB H -0.252405 0.860911 -0.030760 0.168 Uiso 0.3 1 calc R U P G -2
C8 C -0.1370(5) 0.7260(4) -0.1068(3) 0.1498(18) Uiso 0.3 1 d . . P . .
H8A H -0.074682 0.705299 -0.124277 0.180 Uiso 0.3 1 calc R U P G -2
H8B H -0.173743 0.677479 -0.091682 0.180 Uiso 0.3 1 calc R U P G -2
C44 C -0.098(3) 0.832(2) -0.0285(19) 0.140(5) Uani 0.3 1 d . . P G -2
H44A H -0.095566 0.822052 0.020165 0.168 Uiso 0.3 1 calc R U P G -2
H44B H -0.033962 0.870305 -0.029965 0.168 Uiso 0.3 1 calc R U P G -2
H00K H 0.3648(19) 0.5446(16) 0.2273(13) 0.027(6) Uiso 1 1 d . . . . .
H00R H 0.563(2) 0.8188(17) 0.3761(14) 0.033(7) Uiso 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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
N3 Co1 N1 114.55(8) . . ?
N3 Co1 N2 111.09(8) . . ?
N2 Co1 N1 134.35(7) . . ?
O005 K1 O00B 119.14(6) . . ?
O006 K1 O005 59.73(5) . . ?
O006 K1 O00B 176.00(6) . . ?
O009 K1 O005 60.27(5) . . ?
O009 K1 O006 118.85(6) . . ?
O009 K1 O00B 61.01(6) . . ?
O00C K1 O005 119.57(6) . . ?
O00C K1 O006 61.19(5) . . ?
O00C K1 O009 179.10(6) . . ?
O00C K1 O00B 118.88(6) . . ?
O00D K1 O005 178.07(6) . . ?
O00D K1 O006 120.88(6) . . ?
O00D K1 O009 119.50(6) . . ?
O00D K1 O00B 60.11(6) . . ?
O00D K1 O00C 60.63(6) . . ?
O00P K1 O005 96.6(3) . . ?
O00P K1 O006 89.4(2) . . ?
O00P K1 O009 86.6(2) . . ?
O00P K1 O00B 94.6(2) . . ?
O00P K1 O00C 94.3(2) . . ?
O00P K1 O00D 85.3(3) . . ?
O00P K1 O00Q 6.8(3) . . ?
O00Y K1 O005 82.59(15) . . ?
O00Y K1 O006 91.9(3) . . ?
O00Y K1 O009 91.3(2) . . ?
O00Y K1 O00B 84.2(3) . . ?
O00Y K1 O00C 87.8(2) . . ?
O00Y K1 O00D 95.52(15) . . ?
O00Y K1 O00P 177.9(3) . . ?
O00Y K1 O00Z 2.3(5) . . ?
O00Y K1 O00Q 175.3(3) . . ?
O00Z K1 O005 83.5(3) . . ?
O00Z K1 O006 90.5(3) . . ?
O00Z K1 O009 93.6(3) . . ?
O00Z K1 O00B 85.5(3) . . ?
O00Z K1 O00C 85.5(3) . . ?
O00Z K1 O00D 94.6(3) . . ?
O00Z K1 O00P 179.8(4) . . ?
O00Z K1 O00Q 173.0(4) . . ?
O00Q K1 O005 98.15(14) . . ?
O00Q K1 O006 84.53(15) . . ?
O00Q K1 O009 93.08(19) . . ?
O00Q K1 O00B 99.47(15) . . ?
O00Q K1 O00C 87.82(19) . . ?
O00Q K1 O00D 83.76(14) . . ?
N1 Si1 C00X 114.73(10) . . ?
N1 Si1 C1 111.09(11) . . ?
N1 Si1 C01H 111.57(11) . . ?
C00X Si1 C1 106.99(12) . . ?
C00X Si1 C01H 104.64(13) . . ?
C01H Si1 C1 107.35(12) . . ?
N2 Si2 C019 115.56(12) . . ?
N2 Si2 C01B 111.98(11) . . ?
N2 Si2 C4 106.85(16) . . ?
N2 Si2 C15 113.3(7) . . ?
C019 Si2 C4 103.68(19) . . ?
C019 Si2 C15 109.7(6) . . ?
C01B Si2 C019 106.20(13) . . ?
C01B Si2 C4 112.40(18) . . ?
C01B Si2 C15 98.6(7) . . ?
C15 Si2 C4 13.9(7) . . ?
C01I O005 K1 113.88(14) . . ?
C01I O005 C01O 112.7(2) . . ?
C01O O005 K1 115.38(15) . . ?
C01N O006 K1 114.30(16) . . ?
C01N O006 C01U 112.5(2) . . ?
C01U O006 K1 112.23(16) . . ?
Si1 N1 Co1 120.56(9) . . ?
C00J N1 Co1 119.08(14) . . ?
C00J N1 Si1 118.90(14) . . ?
C7 N3 Co1 176.95(16) . . ?
C01F O009 K1 114.86(15) . . ?
C01Q O009 K1 114.28(17) . . ?
C01Q O009 C01F 112.8(2) . . ?
Si2 N2 Co1 121.55(9) . . ?
C00M N2 Co1 120.67(14) . . ?
C00M N2 Si2 117.76(14) . . ?
C01M O00B K1 112.87(16) . . ?
C01M O00B C01R 112.8(2) . . ?
C01R O00B K1 113.86(17) . . ?
C01J O00C K1 111.36(17) . . ?
C01K O00C K1 112.78(15) . . ?
C01K O00C C01J 112.2(2) . . ?
C01S O00D K1 116.90(16) . . ?
C01X O00D K1 117.36(16) . . ?
C01X O00D C01S 112.9(2) . . ?
N3 C7 C00F 121.45(18) . . ?
N3 C7 C00G 120.84(19) . . ?
C00F C7 C00G 117.71(18) . . ?
C7 C00F C00U 119.85(18) . . ?
C00L C00F C7 119.78(19) . . ?
C00L C00F C00U 120.3(2) . . ?
C7 C00G C00T 120.20(18) . . ?
C00H C00G C7 119.6(2) . . ?
C00H C00G C00T 120.18(19) . . ?
C00G C00H H00H 119.0 . . ?
C00I C00H C00G 122.0(2) . . ?
C00I C00H H00H 119.0 . . ?
C00H C00I H00I 120.5 . . ?
C00H C00I C00L 119.01(19) . . ?
C00L C00I H00I 120.5 . . ?
C00N C00J N1 121.2(2) . . ?
C00O C00J N1 120.20(19) . . ?
C00O C00J C00N 118.6(2) . . ?
C00S C00K C00Z 112.2(2) . . ?
C00S C00K C017 112.1(2) . . ?
C00S C00K H00K 108.0(15) . . ?
C00Z C00K H00K 107.4(15) . . ?
C017 C00K C00Z 109.5(2) . . ?
C017 C00K H00K 107.4(15) . . ?
C00F C00L H00L 119.1 . . ?
C00I C00L C00F 121.8(2) . . ?
C00I C00L H00L 119.1 . . ?
C00S C00M N2 121.08(19) . . ?
C00S C00M C00V 119.35(19) . . ?
C00V C00M N2 119.52(19) . . ?
C00J C00N C013 122.0(2) . . ?
C011 C00N C00J 119.1(2) . . ?
C011 C00N C013 118.9(2) . . ?
C00J C00O C00Q 121.78(19) . . ?
C015 C00O C00J 119.6(2) . . ?
C015 C00O C00Q 118.6(2) . . ?
C022 O00P K1 119.5(7) . . ?
C022 O00P C7AA 22.3(6) . . ?
C026 O00P K1 125.5(8) . . ?
C026 O00P C022 106.6(7) . . ?
C026 O00P C7AA 96.6(7) . . ?
C6AA O00P K1 125.9(8) . . ?
C6AA O00P C022 114.3(9) . . ?
C6AA O00P C026 24.3(7) . . ?
C6AA O00P C7AA 112.6(7) . . ?
C7AA O00P K1 114.9(6) . . ?
C00O C00Q H00Q 107.6 . . ?
C00O C00Q C00W 111.3(2) . . ?
C00O C00Q C01D 111.46(19) . . ?
C00W C00Q H00Q 107.6 . . ?
C01D C00Q H00Q 107.6 . . ?
C01D C00Q C00W 111.1(2) . . ?
C00V C00R C016 110.4(2) . . ?
C00V C00R C01V 114.4(2) . . ?
C00V C00R H00R 106.0(15) . . ?
C016 C00R C01V 109.9(2) . . ?
C016 C00R H00R 108.2(16) . . ?
C01V C00R H00R 107.7(16) . . ?
C00M C00S C00K 121.99(19) . . ?
C018 C00S C00K 119.0(2) . . ?
C018 C00S C00M 119.0(2) . . ?
C00G C00T H00T 107.6 . . ?
C00G C00T C010 111.99(19) . . ?
C00G C00T C01C 110.8(2) . . ?
C010 C00T H00T 107.6 . . ?
C01C C00T H00T 107.6 . . ?
C01C C00T C010 111.1(2) . . ?
C00F C00U H00U 107.2 . . ?
C01W C00U C00F 112.2(2) . . ?
C01W C00U H00U 107.2 . . ?
C01W C00U C01Z 110.5(3) . . ?
C01Z C00U C00F 112.3(2) . . ?
C01Z C00U H00U 107.2 . . ?
C00M C00V C00R 120.44(18) . . ?
C01A C00V C00M 119.0(2) . . ?
C01A C00V C00R 120.5(2) . . ?
C00Q C00W H00A 109.5 . . ?
C00Q C00W H00B 109.5 . . ?
C00Q C00W H00C 109.5 . . ?
H00A C00W H00B 109.5 . . ?
H00A C00W H00C 109.5 . . ?
H00B C00W H00C 109.5 . . ?
Si1 C00X H00D 109.5 . . ?
Si1 C00X H00E 109.5 . . ?
Si1 C00X H00F 109.5 . . ?
H00D C00X H00E 109.5 . . ?
H00D C00X H00F 109.5 . . ?
H00E C00X H00F 109.5 . . ?
C024 O00Y K1 129.4(4) . . ?
C024 O00Y C3AA 54.9(7) . . ?
C027 O00Y K1 120.4(4) . . ?
C027 O00Y C024 110.0(5) . . ?
C027 O00Y C3AA 78.2(8) . . ?
C0 O00Y K1 122.3(6) . . ?
C0 O00Y C024 89.9(8) . . ?
C0 O00Y C027 53.8(8) . . ?
C0 O00Y C3AA 105.9(7) . . ?
C3AA O00Y K1 130.5(7) . . ?
C00K C00Z H00G 109.5 . . ?
C00K C00Z H00J 109.5 . . ?
C00K C00Z H00M 109.5 . . ?
H00G C00Z H00J 109.5 . . ?
H00G C00Z H00M 109.5 . . ?
H00J C00Z H00M 109.5 . . ?
C00T C010 H01A 109.5 . . ?
C00T C010 H01B 109.5 . . ?
C00T C010 H01C 109.5 . . ?
H01A C010 H01B 109.5 . . ?
H01A C010 H01C 109.5 . . ?
H01B C010 H01C 109.5 . . ?
C00N C011 H011 118.9 . . ?
C014 C011 C00N 122.2(2) . . ?
C014 C011 H011 118.9 . . ?
Si1 C1 H1BC 108.8 . . ?
Si1 C1 H1BD 108.8 . . ?
Si1 C1 H1AA 106.3 . . ?
Si1 C1 H1AB 106.3 . . ?
H1BC C1 H1BD 107.7 . . ?
H1BC C1 H1AA 90.3 . . ?
H1BC C1 H1AB 16.4 . . ?
H1BD C1 H1AA 132.1 . . ?
H1BD C1 H1AB 93.8 . . ?
H1AA C1 H1AB 106.4 . . ?
C2 C1 Si1 113.9(2) . . ?
C2 C1 H1BC 108.8 . . ?
C2 C1 H1BD 108.8 . . ?
C2 C1 H1AA 25.0 . . ?
C2 C1 H1AB 122.9 . . ?
C2AA C1 Si1 124.0(4) . . ?
C2AA C1 H1BC 115.2 . . ?
C2AA C1 H1BD 25.9 . . ?
C2AA C1 H1AA 106.3 . . ?
C2AA C1 H1AB 106.3 . . ?
C2AA C1 C2 83.0(4) . . ?
C00N C013 H013 107.6 . . ?
C00N C013 C01L 112.0(2) . . ?
C00N C013 C01Y 112.3(2) . . ?
C01L C013 H013 107.6 . . ?
C01L C013 C01Y 109.6(2) . . ?
C01Y C013 H013 107.6 . . ?
C011 C014 H014 120.5 . . ?
C011 C014 C015 118.9(2) . . ?
C015 C014 H014 120.5 . . ?
C00O C015 H015 119.3 . . ?
C014 C015 C00O 121.5(2) . . ?
C014 C015 H015 119.3 . . ?
C00R C016 H01D 109.5 . . ?
C00R C016 H01E 109.5 . . ?
C00R C016 H01F 109.5 . . ?
H01D C016 H01E 109.5 . . ?
H01D C016 H01F 109.5 . . ?
H01E C016 H01F 109.5 . . ?
C00K C017 H01G 109.5 . . ?
C00K C017 H01H 109.5 . . ?
C00K C017 H01I 109.5 . . ?
H01G C017 H01H 109.5 . . ?
H01G C017 H01I 109.5 . . ?
H01H C017 H01I 109.5 . . ?
C00S C018 H018 119.3 . . ?
C01G C018 C00S 121.5(2) . . ?
C01G C018 H018 119.3 . . ?
Si2 C019 H01J 109.5 . . ?
Si2 C019 H01K 109.5 . . ?
Si2 C019 H01L 109.5 . . ?
H01J C019 H01K 109.5 . . ?
H01J C019 H01L 109.5 . . ?
H01K C019 H01L 109.5 . . ?
C00V C01A H01M 119.3 . . ?
C01G C01A C00V 121.5(2) . . ?
C01G C01A H01M 119.3 . . ?
Si2 C01B H01N 109.5 . . ?
Si2 C01B H01O 109.5 . . ?
Si2 C01B H01P 109.5 . . ?
H01N C01B H01O 109.5 . . ?
H01N C01B H01P 109.5 . . ?
H01O C01B H01P 109.5 . . ?
C00T C01C H01Q 109.5 . . ?
C00T C01C H01R 109.5 . . ?
C00T C01C H01S 109.5 . . ?
H01Q C01C H01R 109.5 . . ?
H01Q C01C H01S 109.5 . . ?
H01R C01C H01S 109.5 . . ?
C00Q C01D H01T 109.5 . . ?
C00Q C01D H01U 109.5 . . ?
C00Q C01D H01V 109.5 . . ?
H01T C01D H01U 109.5 . . ?
H01T C01D H01V 109.5 . . ?
H01U C01D H01V 109.5 . . ?
Si2 C4 H4A 108.9 . . ?
Si2 C4 H4B 108.9 . . ?
H4A C4 H4B 107.7 . . ?
C5 C4 Si2 113.2(3) . . ?
C5 C4 H4A 108.9 . . ?
C5 C4 H4B 108.9 . . ?
C10 C4 Si2 125.0(6) . . ?
C10 C4 H4A 123.9 . . ?
C10 C4 H4B 70.4 . . ?
C10 C4 C5 38.6(8) . . ?
O009 C01F H4 109.8 . . ?
O009 C01F H 109.8 . . ?
O009 C01F C01I 109.6(2) . . ?
H4 C01F H 108.2 . . ?
C01I C01F H4 109.8 . . ?
C01I C01F H 109.8 . . ?
C018 C01G C01A 119.8(2) . . ?
C018 C01G H01W 120.1 . . ?
C01A C01G H01W 120.1 . . ?
Si1 C01H H01X 109.5 . . ?
Si1 C01H H01Y 109.5 . . ?
Si1 C01H HA 109.5 . . ?
H01X C01H H01Y 109.5 . . ?
H01X C01H HA 109.5 . . ?
H01Y C01H HA 109.5 . . ?
O005 C01I C01F 108.7(2) . . ?
O005 C01I H6 110.0 . . ?
O005 C01I HB 110.0 . . ?
C01F C01I H6 110.0 . . ?
C01F C01I HB 110.0 . . ?
H6 C01I HB 108.3 . . ?
O00C C01J H7 109.8 . . ?
O00C C01J HC 109.8 . . ?
O00C C01J C01S 109.4(2) . . ?
H7 C01J HC 108.2 . . ?
C01S C01J H7 109.8 . . ?
C01S C01J HC 109.8 . . ?
O00C C01K H8 109.9 . . ?
O00C C01K HD 109.9 . . ?
O00C C01K C01U 109.1(2) . . ?
H8 C01K HD 108.3 . . ?
C01U C01K H8 109.9 . . ?
C01U C01K HD 109.9 . . ?
C013 C01L H01Z 109.5 . . ?
C013 C01L HE 109.5 . . ?
C013 C01L HF 109.5 . . ?
H01Z C01L HE 109.5 . . ?
H01Z C01L HF 109.5 . . ?
HE C01L HF 109.5 . . ?
O00B C01M H9 109.7 . . ?
O00B C01M HG 109.7 . . ?
O00B C01M C01Q 110.0(2) . . ?
H9 C01M HG 108.2 . . ?
C01Q C01M H9 109.7 . . ?
C01Q C01M HG 109.7 . . ?
O006 C01N H11 109.9 . . ?
O006 C01N HH 109.9 . . ?
O006 C01N C01O 108.7(2) . . ?
H11 C01N HH 108.3 . . ?
C01O C01N H11 109.9 . . ?
C01O C01N HH 109.9 . . ?
O005 C01O C01N 109.2(2) . . ?
O005 C01O H12 109.8 . . ?
O005 C01O HI 109.9 . . ?
C01N C01O H12 109.8 . . ?
C01N C01O HI 109.8 . . ?
H12 C01O HI 108.3 . . ?
C4 C5 H5 118.4 . . ?
C6 C5 C4 123.2(4) . . ?
C6 C5 H5 118.4 . . ?
C6 C5 C15 141.0(10) . . ?
C10 C5 C4 54.2(8) . . ?
C10 C5 H5 170.7 . . ?
C10 C5 C6 69.3(8) . . ?
C10 C5 C15 72.1(11) . . ?
C15 C5 C4 17.9(9) . . ?
C15 C5 H5 100.6 . . ?
O009 C01Q C01M 110.0(2) . . ?
O009 C01Q H13 109.7 . . ?
O009 C01Q HJ 109.7 . . ?
C01M C01Q H13 109.7 . . ?
C01M C01Q HJ 109.7 . . ?
H13 C01Q HJ 108.2 . . ?
O00B C01R H14 109.8 . . ?
O00B C01R HK 109.8 . . ?
O00B C01R C01X 109.5(2) . . ?
H14 C01R HK 108.2 . . ?
C01X C01R H14 109.8 . . ?
C01X C01R HK 109.8 . . ?
O00D C01S C01J 109.0(2) . . ?
O00D C01S H15 109.9 . . ?
O00D C01S HL 109.9 . . ?
C01J C01S H15 109.9 . . ?
C01J C01S HL 109.9 . . ?
H15 C01S HL 108.3 . . ?
C5 C6 H6BC 120.0 . . ?
C5 C6 H6BD 120.0 . . ?
C5 C6 H6AA 79.5 . . ?
C5 C6 H6AB 159.9 . . ?
H6BC C6 H6BD 120.0 . . ?
H6BC C6 H6AA 157.1 . . ?
H6BC C6 H6AB 42.6 . . ?
H6BD C6 H6AA 42.4 . . ?
H6BD C6 H6AB 78.3 . . ?
H6AA C6 H6AB 120.0 . . ?
C10 C6 C5 40.9(7) . . ?
C10 C6 H6BC 79.3 . . ?
C10 C6 H6BD 160.4 . . ?
C10 C6 H6AA 120.0 . . ?
C10 C6 H6AB 120.0 . . ?
O006 C01U C01K 109.5(2) . . ?
O006 C01U H16 109.8 . . ?
O006 C01U HM 109.8 . . ?
C01K C01U H16 109.8 . . ?
C01K C01U HM 109.8 . . ?
H16 C01U HM 108.2 . . ?
C00R C01V H01 109.5 . . ?
C00R C01V HN 109.5 . . ?
C00R C01V HO 109.5 . . ?
H01 C01V HN 109.5 . . ?
H01 C01V HO 109.5 . . ?
HN C01V HO 109.5 . . ?
C00U C01W H1 109.5 . . ?
C00U C01W HP 109.5 . . ?
C00U C01W HQ 109.5 . . ?
H1 C01W HP 109.5 . . ?
H1 C01W HQ 109.5 . . ?
HP C01W HQ 109.5 . . ?
O00D C01X C01R 109.1(2) . . ?
O00D C01X H17 109.9 . . ?
O00D C01X HR 109.9 . . ?
C01R C01X H17 109.9 . . ?
C01R C01X HR 109.9 . . ?
H17 C01X HR 108.3 . . ?
C013 C01Y H2 109.5 . . ?
C013 C01Y HS 109.5 . . ?
C013 C01Y HT 109.5 . . ?
H2 C01Y HS 109.5 . . ?
H2 C01Y HT 109.5 . . ?
HS C01Y HT 109.5 . . ?
C00U C01Z H3 109.5 . . ?
C00U C01Z HU 109.5 . . ?
C00U C01Z HV 109.5 . . ?
H3 C01Z HU 109.5 . . ?
H3 C01Z HV 109.5 . . ?
HU C01Z HV 109.5 . . ?
C1 C2 H2A 116.3 . . ?
C1 C2 C2AA 47.8(3) . . ?
C3 C2 C1 127.3(5) . . ?
C3 C2 H2A 116.3 . . ?
C3 C2 C2AA 81.6(5) . . ?
C2AA C2 H2A 157.3 . . ?
H02A C021 H02B 108.6 . . ?
C024 C021 H02A 110.4 . . ?
C024 C021 H02B 110.4 . . ?
C02A C021 H02A 110.4 . . ?
C02A C021 H02B 110.4 . . ?
C02A C021 C024 106.8(4) . . ?
C02A C021 C3AA 73.6(8) . . ?
C02A C021 C0AA 79.3(8) . . ?
C3AA C021 H02A 83.9 . . ?
C3AA C021 H02B 163.5 . . ?
C3AA C021 C024 54.0(7) . . ?
C3AA C021 C0AA 102.8(6) . . ?
C0AA C021 H02A 169.7 . . ?
C0AA C021 H02B 63.4 . . ?
C0AA C021 C024 68.8(6) . . ?
O00P C022 H02C 111.1 . . ?
O00P C022 H02D 111.1 . . ?
O00P C022 C029 103.4(8) . . ?
O00P C022 C8AA 82.3(6) . . ?
H02C C022 H02D 109.0 . . ?
C029 C022 H02C 111.1 . . ?
C029 C022 H02D 111.1 . . ?
C029 C022 C8AA 21.3(4) . . ?
O00Q C022 O00P 9.9(6) . . ?
O00Q C022 H02C 108.7 . . ?
O00Q C022 H02D 103.8 . . ?
O00Q C022 C029 112.8(8) . . ?
O00Q C022 C8AA 91.9(7) . . ?
C7AA C022 O00P 98.1(16) . . ?
C7AA C022 H02C 143.0 . . ?
C7AA C022 H02D 79.3 . . ?
C7AA C022 C029 37.3(12) . . ?
C7AA C022 O00Q 103.7(17) . . ?
C7AA C022 C8AA 43.5(12) . . ?
C8AA C022 H02C 117.1 . . ?
C8AA C022 H02D 122.8 . . ?
C2 C3 H3A 120.0 . . ?
C2 C3 H3B 120.0 . . ?
C2 C3 C4AA 99.1(5) . . ?
H3A C3 H3B 120.0 . . ?
C4AA C3 H3A 25.5 . . ?
C4AA C3 H3B 138.2 . . ?
O00Y C024 C021 104.3(4) . . ?
O00Y C024 H02E 110.9 . . ?
O00Y C024 H02F 110.9 . . ?
O00Y C024 O00Z 4.1(9) . . ?
O00Y C024 C0 43.7(5) . . ?
O00Y C024 C0AA 87.5(6) . . ?
O00Y C024 C5AA 95.2(7) . . ?
C021 C024 H02E 110.9 . . ?
C021 C024 H02F 110.9 . . ?
C021 C024 C0 83.3(5) . . ?
C021 C024 C0AA 55.0(6) . . ?
C021 C024 C5AA 9.6(7) . . ?
H02E C024 H02F 108.9 . . ?
O00Z C024 C021 100.7(6) . . ?
O00Z C024 H02E 114.4 . . ?
O00Z C024 H02F 110.9 . . ?
O00Z C024 C0 44.1(5) . . ?
O00Z C024 C0AA 86.8(6) . . ?
O00Z C024 C5AA 91.7(8) . . ?
C0 C024 H02E 83.8 . . ?
C0 C024 H02F 154.5 . . ?
C3AA C024 O00Y 64.9(7) . . ?
C3AA C024 C021 59.4(6) . . ?
C3AA C024 H02E 165.6 . . ?
C3AA C024 H02F 85.2 . . ?
C3AA C024 O00Z 60.9(7) . . ?
C3AA C024 C0 84.4(7) . . ?
C3AA C024 C0AA 96.6(8) . . ?
C3AA C024 C5AA 56.3(6) . . ?
C0AA C024 H02E 69.2 . . ?
C0AA C024 H02F 160.1 . . ?
C0AA C024 C0 44.8(4) . . ?
C0AA C024 C5AA 50.2(5) . . ?
C5AA C024 H02E 112.3 . . ?
C5AA C024 H02F 118.0 . . ?
C5AA C024 C0 74.3(7) . . ?
O00P C026 H02G 110.0 . . ?
O00P C026 H02H 110.0 . . ?
O00P C026 O00Q 6.1(5) . . ?
O00P C026 C8AA 86.3(7) . . ?
H02G C026 H02H 108.4 . . ?
C02B C026 O00P 108.5(8) . . ?
C02B C026 H02G 110.0 . . ?
C02B C026 H02H 110.0 . . ?
C02B C026 O00Q 103.4(7) . . ?
C02B C026 C8AA 22.8(4) . . ?
C6AA C026 O00P 52.9(12) . . ?
C6AA C026 H02G 58.5 . . ?
C6AA C026 H02H 114.4 . . ?
C6AA C026 C02B 136(2) . . ?
C6AA C026 O00Q 54.2(12) . . ?
C6AA C026 C8AA 124.3(17) . . ?
C6AA C026 C1AA 109(2) . . ?
O00Q C026 H02G 109.5 . . ?
O00Q C026 H02H 115.5 . . ?
O00Q C026 C8AA 81.6(5) . . ?
C8AA C026 H02G 124.8 . . ?
C8AA C026 H02H 114.6 . . ?
C1AA C026 O00P 116.4(10) . . ?
C1AA C026 H02G 74.2 . . ?
C1AA C026 H02H 129.3 . . ?
C1AA C026 C02B 36.4(7) . . ?
C1AA C026 O00Q 110.3(9) . . ?
C1AA C026 C8AA 52.1(6) . . ?
O00Y C027 H02I 110.2 . . ?
O00Y C027 H02J 110.2 . . ?
O00Y C027 C02A 107.3(5) . . ?
O00Y C027 C3AA 52.7(6) . . ?
H02I C027 H02J 108.5 . . ?
C02A C027 H02I 110.2 . . ?
C02A C027 H02J 110.2 . . ?
C02A C027 C3AA 61.4(5) . . ?
O00Z C027 O00Y 3.0(11) . . ?
O00Z C027 H02I 107.8 . . ?
O00Z C027 H02J 113.0 . . ?
O00Z C027 C02A 107.0(6) . . ?
O00Z C027 C3AA 50.9(6) . . ?
C0 C027 O00Y 61.1(8) . . ?
C0 C027 H02I 151.3 . . ?
C0 C027 H02J 57.0 . . ?
C0 C027 C02A 98.4(7) . . ?
C0 C027 O00Z 64.1(8) . . ?
C0 C027 C3AA 93.1(8) . . ?
C3AA C027 H02I 102.4 . . ?
C3AA C027 H02J 148.8 . . ?
C022 C029 H02K 110.5 . . ?
C022 C029 H02L 110.5 . . ?
C022 C029 C1AA 88.1(7) . . ?
H02K C029 H02L 108.7 . . ?
C02B C029 C022 106.3(8) . . ?
C02B C029 H02K 110.5 . . ?
C02B C029 H02L 110.5 . . ?
C02B C029 C1AA 23.7(6) . . ?
C7AA C029 C022 21.5(8) . . ?
C7AA C029 H02K 89.2 . . ?
C7AA C029 H02L 122.8 . . ?
C7AA C029 C02B 112.9(9) . . ?
C7AA C029 C1AA 100.8(8) . . ?
C8AA C029 C022 114.0(12) . . ?
C8AA C029 H02K 92.6 . . ?
C8AA C029 H02L 119.0 . . ?
C8AA C029 C02B 17.9(11) . . ?
C8AA C029 C7AA 113.7(13) . . ?
C8AA C029 C1AA 40.9(10) . . ?
C1AA C029 H02K 132.6 . . ?
C1AA C029 H02L 104.3 . . ?
C021 C02A C027 109.3(5) . . ?
C021 C02A H02M 109.8 . . ?
C021 C02A H02N 109.8 . . ?
C021 C02A C0 83.9(6) . . ?
C021 C02A C3AA 53.8(7) . . ?
C021 C02A C0AA 52.6(6) . . ?
C027 C02A H02M 109.8 . . ?
C027 C02A H02N 109.8 . . ?
C027 C02A C0 37.7(5) . . ?
C027 C02A C3AA 71.1(5) . . ?
C027 C02A C0AA 80.0(5) . . ?
H02M C02A H02N 108.3 . . ?
C0 C02A H02M 94.2 . . ?
C0 C02A H02N 146.7 . . ?
C3AA C02A H02M 160.3 . . ?
C3AA C02A H02N 89.2 . . ?
C3AA C02A C0 74.5(5) . . ?
C3AA C02A C0AA 80.1(7) . . ?
C0AA C02A H02M 80.7 . . ?
C0AA C02A H02N 162.4 . . ?
C0AA C02A C0 42.6(4) . . ?
C5AA C02A C021 5.5(9) . . ?
C5AA C02A C027 113.2(9) . . ?
C5AA C02A H02M 104.5 . . ?
C5AA C02A H02N 111.1 . . ?
C5AA C02A C0 85.5(9) . . ?
C5AA C02A C3AA 59.3(8) . . ?
C5AA C02A C0AA 51.3(9) . . ?
C026 C02B C029 107.1(7) . . ?
C026 C02B H02O 110.3 . . ?
C026 C02B H02P 110.3 . . ?
C026 C02B C6AA 12.9(7) . . ?
C029 C02B H02O 110.3 . . ?
C029 C02B H02P 110.3 . . ?
C029 C02B C6AA 98.8(7) . . ?
H02O C02B H02P 108.5 . . ?
C6AA C02B H02O 123.0 . . ?
C6AA C02B H02P 105.3 . . ?
C8AA C02B C026 110.9(12) . . ?
C8AA C02B C029 18.1(11) . . ?
C8AA C02B H02O 92.8 . . ?
C8AA C02B H02P 122.3 . . ?
C8AA C02B C6AA 106.0(11) . . ?
C8AA C02B C1AA 129.0(18) . . ?
C1AA C02B C026 51.3(9) . . ?
C1AA C02B C029 112.3(14) . . ?
C1AA C02B H02O 137.1 . . ?
C1AA C02B H02P 60.6 . . ?
C1AA C02B C6AA 44.6(7) . . ?
C1 C2AA C2 49.2(3) . . ?
C1 C2AA H2AA 115.9 . . ?
C2 C2AA H2AA 158.5 . . ?
C4AA C2AA C1 128.2(8) . . ?
C4AA C2AA C2 80.8(7) . . ?
C4AA C2AA H2AA 115.9 . . ?
C3 C4AA H4AA 24.8 . . ?
C3 C4AA H4AB 139.4 . . ?
C2AA C4AA C3 98.5(7) . . ?
C2AA C4AA H4AA 120.0 . . ?
C2AA C4AA H4AB 120.0 . . ?
H4AA C4AA H4AB 120.0 . . ?
C4 C10 C6 156.3(16) . . ?
C4 C10 H10 92.4 . . ?
C4 C10 C15 18.9(11) . . ?
C5 C10 C4 87.2(11) . . ?
C5 C10 C6 69.9(11) . . ?
C5 C10 H10 172.3 . . ?
C5 C10 C15 68.3(13) . . ?
C6 C10 H10 111.1 . . ?
C6 C10 C15 137.7(19) . . ?
C15 C10 H10 111.1 . . ?
Si2 C15 H15A 108.1 . . ?
Si2 C15 H15B 108.1 . . ?
C5 C15 Si2 123.2(13) . . ?
C5 C15 C10 39.6(9) . . ?
C5 C15 H15A 69.2 . . ?
C5 C15 H15B 127.3 . . ?
C10 C15 Si2 116.9(15) . . ?
C10 C15 H15A 108.1 . . ?
C10 C15 H15B 108.1 . . ?
H15A C15 H15B 107.3 . . ?
C024 O00Z K1 124.7(7) . . ?
C027 O00Z K1 122.8(7) . . ?
C027 O00Z C024 112.4(6) . . ?
C027 O00Z C0 55.5(8) . . ?
C027 O00Z C3AA 83.1(10) . . ?
C0 O00Z K1 119.8(7) . . ?
C0 O00Z C024 87.8(9) . . ?
C0 O00Z C3AA 108.5(8) . . ?
C3AA O00Z K1 131.6(8) . . ?
C3AA O00Z C024 55.1(8) . . ?
O00Y C0 C024 46.3(5) . . ?
O00Y C0 C02A 82.1(7) . . ?
O00Y C0 O00Z 4.7(10) . . ?
O00Y C0 H0A 115.4 . . ?
O00Y C0 H0B 107.2 . . ?
O00Y C0 C0AA 102.8(9) . . ?
C024 C0 C02A 72.0(4) . . ?
C024 C0 H0A 139.2 . . ?
C024 C0 H0B 111.4 . . ?
C027 C0 O00Y 65.1(7) . . ?
C027 C0 C024 89.4(6) . . ?
C027 C0 C02A 44.0(5) . . ?
C027 C0 O00Z 60.4(8) . . ?
C027 C0 H0A 53.8 . . ?
C027 C0 H0B 143.3 . . ?
C027 C0 C0AA 105.6(9) . . ?
C02A C0 H0A 69.0 . . ?
C02A C0 H0B 169.9 . . ?
O00Z C0 C024 48.2(6) . . ?
O00Z C0 C02A 78.4(8) . . ?
O00Z C0 H0A 111.1 . . ?
O00Z C0 H0B 111.1 . . ?
O00Z C0 C0AA 103.3(9) . . ?
H0A C0 H0B 109.1 . . ?
C0AA C0 C024 57.8(7) . . ?
C0AA C0 C02A 62.1(7) . . ?
C0AA C0 H0A 111.1 . . ?
C0AA C0 H0B 111.1 . . ?
O00Y C3AA C027 49.1(4) . . ?
O00Y C3AA C02A 91.5(7) . . ?
O00Y C3AA H3AA 107.8 . . ?
O00Y C3AA H3AB 114.6 . . ?
C021 C3AA O00Y 106.0(8) . . ?
C021 C3AA C027 89.5(7) . . ?
C021 C3AA C02A 52.6(5) . . ?
C021 C3AA O00Z 107.4(9) . . ?
C021 C3AA H3AA 98.3 . . ?
C021 C3AA H3AB 119.5 . . ?
C021 C3AA C5AA 13.0(10) . . ?
C024 C3AA O00Y 60.2(6) . . ?
C024 C3AA C021 66.6(7) . . ?
C024 C3AA C027 93.0(6) . . ?
C024 C3AA C02A 100.8(7) . . ?
C024 C3AA O00Z 63.9(8) . . ?
C024 C3AA H3AA 70.7 . . ?
C024 C3AA H3AB 173.6 . . ?
C024 C3AA C5AA 74.7(10) . . ?
C027 C3AA H3AA 156.9 . . ?
C027 C3AA H3AB 85.4 . . ?
C02A C3AA C027 47.5(5) . . ?
C02A C3AA H3AA 149.3 . . ?
C02A C3AA H3AB 82.7 . . ?
O00Z C3AA O00Y 3.9(9) . . ?
O00Z C3AA C027 46.0(6) . . ?
O00Z C3AA C02A 89.6(8) . . ?
O00Z C3AA H3AA 111.0 . . ?
O00Z C3AA H3AB 111.0 . . ?
O00Z C3AA C5AA 103.9(8) . . ?
H3AA C3AA H3AB 109.0 . . ?
C5AA C3AA O00Y 103.4(8) . . ?
C5AA C3AA C027 78.7(9) . . ?
C5AA C3AA C02A 39.7(9) . . ?
C5AA C3AA H3AA 111.0 . . ?
C5AA C3AA H3AB 111.0 . . ?
C021 C0AA C024 56.2(5) . . ?
C021 C0AA C02A 48.2(5) . . ?
C021 C0AA H0AA 118.8 . . ?
C021 C0AA H0AB 98.6 . . ?
C024 C0AA C02A 82.5(5) . . ?
C024 C0AA H0AA 171.2 . . ?
C024 C0AA H0AB 66.4 . . ?
C02A C0AA H0AA 99.1 . . ?
C02A C0AA H0AB 144.8 . . ?
C0 C0AA C021 106.8(9) . . ?
C0 C0AA C024 77.4(7) . . ?
C0 C0AA C02A 75.3(9) . . ?
C0 C0AA H0AA 111.4 . . ?
C0 C0AA H0AB 111.4 . . ?
C0 C0AA C5AA 102.0(11) . . ?
H0AA C0AA H0AB 109.2 . . ?
C5AA C0AA C021 12.8(10) . . ?
C5AA C0AA C024 65.1(8) . . ?
C5AA C0AA C02A 36.2(9) . . ?
C5AA C0AA H0AA 111.4 . . ?
C5AA C0AA H0AB 111.4 . . ?
C024 C5AA H5AA 152.9 . . ?
C024 C5AA H5AB 96.7 . . ?
C02A C5AA C024 111.8(9) . . ?
C02A C5AA C3AA 81.0(12) . . ?
C02A C5AA C0AA 92.5(13) . . ?
C02A C5AA H5AA 41.2 . . ?
C02A C5AA H5AB 149.0 . . ?
C3AA C5AA C024 49.0(8) . . ?
C3AA C5AA H5AA 111.2 . . ?
C3AA C5AA H5AB 111.2 . . ?
C0AA C5AA C024 64.7(9) . . ?
C0AA C5AA C3AA 102.8(9) . . ?
C0AA C5AA H5AA 111.2 . . ?
C0AA C5AA H5AB 111.2 . . ?
H5AA C5AA H5AB 109.1 . . ?
O00P C6AA C02B 95.0(8) . . ?
O00P C6AA H6AC 113.9 . . ?
O00P C6AA H6AD 102.0 . . ?
O00P C6AA O00Q 7.8(7) . . ?
O00P C6AA C1AA 112.5(8) . . ?
C026 C6AA O00P 102.9(17) . . ?
C026 C6AA C02B 31.5(14) . . ?
C026 C6AA H6AC 142.8 . . ?
C026 C6AA H6AD 67.3 . . ?
C026 C6AA O00Q 106.0(16) . . ?
C026 C6AA C1AA 47.0(16) . . ?
C02B C6AA H6AC 134.2 . . ?
C02B C6AA H6AD 98.8 . . ?
H6AC C6AA H6AD 108.3 . . ?
O00Q C6AA C02B 94.0(6) . . ?
O00Q C6AA H6AC 109.8 . . ?
O00Q C6AA H6AD 109.9 . . ?
C1AA C6AA C02B 24.5(5) . . ?
C1AA C6AA H6AC 109.9 . . ?
C1AA C6AA H6AD 109.9 . . ?
C1AA C6AA O00Q 109.2(6) . . ?
C022 O00Q K1 132.2(7) . . ?
C022 O00Q C026 102.8(6) . . ?
C022 O00Q C6AA 111.8(7) . . ?
C022 O00Q C7AA 24.4(7) . . ?
C026 O00Q K1 113.0(6) . . ?
C6AA O00Q K1 112.6(5) . . ?
C6AA O00Q C026 19.9(6) . . ?
C6AA O00Q C7AA 107.4(6) . . ?
C7AA O00Q K1 121.5(5) . . ?
C7AA O00Q C026 92.0(6) . . ?
O00P C7AA H7AA 118.6 . . ?
O00P C7AA H7AB 113.9 . . ?
C022 C7AA O00P 59.6(13) . . ?
C022 C7AA C029 121.2(19) . . ?
C022 C7AA O00Q 52.0(12) . . ?
C022 C7AA H7AA 59.9 . . ?
C022 C7AA H7AB 127.3 . . ?
C022 C7AA C8AA 119.9(16) . . ?
C029 C7AA O00P 114.2(8) . . ?
C029 C7AA O00Q 123.2(8) . . ?
C029 C7AA H7AA 88.7 . . ?
C029 C7AA H7AB 109.1 . . ?
C029 C7AA C8AA 27.3(6) . . ?
O00Q C7AA O00P 10.2(6) . . ?
O00Q C7AA H7AA 111.9 . . ?
O00Q C7AA H7AB 111.9 . . ?
O00Q C7AA C8AA 99.5(6) . . ?
H7AA C7AA H7AB 109.6 . . ?
C8AA C7AA O00P 89.7(6) . . ?
C8AA C7AA H7AA 111.9 . . ?
C8AA C7AA H7AB 111.9 . . ?
C022 C8AA H8AA 122.0 . . ?
C022 C8AA H8AB 113.7 . . ?
C026 C8AA C022 75.8(5) . . ?
C026 C8AA H8AA 88.7 . . ?
C026 C8AA H8AB 147.8 . . ?
C029 C8AA C022 44.7(9) . . ?
C029 C8AA C026 119.6(11) . . ?
C029 C8AA C7AA 39.0(9) . . ?
C029 C8AA H8AA 126.8 . . ?
C029 C8AA H8AB 71.7 . . ?
C029 C8AA C1AA 118.7(15) . . ?
C02B C8AA C022 114.7(13) . . ?
C02B C8AA C026 46.3(9) . . ?
C02B C8AA C029 144(2) . . ?
C02B C8AA C7AA 129.6(13) . . ?
C02B C8AA H8AA 88.6 . . ?
C02B C8AA H8AB 105.7 . . ?
C02B C8AA C1AA 26.9(11) . . ?
C7AA C8AA C022 16.6(5) . . ?
C7AA C8AA C026 86.6(5) . . ?
C7AA C8AA H8AA 110.6 . . ?
C7AA C8AA H8AB 110.6 . . ?
H8AA C8AA H8AB 108.8 . . ?
C1AA C8AA C022 89.4(7) . . ?
C1AA C8AA C026 37.2(5) . . ?
C1AA C8AA C7AA 105.5(7) . . ?
C1AA C8AA H8AA 110.6 . . ?
C1AA C8AA H8AB 110.6 . . ?
C026 C1AA C029 94.9(7) . . ?
C026 C1AA C6AA 23.6(9) . . ?
C026 C1AA C8AA 90.7(9) . . ?
C026 C1AA H1AC 97.0 . . ?
C026 C1AA H1AD 135.0 . . ?
C029 C1AA H1AC 130.3 . . ?
C029 C1AA H1AD 94.9 . . ?
C02B C1AA C026 92.3(12) . . ?
C02B C1AA C029 44.0(9) . . ?
C02B C1AA C6AA 110.9(11) . . ?
C02B C1AA C8AA 24.1(8) . . ?
C02B C1AA H1AC 87.3 . . ?
C02B C1AA H1AD 123.9 . . ?
C6AA C1AA C029 98.0(6) . . ?
C6AA C1AA C8AA 101.8(6) . . ?
C6AA C1AA H1AC 111.4 . . ?
C6AA C1AA H1AD 111.4 . . ?
C8AA C1AA C029 20.4(5) . . ?
C8AA C1AA H1AC 111.4 . . ?
C8AA C1AA H1AD 111.4 . . ?
H1AC C1AA H1AD 109.3 . . ?
H1BA C1BA H1BB 108.5 . . ?
C2BA C1BA H1BA 110.3 . . ?
C2BA C1BA H1BB 110.3 . . ?
C2BA C1BA C0BA 107.2(7) . . ?
C2BA C1BA C4BA 85.2(10) . . ?
C0BA C1BA H1BA 110.3 . . ?
C0BA C1BA H1BB 110.3 . . ?
C4BA C1BA H1BA 164.5 . . ?
C4BA C1BA H1BB 65.5 . . ?
C4BA C1BA C0BA 61.8(10) . . ?
C44 C1BA H1BA 98.6 . . ?
C44 C1BA H1BB 128.4 . . ?
C44 C1BA C2BA 100(3) . . ?
C44 C1BA C0BA 18(2) . . ?
C44 C1BA C4BA 77(3) . . ?
C1BA C2BA H2BA 110.3 . . ?
C1BA C2BA H2BB 110.3 . . ?
C1BA C2BA C4BA 51.3(8) . . ?
C1BA C2BA C44 28.4(12) . . ?
H2BA C2BA H2BB 108.5 . . ?
C4BA C2BA H2BA 157.4 . . ?
C4BA C2BA H2BB 72.5 . . ?
C44 C2BA H2BA 121.6 . . ?
C44 C2BA H2BB 122.2 . . ?
C44 C2BA C4BA 50.0(12) . . ?
H9AA C9AA H9AB 109.4 . . ?
C0BA C9AA H9AA 111.6 . . ?
C0BA C9AA H9AB 111.6 . . ?
C0BA C9AA C3BA 104.8(9) . . ?
C0BA C9AA C4BA 55.4(8) . . ?
C0BA C9AA C44 29.7(11) . . ?
O5 C9AA H9AA 117.2 . . ?
O5 C9AA H9AB 64.7 . . ?
O5 C9AA C0BA 129.1(9) . . ?
O5 C9AA C3BA 38.0(8) . . ?
O5 C9AA C4BA 80.0(10) . . ?
O5 C9AA C44 103.3(14) . . ?
C3BA C9AA H9AA 140.3 . . ?
C3BA C9AA H9AB 39.5 . . ?
C4BA C9AA H9AA 160.7 . . ?
C4BA C9AA H9AB 68.4 . . ?
C4BA C9AA C3BA 49.4(9) . . ?
C44 C9AA H9AA 127.4 . . ?
C44 C9AA H9AB 117.8 . . ?
C44 C9AA C3BA 92.2(13) . . ?
C44 C9AA C4BA 49.5(11) . . ?
C1BA C0BA H0BA 111.6 . . ?
C1BA C0BA H0BB 111.6 . . ?
C9AA C0BA C1BA 100.7(7) . . ?
C9AA C0BA H0BA 111.6 . . ?
C9AA C0BA H0BB 111.6 . . ?
C9AA C0BA C4BA 77.0(10) . . ?
H0BA C0BA H0BB 109.4 . . ?
C4BA C0BA C1BA 56.2(9) . . ?
C4BA C0BA H0BA 74.6 . . ?
C4BA C0BA H0BB 167.1 . . ?
C44 C0BA C1BA 17(2) . . ?
C44 C0BA C9AA 96(3) . . ?
C44 C0BA H0BA 127.6 . . ?
C44 C0BA H0BB 99.0 . . ?
C44 C0BA C4BA 70(2) . . ?
C3BA O5 C9AA 98.8(16) . . ?
C9AA C3BA H3BA 149.2 . . ?
C9AA C3BA H3BB 98.8 . . ?
O5 C3BA C9AA 43.2(10) . . ?
O5 C3BA H3BA 112.2 . . ?
O5 C3BA H3BB 112.2 . . ?
O5 C3BA C4BA 97.7(17) . . ?
H3BA C3BA H3BB 109.8 . . ?
C4BA C3BA C9AA 64.6(12) . . ?
C4BA C3BA H3BA 112.2 . . ?
C4BA C3BA H3BB 112.2 . . ?
C1BA C4BA C2BA 43.5(7) . . ?
C1BA C4BA C9AA 86.3(10) . . ?
C1BA C4BA C0BA 62.1(9) . . ?
C1BA C4BA C3BA 119.9(16) . . ?
C1BA C4BA H4BA 126.7 . . ?
C1BA C4BA H4BB 78.9 . . ?
C1BA C4BA C44 30.5(14) . . ?
C2BA C4BA H4BA 163.1 . . ?
C2BA C4BA H4BB 85.4 . . ?
C9AA C4BA C2BA 73.2(8) . . ?
C9AA C4BA H4BA 93.9 . . ?
C9AA C4BA H4BB 158.5 . . ?
C0BA C4BA C2BA 83.8(9) . . ?
C0BA C4BA C9AA 47.7(8) . . ?
C0BA C4BA H4BA 79.3 . . ?
C0BA C4BA H4BB 132.8 . . ?
C3BA C4BA C2BA 76.9(12) . . ?
C3BA C4BA C9AA 65.9(12) . . ?
C3BA C4BA C0BA 113.6(17) . . ?
C3BA C4BA H4BA 108.3 . . ?
C3BA C4BA H4BB 108.3 . . ?
H4BA C4BA H4BB 107.4 . . ?
C44 C4BA C2BA 56.1(15) . . ?
C44 C4BA C9AA 60.9(16) . . ?
C44 C4BA C0BA 32.5(14) . . ?
C44 C4BA C3BA 116(2) . . ?
C44 C4BA H4BA 108.3 . . ?
C44 C4BA H4BB 108.3 . . ?
C1BA C44 C2BA 52(2) . . ?
C1BA C44 C9AA 128(4) . . ?
C1BA C44 C0BA 145(4) . . ?
C1BA C44 C4BA 73(3) . . ?
C1BA C44 H44A 45.3 . . ?
C1BA C44 H44B 150.1 . . ?
C2BA C44 C9AA 83.2(16) . . ?
C2BA C44 H44A 81.4 . . ?
C2BA C44 H44B 156.5 . . ?
C9AA C44 H44A 161.8 . . ?
C9AA C44 H44B 79.9 . . ?
C0BA C44 C2BA 135(3) . . ?
C0BA C44 C9AA 54(2) . . ?
C0BA C44 C4BA 78(2) . . ?
C0BA C44 H44A 143.2 . . ?
C0BA C44 H44B 38.8 . . ?
C4BA C44 C2BA 73.9(18) . . ?
C4BA C44 C9AA 69.6(17) . . ?
C4BA C44 H44A 114.6 . . ?
C4BA C44 H44B 114.6 . . ?
H44A C44 H44B 111.7 . . ?
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
Co1 N1 1.9378(18) . ?
Co1 N3 1.7555(16) . ?
Co1 N2 1.9230(18) . ?
K1 O005 2.8079(17) . ?
K1 O006 2.8065(18) . ?
K1 O009 2.7982(18) . ?
K1 O00B 2.8211(19) . ?
K1 O00C 2.7940(18) . ?
K1 O00D 2.7642(17) . ?
K1 O00P 2.697(9) . ?
K1 O00Y 2.648(6) . ?
K1 O00Z 2.681(8) . ?
K1 O00Q 2.701(5) . ?
Si1 N1 1.7223(19) . ?
Si1 C00X 1.869(3) . ?
Si1 C1 1.897(2) . ?
Si1 C01H 1.871(3) . ?
Si2 N2 1.7227(18) . ?
Si2 C019 1.868(3) . ?
Si2 C01B 1.863(3) . ?
Si2 C4 1.921(6) . ?
Si2 C15 1.88(2) . ?
O005 C01I 1.411(3) . ?
O005 C01O 1.414(3) . ?
O006 C01N 1.410(3) . ?
O006 C01U 1.418(3) . ?
N1 C00J 1.426(3) . ?
N3 C7 1.340(2) . ?
O009 C01F 1.431(3) . ?
O009 C01Q 1.406(3) . ?
N2 C00M 1.423(2) . ?
O00B C01M 1.418(4) . ?
O00B C01R 1.428(3) . ?
O00C C01J 1.419(3) . ?
O00C C01K 1.417(3) . ?
O00D C01S 1.416(4) . ?
O00D C01X 1.405(4) . ?
C7 C00F 1.436(3) . ?
C7 C00G 1.438(3) . ?
C00F C00L 1.389(3) . ?
C00F C00U 1.517(3) . ?
C00G C00H 1.390(3) . ?
C00G C00T 1.517(3) . ?
C00H H00H 0.9500 . ?
C00H C00I 1.386(3) . ?
C00I H00I 0.9500 . ?
C00I C00L 1.386(3) . ?
C00J C00N 1.419(3) . ?
C00J C00O 1.414(3) . ?
C00K C00S 1.507(3) . ?
C00K C00Z 1.533(3) . ?
C00K C017 1.530(3) . ?
C00K H00K 0.94(2) . ?
C00L H00L 0.9500 . ?
C00M C00S 1.412(3) . ?
C00M C00V 1.420(3) . ?
C00N C011 1.397(3) . ?
C00N C013 1.513(4) . ?
C00O C00Q 1.524(3) . ?
C00O C015 1.399(3) . ?
O00P C022 1.436(11) . ?
O00P C026 1.426(10) . ?
O00P C6AA 1.166(12) . ?
O00P C7AA 1.649(14) . ?
C00Q H00Q 1.0000 . ?
C00Q C00W 1.534(3) . ?
C00Q C01D 1.529(3) . ?
C00R C00V 1.519(3) . ?
C00R C016 1.522(4) . ?
C00R C01V 1.529(3) . ?
C00R H00R 0.96(3) . ?
C00S C018 1.403(3) . ?
C00T H00T 1.0000 . ?
C00T C010 1.528(3) . ?
C00T C01C 1.528(3) . ?
C00U H00U 1.0000 . ?
C00U C01W 1.506(4) . ?
C00U C01Z 1.509(4) . ?
C00V C01A 1.396(3) . ?
C00W H00A 0.9800 . ?
C00W H00B 0.9800 . ?
C00W H00C 0.9800 . ?
C00X H00D 0.9800 . ?
C00X H00E 0.9800 . ?
C00X H00F 0.9800 . ?
O00Y C024 1.419(7) . ?
O00Y C027 1.406(8) . ?
O00Y C0 1.357(15) . ?
O00Y C3AA 1.480(14) . ?
C00Z H00G 0.9800 . ?
C00Z H00J 0.9800 . ?
C00Z H00M 0.9800 . ?
C010 H01A 0.9800 . ?
C010 H01B 0.9800 . ?
C010 H01C 0.9800 . ?
C011 H011 0.9500 . ?
C011 C014 1.370(4) . ?
C1 H1BC 0.9900 . ?
C1 H1BD 0.9900 . ?
C1 H1AA 0.9900 . ?
C1 H1AB 0.9900 . ?
C1 C2 1.458(4) . ?
C1 C2AA 1.427(9) . ?
C013 H013 1.0000 . ?
C013 C01L 1.520(4) . ?
C013 C01Y 1.536(4) . ?
C014 H014 0.9500 . ?
C014 C015 1.384(4) . ?
C015 H015 0.9500 . ?
C016 H01D 0.9800 . ?
C016 H01E 0.9800 . ?
C016 H01F 0.9800 . ?
C017 H01G 0.9800 . ?
C017 H01H 0.9800 . ?
C017 H01I 0.9800 . ?
C018 H018 0.9500 . ?
C018 C01G 1.372(4) . ?
C019 H01J 0.9800 . ?
C019 H01K 0.9800 . ?
C019 H01L 0.9800 . ?
C01A H01M 0.9500 . ?
C01A C01G 1.378(4) . ?
C01B H01N 0.9800 . ?
C01B H01O 0.9800 . ?
C01B H01P 0.9800 . ?
C01C H01Q 0.9800 . ?
C01C H01R 0.9800 . ?
C01C H01S 0.9800 . ?
C01D H01T 0.9800 . ?
C01D H01U 0.9800 . ?
C01D H01V 0.9800 . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 C5 1.483(6) . ?
C4 C10 1.204(12) . ?
C01F H4 0.9900 . ?
C01F H 0.9900 . ?
C01F C01I 1.479(4) . ?
C01G H01W 0.9500 . ?
C01H H01X 0.9800 . ?
C01H H01Y 0.9800 . ?
C01H HA 0.9800 . ?
C01I H6 0.9900 . ?
C01I HB 0.9900 . ?
C01J H7 0.9900 . ?
C01J HC 0.9900 . ?
C01J C01S 1.480(4) . ?
C01K H8 0.9900 . ?
C01K HD 0.9900 . ?
C01K C01U 1.478(4) . ?
C01L H01Z 0.9800 . ?
C01L HE 0.9800 . ?
C01L HF 0.9800 . ?
C01M H9 0.9900 . ?
C01M HG 0.9900 . ?
C01M C01Q 1.497(4) . ?
C01N H11 0.9900 . ?
C01N HH 0.9900 . ?
C01N C01O 1.479(4) . ?
C01O H12 0.9900 . ?
C01O HI 0.9900 . ?
C5 H5 0.9500 . ?
C5 C6 1.329(5) . ?
C5 C10 0.926(17) . ?
C5 C15 1.35(2) . ?
C01Q H13 0.9900 . ?
C01Q HJ 0.9900 . ?
C01R H14 0.9900 . ?
C01R HK 0.9900 . ?
C01R C01X 1.492(5) . ?
C01S H15 0.9900 . ?
C01S HL 0.9900 . ?
C6 H6BC 0.9500 . ?
C6 H6BD 0.9500 . ?
C6 H6AA 0.9500 . ?
C6 H6AB 0.9500 . ?
C6 C10 1.324(14) . ?
C01U H16 0.9900 . ?
C01U HM 0.9900 . ?
C01V H01 0.9800 . ?
C01V HN 0.9800 . ?
C01V HO 0.9800 . ?
C01W H1 0.9800 . ?
C01W HP 0.9800 . ?
C01W HQ 0.9800 . ?
C01X H17 0.9900 . ?
C01X HR 0.9900 . ?
C01Y H2 0.9800 . ?
C01Y HS 0.9800 . ?
C01Y HT 0.9800 . ?
C01Z H3 0.9800 . ?
C01Z HU 0.9800 . ?
C01Z HV 0.9800 . ?
C2 H2A 0.9500 . ?
C2 C3 1.315(6) . ?
C2 C2AA 1.913(10) . ?
C021 H02A 0.9900 . ?
C021 H02B 0.9900 . ?
C021 C024 1.517(7) . ?
C021 C02A 1.402(8) . ?
C021 C3AA 1.423(14) . ?
C021 C0AA 1.494(14) . ?
C022 H02C 0.9900 . ?
C022 H02D 0.9900 . ?
C022 C029 1.476(11) . ?
C022 O00Q 1.209(12) . ?
C022 C7AA 0.633(14) . ?
C022 C8AA 1.917(13) . ?
C3 H3A 0.9500 . ?
C3 H3B 0.9500 . ?
C3 C4AA 1.508(13) . ?
C024 H02E 0.9900 . ?
C024 H02F 0.9900 . ?
C024 O00Z 1.463(13) . ?
C024 C0 1.962(14) . ?
C024 C3AA 1.337(16) . ?
C024 C0AA 1.702(13) . ?
C024 C5AA 1.707(18) . ?
C026 H02G 0.9900 . ?
C026 H02H 0.9900 . ?
C026 C02B 1.406(11) . ?
C026 C6AA 0.601(13) . ?
C026 O00Q 1.700(12) . ?
C026 C8AA 1.817(13) . ?
C026 C1AA 1.098(13) . ?
C027 H02I 0.9900 . ?
C027 H02J 0.9900 . ?
C027 C02A 1.420(7) . ?
C027 O00Z 1.320(13) . ?
C027 C0 1.250(15) . ?
C027 C3AA 1.822(14) . ?
C029 H02K 0.9900 . ?
C029 H02L 0.9900 . ?
C029 C02B 1.443(10) . ?
C029 C7AA 1.046(11) . ?
C029 C8AA 0.762(10) . ?
C029 C1AA 1.921(12) . ?
C02A H02M 0.9900 . ?
C02A H02N 0.9900 . ?
C02A C0 2.024(14) . ?
C02A C3AA 1.692(15) . ?
C02A C0AA 1.849(16) . ?
C02A C5AA 1.09(2) . ?
C02B H02O 0.9900 . ?
C02B H02P 0.9900 . ?
C02B C6AA 1.882(13) . ?
C02B C8AA 0.755(10) . ?
C02B C1AA 0.834(13) . ?
C2AA H2AA 0.9500 . ?
C2AA C4AA 1.335(12) . ?
C4AA H4AA 0.9500 . ?
C4AA H4AB 0.9500 . ?
C10 H10 0.9500 . ?
C10 C15 1.38(2) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
O00Z C0 1.365(13) . ?
O00Z C3AA 1.424(12) . ?
C0 H0A 0.9900 . ?
C0 H0B 0.9900 . ?
C0 C0AA 1.417(12) . ?
C3AA H3AA 0.9900 . ?
C3AA H3AB 0.9900 . ?
C3AA C5AA 1.473(13) . ?
C0AA H0AA 0.9900 . ?
C0AA H0AB 0.9900 . ?
C0AA C5AA 1.445(14) . ?
C5AA H5AA 0.9900 . ?
C5AA H5AB 0.9900 . ?
C6AA H6AC 0.9900 . ?
C6AA H6AD 0.9900 . ?
C6AA O00Q 1.433(9) . ?
C6AA C1AA 1.415(10) . ?
O00Q C7AA 1.492(9) . ?
C7AA H7AA 0.9900 . ?
C7AA H7AB 0.9900 . ?
C7AA C8AA 1.522(11) . ?
C8AA H8AA 0.9900 . ?
C8AA H8AB 0.9900 . ?
C8AA C1AA 1.434(9) . ?
C1AA H1AC 0.9900 . ?
C1AA H1AD 0.9900 . ?
C1BA H1BA 0.9900 . ?
C1BA H1BB 0.9900 . ?
C1BA C2BA 1.356(11) . ?
C1BA C0BA 1.635(12) . ?
C1BA C4BA 1.54(2) . ?
C1BA C44 0.82(4) . ?
C2BA H2BA 0.9900 . ?
C2BA H2BB 0.9900 . ?
C2BA C4BA 1.96(2) . ?
C2BA C44 1.70(4) . ?
C9AA H9AA 0.9900 . ?
C9AA H9AB 0.9900 . ?
C9AA C0BA 1.464(12) . ?
C9AA O5 1.352(13) . ?
C9AA C3BA 1.95(3) . ?
C9AA C4BA 1.93(2) . ?
C9AA C44 1.80(4) . ?
C0BA H0BA 0.9900 . ?
C0BA H0BB 0.9900 . ?
C0BA C4BA 1.63(2) . ?
C0BA C44 0.90(3) . ?
O5 C3BA 1.22(2) . ?
C3BA H3BA 0.9900 . ?
C3BA H3BB 0.9900 . ?
C3BA C4BA 1.62(3) . ?
C4BA H4BA 0.9900 . ?
C4BA H4BB 0.9900 . ?
C4BA C44 1.57(4) . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Co1 N1 C00J C00N -107.1(2) . . . . ?
Co1 N1 C00J C00O 74.4(2) . . . . ?
Co1 N2 C00M C00S -94.2(2) . . . . ?
Co1 N2 C00M C00V 88.6(2) . . . . ?
K1 O005 C01I C01F 51.9(2) . . . . ?
K1 O005 C01O C01N -46.3(3) . . . . ?
K1 O006 C01N C01O -51.5(3) . . . . ?
K1 O006 C01U C01K 50.0(3) . . . . ?
K1 O009 C01F C01I 45.8(3) . . . . ?
K1 O009 C01Q C01M -47.7(3) . . . . ?
K1 O00B C01M C01Q -48.4(3) . . . . ?
K1 O00B C01R C01X 48.0(3) . . . . ?
K1 O00C C01J C01S -55.6(3) . . . . ?
K1 O00C C01K C01U 50.5(3) . . . . ?
K1 O00D C01S C01J -40.6(3) . . . . ?
K1 O00D C01X C01R 46.4(3) . . . . ?
K1 O00P C022 C029 -121.6(8) . . . . ?
K1 O00P C022 O00Q 41(4) . . . . ?
K1 O00P C022 C7AA -84.0(16) . . . . ?
K1 O00P C022 C8AA -124.6(7) . . . . ?
K1 O00P C026 C02B 126.4(11) . . . . ?
K1 O00P C026 C6AA -100(2) . . . . ?
K1 O00P C026 O00Q 160(7) . . . . ?
K1 O00P C026 C8AA 121.0(8) . . . . ?
K1 O00P C026 C1AA 165.0(10) . . . . ?
K1 O00P C6AA C026 97.9(19) . . . . ?
K1 O00P C6AA C02B 128.8(9) . . . . ?
K1 O00P C6AA O00Q -148(6) . . . . ?
K1 O00P C6AA C1AA 146.4(8) . . . . ?
K1 O00P C7AA C022 107.4(16) . . . . ?
K1 O00P C7AA C029 -139.3(10) . . . . ?
K1 O00P C7AA O00Q 68(3) . . . . ?
K1 O00P C7AA C8AA -127.0(6) . . . . ?
K1 O00Y C024 C021 -162.4(8) . . . . ?
K1 O00Y C024 O00Z -134(12) . . . . ?
K1 O00Y C024 C0 133.7(14) . . . . ?
K1 O00Y C024 C3AA -116.8(11) . . . . ?
K1 O00Y C024 C0AA 144.8(9) . . . . ?
K1 O00Y C024 C5AA -165.6(8) . . . . ?
K1 O00Y C027 C02A 160.1(7) . . . . ?
K1 O00Y C027 O00Z 77(11) . . . . ?
K1 O00Y C027 C0 -109.8(9) . . . . ?
K1 O00Y C027 C3AA 130.3(10) . . . . ?
K1 O00Y C0 C024 -138.6(10) . . . . ?
K1 O00Y C0 C027 106.2(7) . . . . ?
K1 O00Y C0 C02A 148.8(6) . . . . ?
K1 O00Y C0 O00Z 110(7) . . . . ?
K1 O00Y C0 C0AA -152.3(8) . . . . ?
K1 O00Y C3AA C021 165.0(6) . . . . ?
K1 O00Y C3AA C024 114.8(7) . . . . ?
K1 O00Y C3AA C027 -120.2(9) . . . . ?
K1 O00Y C3AA C02A -143.6(5) . . . . ?
K1 O00Y C3AA O00Z -84(11) . . . . ?
K1 O00Y C3AA C5AA 178.1(10) . . . . ?
K1 O00Z C0 O00Y -65(7) . . . . ?
K1 O00Z C0 C024 -129.4(13) . . . . ?
K1 O00Z C0 C027 111.3(10) . . . . ?
K1 O00Z C0 C02A 154.5(9) . . . . ?
K1 O00Z C0 C0AA -148.2(10) . . . . ?
K1 O00Z C3AA O00Y 90(11) . . . . ?
K1 O00Z C3AA C021 159.9(9) . . . . ?
K1 O00Z C3AA C024 108.0(12) . . . . ?
K1 O00Z C3AA C027 -128.5(16) . . . . ?
K1 O00Z C3AA C02A -149.8(10) . . . . ?
K1 O00Z C3AA C5AA 172.9(13) . . . . ?
K1 O00Q C7AA O00P -100(3) . . . . ?
K1 O00Q C7AA C022 123.9(17) . . . . ?
K1 O00Q C7AA C029 -130.2(12) . . . . ?
K1 O00Q C7AA C8AA -115.4(6) . . . . ?
Si1 N1 C00J C00N 86.7(2) . . . . ?
Si1 N1 C00J C00O -91.8(2) . . . . ?
Si1 C1 C2 C3 -104.4(5) . . . . ?
Si1 C1 C2 C2AA -124.2(4) . . . . ?
Si1 C1 C2AA C2 114.2(4) . . . . ?
Si1 C1 C2AA C4AA 95.6(9) . . . . ?
Si2 N2 C00M C00S 87.6(2) . . . . ?
Si2 N2 C00M C00V -89.6(2) . . . . ?
Si2 C4 C5 C6 -110.8(4) . . . . ?
Si2 C4 C5 C10 -117.5(9) . . . . ?
Si2 C4 C5 C15 63(3) . . . . ?
Si2 C4 C10 C5 84.0(10) . . . . ?
Si2 C4 C10 C6 70(3) . . . . ?
Si2 C4 C10 C15 84(3) . . . . ?
O006 C01N C01O O005 65.3(3) . . . . ?
N1 Si1 C1 C2 177.5(2) . . . . ?
N1 Si1 C1 C2AA 79.4(5) . . . . ?
N1 C00J C00N C011 -178.0(2) . . . . ?
N1 C00J C00N C013 1.6(3) . . . . ?
N1 C00J C00O C00Q -2.2(3) . . . . ?
N1 C00J C00O C015 177.7(2) . . . . ?
N3 C7 C00F C00L -177.3(2) . . . . ?
N3 C7 C00F C00U 4.9(3) . . . . ?
N3 C7 C00G C00H 178.8(2) . . . . ?
N3 C7 C00G C00T -3.7(3) . . . . ?
O009 C01F C01I O005 -65.5(3) . . . . ?
N2 Si2 C15 C5 162.6(13) . . . . ?
N2 Si2 C15 C10 117.1(16) . . . . ?
N2 C00M C00S C00K 1.9(3) . . . . ?
N2 C00M C00S C018 -177.2(2) . . . . ?
N2 C00M C00V C00R -4.4(3) . . . . ?
N2 C00M C00V C01A 177.3(2) . . . . ?
O00B C01M C01Q O009 65.6(3) . . . . ?
O00B C01R C01X O00D -62.6(3) . . . . ?
O00C C01J C01S O00D 64.7(3) . . . . ?
O00C C01K C01U O006 -69.0(3) . . . . ?
C7 C00F C00L C00I -2.2(3) . . . . ?
C7 C00F C00U C01W 124.1(2) . . . . ?
C7 C00F C00U C01Z -110.7(3) . . . . ?
C7 C00G C00H C00I -1.0(3) . . . . ?
C7 C00G C00T C010 126.7(2) . . . . ?
C7 C00G C00T C01C -108.7(2) . . . . ?
C00F C7 C00G C00H -0.9(3) . . . . ?
C00F C7 C00G C00T 176.53(19) . . . . ?
C00G C7 C00F C00L 2.5(3) . . . . ?
C00G C7 C00F C00U -175.36(19) . . . . ?
C00G C00H C00I C00L 1.4(4) . . . . ?
C00H C00G C00T C010 -55.9(3) . . . . ?
C00H C00G C00T C01C 68.8(3) . . . . ?
C00H C00I C00L C00F 0.3(3) . . . . ?
C00J C00N C011 C014 0.2(4) . . . . ?
C00J C00N C013 C01L 120.2(3) . . . . ?
C00J C00N C013 C01Y -116.0(3) . . . . ?
C00J C00O C00Q C00W -115.7(2) . . . . ?
C00J C00O C00Q C01D 119.7(2) . . . . ?
C00J C00O C015 C014 0.4(4) . . . . ?
C00K C00S C018 C01G -179.2(3) . . . . ?
C00L C00F C00U C01W -53.8(3) . . . . ?
C00L C00F C00U C01Z 71.4(3) . . . . ?
C00M C00S C018 C01G -0.1(4) . . . . ?
C00M C00V C01A C01G 0.0(4) . . . . ?
C00N C00J C00O C00Q 179.3(2) . . . . ?
C00N C00J C00O C015 -0.8(3) . . . . ?
C00N C011 C014 C015 -0.7(4) . . . . ?
C00O C00J C00N C011 0.5(3) . . . . ?
C00O C00J C00N C013 -179.9(2) . . . . ?
O00P C022 C029 C02B -25.5(13) . . . . ?
O00P C022 C029 C7AA 86(2) . . . . ?
O00P C022 C029 C8AA -8.3(19) . . . . ?
O00P C022 C029 C1AA -40.9(10) . . . . ?
O00P C022 O00Q K1 -129(5) . . . . ?
O00P C022 O00Q C026 9(4) . . . . ?
O00P C022 O00Q C6AA 28(4) . . . . ?
O00P C022 O00Q C7AA -56(5) . . . . ?
O00P C022 C7AA C029 -101.5(16) . . . . ?
O00P C022 C7AA O00Q 8.3(6) . . . . ?
O00P C022 C7AA C8AA -69.8(16) . . . . ?
O00P C026 C02B C029 4.5(16) . . . . ?
O00P C026 C02B C6AA 55(2) . . . . ?
O00P C026 C02B C8AA -14(2) . . . . ?
O00P C026 C02B C1AA 109.6(15) . . . . ?
O00P C026 C6AA C02B -78(3) . . . . ?
O00P C026 C6AA O00Q -7.4(7) . . . . ?
O00P C026 C6AA C1AA -109.0(13) . . . . ?
O00P C026 O00Q K1 -17(6) . . . . ?
O00P C026 O00Q C022 -165(7) . . . . ?
O00P C026 O00Q C6AA 76(7) . . . . ?
O00P C026 O00Q C7AA -143(7) . . . . ?
O00P C026 C8AA C022 19.3(7) . . . . ?
O00P C026 C8AA C029 28.3(17) . . . . ?
O00P C026 C8AA C02B 167(2) . . . . ?
O00P C026 C8AA C7AA 6.6(8) . . . . ?
O00P C026 C8AA C1AA 127.9(13) . . . . ?
O00P C026 C1AA C029 -41.6(13) . . . . ?
O00P C026 C1AA C02B -85.6(16) . . . . ?
O00P C026 C1AA C6AA 57.3(14) . . . . ?
O00P C026 C1AA C8AA -61.5(14) . . . . ?
O00P C6AA O00Q K1 28(5) . . . . ?
O00P C6AA O00Q C022 -134(6) . . . . ?
O00P C6AA O00Q C026 -68(6) . . . . ?
O00P C6AA O00Q C7AA -108(6) . . . . ?
O00P C6AA C1AA C026 -86.7(19) . . . . ?
O00P C6AA C1AA C029 -3.0(12) . . . . ?
O00P C6AA C1AA C02B -46.6(17) . . . . ?
O00P C6AA C1AA C8AA -23.3(13) . . . . ?
O00P C7AA C8AA C022 -54.0(17) . . . . ?
O00P C7AA C8AA C026 -5.7(7) . . . . ?
O00P C7AA C8AA C029 -154.9(19) . . . . ?
O00P C7AA C8AA C02B -24(2) . . . . ?
O00P C7AA C8AA C1AA -38.0(8) . . . . ?
C00Q C00O C015 C014 -179.7(2) . . . . ?
C00R C00V C01A C01G -178.3(3) . . . . ?
C00S C00M C00V C00R 178.3(2) . . . . ?
C00S C00M C00V C01A 0.1(4) . . . . ?
C00S C018 C01G C01A 0.1(5) . . . . ?
C00T C00G C00H C00I -178.5(2) . . . . ?
C00U C00F C00L C00I 175.6(2) . . . . ?
C00V C00M C00S C00K 179.1(2) . . . . ?
C00V C00M C00S C018 0.0(3) . . . . ?
C00V C01A C01G C018 -0.1(5) . . . . ?
C00X Si1 N1 Co1 -50.55(15) . . . . ?
C00X Si1 N1 C00J 115.49(17) . . . . ?
C00X Si1 C1 C2 -56.6(3) . . . . ?
C00X Si1 C1 C2AA -154.6(4) . . . . ?
O00Y C024 O00Z K1 42(10) . . . . ?
O00Y C024 O00Z C027 -135(12) . . . . ?
O00Y C024 O00Z C0 -84(11) . . . . ?
O00Y C024 O00Z C3AA 162(11) . . . . ?
O00Y C024 C3AA C021 -126.4(7) . . . . ?
O00Y C024 C3AA C027 -38.3(4) . . . . ?
O00Y C024 C3AA C02A -85.5(7) . . . . ?
O00Y C024 C3AA O00Z -1.4(7) . . . . ?
O00Y C024 C3AA C5AA -115.7(9) . . . . ?
O00Y C024 C0AA C021 109.4(7) . . . . ?
O00Y C024 C0AA C02A 65.6(6) . . . . ?
O00Y C024 C0AA C0 -10.9(9) . . . . ?
O00Y C024 C0AA C5AA 98.9(10) . . . . ?
O00Y C024 C5AA C02A -0.3(13) . . . . ?
O00Y C024 C5AA C3AA 55.0(9) . . . . ?
O00Y C024 C5AA C0AA -82.3(10) . . . . ?
O00Y C027 C02A C021 11.9(11) . . . . ?
O00Y C027 C02A C0 62.2(9) . . . . ?
O00Y C027 C02A C3AA -26.7(9) . . . . ?
O00Y C027 C02A C0AA 56.1(8) . . . . ?
O00Y C027 C02A C5AA 16.1(14) . . . . ?
O00Y C027 O00Z K1 -100(11) . . . . ?
O00Y C027 O00Z C024 77(11) . . . . ?
O00Y C027 O00Z C0 6(11) . . . . ?
O00Y C027 O00Z C3AA 124(11) . . . . ?
O00Y C027 C0 C024 -40.9(4) . . . . ?
O00Y C027 C0 C02A -105.2(6) . . . . ?
O00Y C027 C0 O00Z -0.4(7) . . . . ?
O00Y C027 C0 C0AA -97.1(11) . . . . ?
O00Y C027 C3AA C021 111.9(10) . . . . ?
O00Y C027 C3AA C024 45.4(7) . . . . ?
O00Y C027 C3AA C02A 147.3(9) . . . . ?
O00Y C027 C3AA O00Z -3.2(12) . . . . ?
O00Y C027 C3AA C5AA 119.1(12) . . . . ?
O00Y C0 C0AA C021 -36.9(15) . . . . ?
O00Y C0 C0AA C024 11.7(10) . . . . ?
O00Y C0 C0AA C02A -73.8(10) . . . . ?
O00Y C0 C0AA C5AA -49.1(16) . . . . ?
O00Y C3AA C5AA C024 -53.5(8) . . . . ?
O00Y C3AA C5AA C02A 75.9(13) . . . . ?
O00Y C3AA C5AA C0AA -14.6(18) . . . . ?
C00Z C00K C00S C00M -106.8(2) . . . . ?
C00Z C00K C00S C018 72.4(3) . . . . ?
C011 C00N C013 C01L -60.2(3) . . . . ?
C011 C00N C013 C01Y 63.6(3) . . . . ?
C011 C014 C015 C00O 0.4(4) . . . . ?
C1 Si1 N1 Co1 70.95(14) . . . . ?
C1 Si1 N1 C00J -123.02(17) . . . . ?
C1 C2 C3 C4AA -15.6(7) . . . . ?
C1 C2AA C4AA C3 13.3(11) . . . . ?
C013 C00N C011 C014 -179.4(2) . . . . ?
C015 C00O C00Q C00W 64.4(3) . . . . ?
C015 C00O C00Q C01D -60.2(3) . . . . ?
C016 C00R C00V C00M -87.7(3) . . . . ?
C016 C00R C00V C01A 90.6(3) . . . . ?
C017 C00K C00S C00M 129.6(2) . . . . ?
C017 C00K C00S C018 -51.3(3) . . . . ?
C019 Si2 N2 Co1 -52.44(15) . . . . ?
C019 Si2 N2 C00M 125.75(17) . . . . ?
C019 Si2 C15 C5 31.8(17) . . . . ?
C019 Si2 C15 C10 -13.7(19) . . . . ?
C01B Si2 N2 Co1 69.33(14) . . . . ?
C01B Si2 N2 C00M -112.49(17) . . . . ?
C01B Si2 C15 C5 -78.9(15) . . . . ?
C01B Si2 C15 C10 -124.4(17) . . . . ?
C4 Si2 N2 Co1 -167.20(19) . . . . ?
C4 Si2 N2 C00M 11.0(2) . . . . ?
C4 Si2 C15 C5 98(4) . . . . ?
C4 Si2 C15 C10 52(3) . . . . ?
C4 C5 C6 C10 -5.8(7) . . . . ?
C4 C5 C10 C6 174.0(7) . . . . ?
C4 C5 C10 C15 -0.1(12) . . . . ?
C4 C5 C15 Si2 -93(4) . . . . ?
C4 C5 C15 C10 0(3) . . . . ?
C4 C10 C15 Si2 -69(3) . . . . ?
C4 C10 C15 C5 -180(4) . . . . ?
C01F O009 C01Q C01M 178.6(2) . . . . ?
C01H Si1 N1 Co1 -169.31(13) . . . . ?
C01H Si1 N1 C00J -3.3(2) . . . . ?
C01H Si1 C1 C2 55.2(3) . . . . ?
C01H Si1 C1 C2AA -42.8(5) . . . . ?
C01I O005 C01O C01N -179.5(2) . . . . ?
C01J O00C C01K C01U 177.2(2) . . . . ?
C01K O00C C01J C01S 176.9(2) . . . . ?
C01M O00B C01R C01X 178.3(2) . . . . ?
C01N O006 C01U C01K -179.4(3) . . . . ?
C01O O005 C01I C01F -174.2(2) . . . . ?
C5 C4 C10 C6 -14.1(19) . . . . ?
C5 C4 C10 C15 0(3) . . . . ?
C5 C6 C10 C4 15(2) . . . . ?
C5 C6 C10 C15 8.1(15) . . . . ?
C5 C10 C15 Si2 110.6(15) . . . . ?
C01Q O009 C01F C01I 179.2(2) . . . . ?
C01R O00B C01M C01Q -179.2(2) . . . . ?
C01S O00D C01X C01R -173.1(2) . . . . ?
C6 C5 C10 C4 -174.0(7) . . . . ?
C6 C5 C10 C15 -174.1(11) . . . . ?
C6 C5 C15 Si2 -84.4(18) . . . . ?
C6 C5 C15 C10 8.8(16) . . . . ?
C6 C10 C15 Si2 102(2) . . . . ?
C6 C10 C15 C5 -8.2(16) . . . . ?
C01U O006 C01N C01O 179.0(3) . . . . ?
C01V C00R C00V C00M 147.7(2) . . . . ?
C01V C00R C00V C01A -34.0(4) . . . . ?
C01X O00D C01S C01J 178.8(2) . . . . ?
C2 C1 C2AA C4AA -18.7(9) . . . . ?
C2 C3 C4AA C2AA 1.3(8) . . . . ?
C2 C2AA C4AA C3 -0.9(5) . . . . ?
C021 C024 O00Z K1 -166.0(8) . . . . ?
C021 C024 O00Z C027 17.7(12) . . . . ?
C021 C024 O00Z C0 68.6(10) . . . . ?
C021 C024 O00Z C3AA -45.8(8) . . . . ?
C021 C024 C3AA O00Y 126.4(7) . . . . ?
C021 C024 C3AA C027 88.2(6) . . . . ?
C021 C024 C3AA C02A 40.9(5) . . . . ?
C021 C024 C3AA O00Z 125.0(8) . . . . ?
C021 C024 C3AA C5AA 10.8(8) . . . . ?
C021 C024 C0AA C02A -43.8(5) . . . . ?
C021 C024 C0AA C0 -120.3(11) . . . . ?
C021 C024 C0AA C5AA -10.5(10) . . . . ?
C021 C024 C5AA C02A -161(6) . . . . ?
C021 C024 C5AA C3AA -106(5) . . . . ?
C021 C024 C5AA C0AA 117(5) . . . . ?
C021 C02A C3AA O00Y -109.1(10) . . . . ?
C021 C02A C3AA C024 -49.1(8) . . . . ?
C021 C02A C3AA C027 -133.2(8) . . . . ?
C021 C02A C3AA O00Z -112.4(11) . . . . ?
C021 C02A C3AA C5AA 0.2(12) . . . . ?
C021 C02A C0AA C024 50.6(5) . . . . ?
C021 C02A C0AA C0 129.4(10) . . . . ?
C021 C02A C0AA C5AA -6.8(11) . . . . ?
C021 C02A C5AA C024 37(10) . . . . ?
C021 C02A C5AA C3AA -2(10) . . . . ?
C021 C02A C5AA C0AA 101(10) . . . . ?
C021 C3AA C5AA C024 50(3) . . . . ?
C021 C3AA C5AA C02A 179(4) . . . . ?
C021 C3AA C5AA C0AA 89(4) . . . . ?
C021 C0AA C5AA C024 -43(3) . . . . ?
C021 C0AA C5AA C02A -156(4) . . . . ?
C021 C0AA C5AA C3AA -75(3) . . . . ?
C022 O00P C026 C02B -21.1(15) . . . . ?
C022 O00P C026 C6AA 113(2) . . . . ?
C022 O00P C026 O00Q 13(6) . . . . ?
C022 O00P C026 C8AA -26.5(10) . . . . ?
C022 O00P C026 C1AA 17.5(17) . . . . ?
C022 O00P C6AA C026 -76(2) . . . . ?
C022 O00P C6AA C02B -45.2(13) . . . . ?
C022 O00P C6AA O00Q 38(5) . . . . ?
C022 O00P C6AA C1AA -27.6(16) . . . . ?
C022 O00P C7AA C029 113(2) . . . . ?
C022 O00P C7AA O00Q -40(3) . . . . ?
C022 O00P C7AA C8AA 125.6(18) . . . . ?
C022 C029 C02B C026 13.3(15) . . . . ?
C022 C029 C02B C6AA 3.1(11) . . . . ?
C022 C029 C02B C8AA 118(3) . . . . ?
C022 C029 C02B C1AA -41.2(15) . . . . ?
C022 C029 C7AA O00P -67.8(17) . . . . ?
C022 C029 C7AA O00Q -62.3(16) . . . . ?
C022 C029 C7AA C8AA -96(3) . . . . ?
C022 C029 C8AA C026 -12(2) . . . . ?
C022 C029 C8AA C02B -68(3) . . . . ?
C022 C029 C8AA C7AA 23.6(9) . . . . ?
C022 C029 C8AA C1AA -55.2(17) . . . . ?
C022 O00Q C7AA O00P 136(3) . . . . ?
C022 O00Q C7AA C029 106(2) . . . . ?
C022 O00Q C7AA C8AA 120.7(19) . . . . ?
C022 C7AA C8AA C026 48.3(19) . . . . ?
C022 C7AA C8AA C029 -101(3) . . . . ?
C022 C7AA C8AA C02B 30(3) . . . . ?
C022 C7AA C8AA C1AA 16(2) . . . . ?
C022 C8AA C1AA C026 66.8(9) . . . . ?
C022 C8AA C1AA C029 -35.3(11) . . . . ?
C022 C8AA C1AA C02B 161(2) . . . . ?
C022 C8AA C1AA C6AA 45.8(8) . . . . ?
C024 O00Y C027 C02A -15.7(11) . . . . ?
C024 O00Y C027 O00Z -99(11) . . . . ?
C024 O00Y C027 C0 74.4(9) . . . . ?
C024 O00Y C027 C3AA -45.5(7) . . . . ?
C024 O00Y C0 C027 -115.2(6) . . . . ?
C024 O00Y C0 C02A -72.6(6) . . . . ?
C024 O00Y C0 O00Z -111(7) . . . . ?
C024 O00Y C0 C0AA -13.7(12) . . . . ?
C024 O00Y C3AA C021 50.2(8) . . . . ?
C024 O00Y C3AA C027 125.0(7) . . . . ?
C024 O00Y C3AA C02A 101.6(6) . . . . ?
C024 O00Y C3AA O00Z 161(11) . . . . ?
C024 O00Y C3AA C5AA 63.3(12) . . . . ?
C024 C021 C02A C027 -3.8(11) . . . . ?
C024 C021 C02A C0 -32.1(7) . . . . ?
C024 C021 C02A C3AA 43.1(6) . . . . ?
C024 C021 C02A C0AA -63.8(7) . . . . ?
C024 C021 C02A C5AA -139(11) . . . . ?
C024 C021 C3AA O00Y -46.6(7) . . . . ?
C024 C021 C3AA C027 -93.4(5) . . . . ?
C024 C021 C3AA C02A -126.0(7) . . . . ?
C024 C021 C3AA O00Z -50.4(9) . . . . ?
C024 C021 C3AA C5AA -127(4) . . . . ?
C024 C021 C0AA C02A 112.9(5) . . . . ?
C024 C021 C0AA C0 61.6(10) . . . . ?
C024 C021 C0AA C5AA 131(3) . . . . ?
C024 O00Z C0 O00Y 65(7) . . . . ?
C024 O00Z C0 C027 -119.4(7) . . . . ?
C024 O00Z C0 C02A -76.1(6) . . . . ?
C024 O00Z C0 C0AA -18.8(13) . . . . ?
C024 O00Z C3AA O00Y -18(11) . . . . ?
C024 O00Z C3AA C021 51.9(9) . . . . ?
C024 O00Z C3AA C027 123.6(8) . . . . ?
C024 O00Z C3AA C02A 102.3(6) . . . . ?
C024 O00Z C3AA C5AA 64.9(12) . . . . ?
C024 C0 C0AA C021 -48.5(7) . . . . ?
C024 C0 C0AA C02A -85.5(4) . . . . ?
C024 C0 C0AA C5AA -60.8(10) . . . . ?
C024 C3AA C5AA C02A 129.4(10) . . . . ?
C024 C3AA C5AA C0AA 38.9(13) . . . . ?
C024 C0AA C5AA C02A -113.0(9) . . . . ?
C024 C0AA C5AA C3AA -31.7(11) . . . . ?
C026 O00P C022 C029 28.3(14) . . . . ?
C026 O00P C022 O00Q -169(5) . . . . ?
C026 O00P C022 C7AA 65.9(19) . . . . ?
C026 O00P C022 C8AA 25.2(10) . . . . ?
C026 O00P C6AA C02B 30.9(16) . . . . ?
C026 O00P C6AA O00Q 114(6) . . . . ?
C026 O00P C6AA C1AA 48.5(16) . . . . ?
C026 O00P C7AA C022 -118.3(17) . . . . ?
C026 O00P C7AA C029 -5.1(15) . . . . ?
C026 O00P C7AA O00Q -158(4) . . . . ?
C026 O00P C7AA C8AA 7.3(9) . . . . ?
C026 C02B C6AA O00P -107(3) . . . . ?
C026 C02B C6AA O00Q -114(3) . . . . ?
C026 C02B C6AA C1AA 116(3) . . . . ?
C026 C02B C8AA C022 35(2) . . . . ?
C026 C02B C8AA C029 81(3) . . . . ?
C026 C02B C8AA C7AA 26(3) . . . . ?
C026 C02B C8AA C1AA 56.5(16) . . . . ?
C026 C02B C1AA C029 -94.6(12) . . . . ?
C026 C02B C1AA C6AA -15.0(7) . . . . ?
C026 C02B C1AA C8AA -87(2) . . . . ?
C026 C6AA O00Q K1 95.3(19) . . . . ?
C026 C6AA O00Q C022 -66(2) . . . . ?
C026 C6AA O00Q C7AA -41(2) . . . . ?
C026 C6AA C1AA C029 83.8(17) . . . . ?
C026 C6AA C1AA C02B 40(2) . . . . ?
C026 C6AA C1AA C8AA 63.4(18) . . . . ?
C026 O00Q C7AA O00P 18(3) . . . . ?
C026 O00Q C7AA C022 -117.4(17) . . . . ?
C026 O00Q C7AA C029 -11.5(14) . . . . ?
C026 O00Q C7AA C8AA 3.3(8) . . . . ?
C026 C8AA C1AA C029 -102.1(15) . . . . ?
C026 C8AA C1AA C02B 94(2) . . . . ?
C026 C8AA C1AA C6AA -21.0(8) . . . . ?
C027 O00Y C024 C021 12.9(11) . . . . ?
C027 O00Y C024 O00Z 41(10) . . . . ?
C027 O00Y C024 C0 -51.0(8) . . . . ?
C027 O00Y C024 C3AA 58.6(9) . . . . ?
C027 O00Y C024 C0AA -39.9(9) . . . . ?
C027 O00Y C024 C5AA 9.7(10) . . . . ?
C027 O00Y C0 C024 115.2(6) . . . . ?
C027 O00Y C0 C02A 42.5(4) . . . . ?
C027 O00Y C0 O00Z 4(7) . . . . ?
C027 O00Y C0 C0AA 101.5(11) . . . . ?
C027 O00Y C3AA C021 -74.9(10) . . . . ?
C027 O00Y C3AA C024 -125.0(7) . . . . ?
C027 O00Y C3AA C02A -23.5(7) . . . . ?
C027 O00Y C3AA O00Z 36(10) . . . . ?
C027 O00Y C3AA C5AA -61.7(13) . . . . ?
C027 C02A C3AA O00Y 24.1(7) . . . . ?
C027 C02A C3AA C021 133.2(8) . . . . ?
C027 C02A C3AA C024 84.1(6) . . . . ?
C027 C02A C3AA O00Z 20.8(9) . . . . ?
C027 C02A C3AA C5AA 133.4(12) . . . . ?
C027 C02A C0AA C021 -123.9(7) . . . . ?
C027 C02A C0AA C024 -73.4(5) . . . . ?
C027 C02A C0AA C0 5.5(8) . . . . ?
C027 C02A C0AA C5AA -130.7(11) . . . . ?
C027 C02A C5AA C024 -9.4(15) . . . . ?
C027 C02A C5AA C3AA -48.4(11) . . . . ?
C027 C02A C5AA C0AA 54.3(12) . . . . ?
C027 O00Z C0 O00Y -176(8) . . . . ?
C027 O00Z C0 C024 119.4(7) . . . . ?
C027 O00Z C0 C02A 43.2(4) . . . . ?
C027 O00Z C0 C0AA 100.6(12) . . . . ?
C027 O00Z C3AA O00Y -142(11) . . . . ?
C027 O00Z C3AA C021 -71.6(12) . . . . ?
C027 O00Z C3AA C024 -123.6(8) . . . . ?
C027 O00Z C3AA C02A -21.3(8) . . . . ?
C027 O00Z C3AA C5AA -58.7(15) . . . . ?
C027 C0 C0AA C021 30.5(15) . . . . ?
C027 C0 C0AA C024 79.1(9) . . . . ?
C027 C0 C0AA C02A -6.4(9) . . . . ?
C027 C0 C0AA C5AA 18.3(16) . . . . ?
C027 C3AA C5AA C024 -96.3(5) . . . . ?
C027 C3AA C5AA C02A 33.1(8) . . . . ?
C027 C3AA C5AA C0AA -57.4(13) . . . . ?
C029 C022 O00Q K1 -111.1(10) . . . . ?
C029 C022 O00Q C026 27.3(12) . . . . ?
C029 C022 O00Q C6AA 45.9(13) . . . . ?
C029 C022 O00Q C7AA -38.2(11) . . . . ?
C029 C022 C7AA O00P 101.5(16) . . . . ?
C029 C022 C7AA O00Q 109.8(16) . . . . ?
C029 C022 C7AA C8AA 31.8(9) . . . . ?
C029 C02B C6AA O00P 24.7(12) . . . . ?
C029 C02B C6AA C026 131(3) . . . . ?
C029 C02B C6AA O00Q 16.9(10) . . . . ?
C029 C02B C6AA C1AA -112.9(16) . . . . ?
C029 C02B C8AA C022 -46(2) . . . . ?
C029 C02B C8AA C026 -81(3) . . . . ?
C029 C02B C8AA C7AA -55(2) . . . . ?
C029 C02B C8AA C1AA -25(4) . . . . ?
C029 C02B C1AA C026 94.6(12) . . . . ?
C029 C02B C1AA C6AA 79.6(13) . . . . ?
C029 C02B C1AA C8AA 8.0(15) . . . . ?
C029 C7AA C8AA C022 101(3) . . . . ?
C029 C7AA C8AA C026 149.2(19) . . . . ?
C029 C7AA C8AA C02B 130(3) . . . . ?
C029 C7AA C8AA C1AA 117(2) . . . . ?
C029 C8AA C1AA C026 102.1(15) . . . . ?
C029 C8AA C1AA C02B -164(3) . . . . ?
C029 C8AA C1AA C6AA 81.1(15) . . . . ?
C02A C021 C024 O00Y -5.5(10) . . . . ?
C02A C021 C024 O00Z -7.4(10) . . . . ?
C02A C021 C024 C0 33.2(8) . . . . ?
C02A C021 C024 C3AA -54.2(9) . . . . ?
C02A C021 C024 C0AA 71.0(8) . . . . ?
C02A C021 C024 C5AA 14(4) . . . . ?
C02A C021 C3AA O00Y 79.4(10) . . . . ?
C02A C021 C3AA C024 126.0(7) . . . . ?
C02A C021 C3AA C027 32.5(6) . . . . ?
C02A C021 C3AA O00Z 75.6(12) . . . . ?
C02A C021 C3AA C5AA -1(3) . . . . ?
C02A C021 C0AA C024 -112.9(5) . . . . ?
C02A C021 C0AA C0 -51.3(11) . . . . ?
C02A C021 C0AA C5AA 18(3) . . . . ?
C02A C027 O00Z K1 162.8(8) . . . . ?
C02A C027 O00Z C024 -20.8(13) . . . . ?
C02A C027 O00Z C0 -91.2(8) . . . . ?
C02A C027 O00Z C3AA 26.9(10) . . . . ?
C02A C027 C0 O00Y 105.2(6) . . . . ?
C02A C027 C0 C024 64.4(6) . . . . ?
C02A C027 C0 O00Z 104.9(7) . . . . ?
C02A C027 C0 C0AA 8.2(12) . . . . ?
C02A C027 C3AA O00Y -147.3(9) . . . . ?
C02A C027 C3AA C021 -35.4(6) . . . . ?
C02A C027 C3AA C024 -101.9(7) . . . . ?
C02A C027 C3AA O00Z -150.5(11) . . . . ?
C02A C027 C3AA C5AA -28.2(9) . . . . ?
C02A C0 C0AA C021 36.9(7) . . . . ?
C02A C0 C0AA C024 85.5(4) . . . . ?
C02A C0 C0AA C5AA 24.7(10) . . . . ?
C02A C3AA C5AA C024 -129.4(10) . . . . ?
C02A C3AA C5AA C0AA -90.5(14) . . . . ?
C02A C0AA C5AA C024 113.0(9) . . . . ?
C02A C0AA C5AA C3AA 81.3(13) . . . . ?
C02B C026 C6AA O00P 78(3) . . . . ?
C02B C026 C6AA O00Q 71(3) . . . . ?
C02B C026 C6AA C1AA -30.6(17) . . . . ?
C02B C026 O00Q K1 129.8(9) . . . . ?
C02B C026 O00Q C022 -17.9(13) . . . . ?
C02B C026 O00Q C6AA -137(3) . . . . ?
C02B C026 O00Q C7AA 4.1(11) . . . . ?
C02B C026 C8AA C022 -147(2) . . . . ?
C02B C026 C8AA C029 -138(3) . . . . ?
C02B C026 C8AA C7AA -160(2) . . . . ?
C02B C026 C8AA C1AA -38.6(18) . . . . ?
C02B C026 C1AA C029 44.1(8) . . . . ?
C02B C026 C1AA C6AA 143.0(18) . . . . ?
C02B C026 C1AA C8AA 24.1(8) . . . . ?
C02B C029 C7AA O00P 8.3(17) . . . . ?
C02B C029 C7AA C022 76(2) . . . . ?
C02B C029 C7AA O00Q 13.8(18) . . . . ?
C02B C029 C7AA C8AA -19.4(12) . . . . ?
C02B C029 C8AA C022 68(3) . . . . ?
C02B C029 C8AA C026 55(2) . . . . ?
C02B C029 C8AA C7AA 91(3) . . . . ?
C02B C029 C8AA C1AA 12.4(19) . . . . ?
C02B C6AA O00Q K1 125.0(5) . . . . ?
C02B C6AA O00Q C022 -36.7(11) . . . . ?
C02B C6AA O00Q C026 29.7(17) . . . . ?
C02B C6AA O00Q C7AA -11.2(8) . . . . ?
C02B C6AA C1AA C026 -40(2) . . . . ?
C02B C6AA C1AA C029 43.7(10) . . . . ?
C02B C6AA C1AA C8AA 23.4(9) . . . . ?
C02B C8AA C1AA C026 -94(2) . . . . ?
C02B C8AA C1AA C029 164(3) . . . . ?
C02B C8AA C1AA C6AA -115(2) . . . . ?
C2AA C1 C2 C3 19.8(6) . . . . ?
C2AA C2 C3 C4AA -0.9(5) . . . . ?
C10 C4 C5 C6 6.7(8) . . . . ?
C10 C4 C5 C15 -180(4) . . . . ?
C10 C5 C15 Si2 -93.2(17) . . . . ?
C15 Si2 N2 Co1 179.7(7) . . . . ?
C15 Si2 N2 C00M -2.1(7) . . . . ?
C15 C5 C6 C10 -8.9(16) . . . . ?
C15 C5 C10 C4 0.1(12) . . . . ?
C15 C5 C10 C6 174.1(11) . . . . ?
O00Z C024 C3AA O00Y 1.4(7) . . . . ?
O00Z C024 C3AA C021 -125.0(8) . . . . ?
O00Z C024 C3AA C027 -36.9(5) . . . . ?
O00Z C024 C3AA C02A -84.1(7) . . . . ?
O00Z C024 C3AA C5AA -114.3(10) . . . . ?
O00Z C024 C0AA C021 105.4(8) . . . . ?
O00Z C024 C0AA C02A 61.6(7) . . . . ?
O00Z C024 C0AA C0 -15.0(10) . . . . ?
O00Z C024 C0AA C5AA 94.8(11) . . . . ?
O00Z C024 C5AA C02A -2.4(13) . . . . ?
O00Z C024 C5AA C3AA 52.9(9) . . . . ?
O00Z C024 C5AA C0AA -84.5(10) . . . . ?
O00Z C027 C02A C021 15.0(12) . . . . ?
O00Z C027 C02A C0 65.4(9) . . . . ?
O00Z C027 C02A C3AA -23.6(10) . . . . ?
O00Z C027 C02A C0AA 59.3(9) . . . . ?
O00Z C027 C02A C5AA 19.2(15) . . . . ?
O00Z C027 C0 O00Y 0.4(7) . . . . ?
O00Z C027 C0 C024 -40.5(5) . . . . ?
O00Z C027 C0 C02A -104.9(7) . . . . ?
O00Z C027 C0 C0AA -96.7(11) . . . . ?
O00Z C027 C3AA O00Y 3.2(12) . . . . ?
O00Z C027 C3AA C021 115.1(12) . . . . ?
O00Z C027 C3AA C024 48.5(9) . . . . ?
O00Z C027 C3AA C02A 150.5(11) . . . . ?
O00Z C027 C3AA C5AA 122.3(14) . . . . ?
O00Z C0 C0AA C021 -32.0(16) . . . . ?
O00Z C0 C0AA C024 16.5(12) . . . . ?
O00Z C0 C0AA C02A -69.0(12) . . . . ?
O00Z C0 C0AA C5AA -44.3(17) . . . . ?
O00Z C3AA C5AA C024 -57.5(10) . . . . ?
O00Z C3AA C5AA C02A 71.9(15) . . . . ?
O00Z C3AA C5AA C0AA -19(2) . . . . ?
C0 O00Y C024 C021 63.9(10) . . . . ?
C0 O00Y C024 O00Z 92(11) . . . . ?
C0 O00Y C024 C3AA 109.5(10) . . . . ?
C0 O00Y C024 C0AA 11.1(9) . . . . ?
C0 O00Y C024 C5AA 60.7(9) . . . . ?
C0 O00Y C027 C02A -90.1(8) . . . . ?
C0 O00Y C027 O00Z -174(11) . . . . ?
C0 O00Y C027 C3AA -119.9(8) . . . . ?
C0 O00Y C3AA C021 -28.2(15) . . . . ?
C0 O00Y C3AA C024 -78.4(11) . . . . ?
C0 O00Y C3AA C027 46.6(8) . . . . ?
C0 O00Y C3AA C02A 23.1(12) . . . . ?
C0 O00Y C3AA O00Z 83(11) . . . . ?
C0 O00Y C3AA C5AA -15.1(17) . . . . ?
C0 C024 O00Z K1 125.4(14) . . . . ?
C0 C024 O00Z C027 -50.9(8) . . . . ?
C0 C024 O00Z C3AA -114.5(11) . . . . ?
C0 C024 C3AA O00Y 40.9(5) . . . . ?
C0 C024 C3AA C021 -85.5(5) . . . . ?
C0 C024 C3AA C027 2.6(5) . . . . ?
C0 C024 C3AA C02A -44.6(6) . . . . ?
C0 C024 C3AA O00Z 39.5(6) . . . . ?
C0 C024 C3AA C5AA -74.8(8) . . . . ?
C0 C024 C0AA C021 120.3(11) . . . . ?
C0 C024 C0AA C02A 76.5(9) . . . . ?
C0 C024 C0AA C5AA 109.8(13) . . . . ?
C0 C024 C5AA C02A 38.5(11) . . . . ?
C0 C024 C5AA C3AA 93.8(9) . . . . ?
C0 C024 C5AA C0AA -43.5(8) . . . . ?
C0 C027 C02A C021 -50.4(11) . . . . ?
C0 C027 C02A C3AA -89.0(9) . . . . ?
C0 C027 C02A C0AA -6.1(9) . . . . ?
C0 C027 C02A C5AA -46.2(14) . . . . ?
C0 C027 O00Z K1 -106.0(10) . . . . ?
C0 C027 O00Z C024 70.4(10) . . . . ?
C0 C027 O00Z C3AA 118.1(9) . . . . ?
C0 C027 C3AA O00Y -49.5(8) . . . . ?
C0 C027 C3AA C021 62.4(9) . . . . ?
C0 C027 C3AA C024 -4.1(7) . . . . ?
C0 C027 C3AA C02A 97.9(8) . . . . ?
C0 C027 C3AA O00Z -52.6(9) . . . . ?
C0 C027 C3AA C5AA 69.6(11) . . . . ?
C0 C02A C3AA O00Y -15.3(7) . . . . ?
C0 C02A C3AA C021 93.8(8) . . . . ?
C0 C02A C3AA C024 44.7(6) . . . . ?
C0 C02A C3AA C027 -39.3(5) . . . . ?
C0 C02A C3AA O00Z -18.6(9) . . . . ?
C0 C02A C3AA C5AA 94.1(11) . . . . ?
C0 C02A C0AA C021 -129.4(10) . . . . ?
C0 C02A C0AA C024 -78.9(7) . . . . ?
C0 C02A C0AA C5AA -136.2(13) . . . . ?
C0 C02A C5AA C024 -35.7(9) . . . . ?
C0 C02A C5AA C3AA -74.6(6) . . . . ?
C0 C02A C5AA C0AA 28.0(8) . . . . ?
C0 O00Z C3AA O00Y -92(11) . . . . ?
C0 O00Z C3AA C021 -21.6(18) . . . . ?
C0 O00Z C3AA C024 -73.6(13) . . . . ?
C0 O00Z C3AA C027 50.0(10) . . . . ?
C0 O00Z C3AA C02A 28.7(15) . . . . ?
C0 O00Z C3AA C5AA -9(2) . . . . ?
C0 C0AA C5AA C024 69.9(11) . . . . ?
C0 C0AA C5AA C02A -43.2(14) . . . . ?
C0 C0AA C5AA C3AA 38.2(18) . . . . ?
C3AA O00Y C024 C021 -45.6(8) . . . . ?
C3AA O00Y C024 O00Z -17(11) . . . . ?
C3AA O00Y C024 C0 -109.5(10) . . . . ?
C3AA O00Y C024 C0AA -98.4(7) . . . . ?
C3AA O00Y C024 C5AA -48.8(7) . . . . ?
C3AA O00Y C027 C02A 29.8(9) . . . . ?
C3AA O00Y C027 O00Z -54(11) . . . . ?
C3AA O00Y C027 C0 119.9(8) . . . . ?
C3AA O00Y C0 C024 53.3(8) . . . . ?
C3AA O00Y C0 C027 -61.9(10) . . . . ?
C3AA O00Y C0 C02A -19.4(10) . . . . ?
C3AA O00Y C0 O00Z -58(7) . . . . ?
C3AA O00Y C0 C0AA 39.6(15) . . . . ?
C3AA C021 C024 O00Y 48.7(9) . . . . ?
C3AA C021 C024 O00Z 46.7(8) . . . . ?
C3AA C021 C024 C0 87.4(8) . . . . ?
C3AA C021 C024 C0AA 125.2(9) . . . . ?
C3AA C021 C024 C5AA 68(5) . . . . ?
C3AA C021 C02A C027 -47.0(8) . . . . ?
C3AA C021 C02A C0 -75.2(6) . . . . ?
C3AA C021 C02A C0AA -107.0(7) . . . . ?
C3AA C021 C02A C5AA 178(11) . . . . ?
C3AA C021 C0AA C024 -42.7(8) . . . . ?
C3AA C021 C0AA C02A 70.2(9) . . . . ?
C3AA C021 C0AA C0 18.9(15) . . . . ?
C3AA C021 C0AA C5AA 89(3) . . . . ?
C3AA C024 O00Z K1 -120.2(11) . . . . ?
C3AA C024 O00Z C027 63.5(11) . . . . ?
C3AA C024 O00Z C0 114.5(11) . . . . ?
C3AA C024 C0AA C021 45.1(7) . . . . ?
C3AA C024 C0AA C02A 1.3(6) . . . . ?
C3AA C024 C0AA C0 -75.2(9) . . . . ?
C3AA C024 C0AA C5AA 34.6(10) . . . . ?
C3AA C024 C5AA C02A -55.3(13) . . . . ?
C3AA C024 C5AA C0AA -137.3(13) . . . . ?
C3AA C027 C02A C021 38.6(8) . . . . ?
C3AA C027 C02A C0 89.0(9) . . . . ?
C3AA C027 C02A C0AA 82.9(7) . . . . ?
C3AA C027 C02A C5AA 42.8(11) . . . . ?
C3AA C027 O00Z K1 135.9(13) . . . . ?
C3AA C027 O00Z C024 -47.7(7) . . . . ?
C3AA C027 O00Z C0 -118.1(9) . . . . ?
C3AA C027 C0 O00Y 43.7(5) . . . . ?
C3AA C027 C0 C024 2.8(5) . . . . ?
C3AA C027 C0 C02A -61.6(5) . . . . ?
C3AA C027 C0 O00Z 43.3(6) . . . . ?
C3AA C027 C0 C0AA -53.4(11) . . . . ?
C3AA C02A C0AA C021 -51.6(6) . . . . ?
C3AA C02A C0AA C024 -1.0(5) . . . . ?
C3AA C02A C0AA C0 77.8(8) . . . . ?
C3AA C02A C0AA C5AA -58.4(10) . . . . ?
C3AA C02A C5AA C024 38.9(7) . . . . ?
C3AA C02A C5AA C0AA 102.6(9) . . . . ?
C3AA O00Z C0 O00Y 117(8) . . . . ?
C3AA O00Z C0 C024 52.0(10) . . . . ?
C3AA O00Z C0 C027 -67.4(12) . . . . ?
C3AA O00Z C0 C02A -24.2(13) . . . . ?
C3AA O00Z C0 C0AA 33.2(18) . . . . ?
C0AA C021 C024 O00Y -76.5(9) . . . . ?
C0AA C021 C024 O00Z -78.4(9) . . . . ?
C0AA C021 C024 C0 -37.8(7) . . . . ?
C0AA C021 C024 C3AA -125.2(9) . . . . ?
C0AA C021 C024 C5AA -57(5) . . . . ?
C0AA C021 C02A C027 60.0(8) . . . . ?
C0AA C021 C02A C0 31.7(5) . . . . ?
C0AA C021 C02A C3AA 107.0(7) . . . . ?
C0AA C021 C02A C5AA -75(10) . . . . ?
C0AA C021 C3AA O00Y 4.8(13) . . . . ?
C0AA C021 C3AA C024 51.4(9) . . . . ?
C0AA C021 C3AA C027 -42.0(10) . . . . ?
C0AA C021 C3AA C02A -74.6(8) . . . . ?
C0AA C021 C3AA O00Z 1.0(15) . . . . ?
C0AA C021 C3AA C5AA -75(3) . . . . ?
C0AA C024 O00Z K1 140.5(9) . . . . ?
C0AA C024 O00Z C027 -35.8(11) . . . . ?
C0AA C024 O00Z C0 15.2(10) . . . . ?
C0AA C024 O00Z C3AA -99.3(7) . . . . ?
C0AA C024 C3AA O00Y 84.1(6) . . . . ?
C0AA C024 C3AA C021 -42.3(6) . . . . ?
C0AA C024 C3AA C027 45.8(5) . . . . ?
C0AA C024 C3AA C02A -1.4(7) . . . . ?
C0AA C024 C3AA O00Z 82.7(6) . . . . ?
C0AA C024 C3AA C5AA -31.6(8) . . . . ?
C0AA C024 C5AA C02A 82.1(13) . . . . ?
C0AA C024 C5AA C3AA 137.3(13) . . . . ?
C0AA C02A C3AA O00Y -58.6(8) . . . . ?
C0AA C02A C3AA C021 50.4(6) . . . . ?
C0AA C02A C3AA C024 1.3(6) . . . . ?
C0AA C02A C3AA C027 -82.7(5) . . . . ?
C0AA C02A C3AA O00Z -62.0(9) . . . . ?
C0AA C02A C3AA C5AA 50.7(9) . . . . ?
C0AA C02A C5AA C024 -63.7(9) . . . . ?
C0AA C02A C5AA C3AA -102.6(9) . . . . ?
C5AA C024 O00Z K1 -169.5(9) . . . . ?
C5AA C024 O00Z C027 14.2(11) . . . . ?
C5AA C024 O00Z C0 65.1(10) . . . . ?
C5AA C024 O00Z C3AA -49.3(7) . . . . ?
C5AA C024 C3AA O00Y 115.7(9) . . . . ?
C5AA C024 C3AA C021 -10.8(8) . . . . ?
C5AA C024 C3AA C027 77.4(8) . . . . ?
C5AA C024 C3AA C02A 30.1(7) . . . . ?
C5AA C024 C3AA O00Z 114.3(10) . . . . ?
C5AA C024 C0AA C021 10.5(10) . . . . ?
C5AA C024 C0AA C02A -33.3(8) . . . . ?
C5AA C024 C0AA C0 -109.8(13) . . . . ?
C5AA C02A C3AA O00Y -109.3(13) . . . . ?
C5AA C02A C3AA C021 -0.2(12) . . . . ?
C5AA C02A C3AA C024 -49.3(11) . . . . ?
C5AA C02A C3AA C027 -133.4(12) . . . . ?
C5AA C02A C3AA O00Z -112.7(14) . . . . ?
C5AA C02A C0AA C021 6.8(11) . . . . ?
C5AA C02A C0AA C024 57.4(10) . . . . ?
C5AA C02A C0AA C0 136.2(13) . . . . ?
C6AA O00P C022 C029 52.9(15) . . . . ?
C6AA O00P C022 O00Q -144(5) . . . . ?
C6AA O00P C022 C7AA 90(2) . . . . ?
C6AA O00P C022 C8AA 49.8(12) . . . . ?
C6AA O00P C026 C02B -134(3) . . . . ?
C6AA O00P C026 O00Q -100(7) . . . . ?
C6AA O00P C026 C8AA -139(2) . . . . ?
C6AA O00P C026 C1AA -95(2) . . . . ?
C6AA O00P C7AA C022 -99.3(19) . . . . ?
C6AA O00P C7AA C029 13.9(17) . . . . ?
C6AA O00P C7AA O00Q -139(4) . . . . ?
C6AA O00P C7AA C8AA 26.2(12) . . . . ?
C6AA C026 C02B C029 -51(3) . . . . ?
C6AA C026 C02B C8AA -70(4) . . . . ?
C6AA C026 C02B C1AA 54(3) . . . . ?
C6AA C026 O00Q K1 -93(2) . . . . ?
C6AA C026 O00Q C022 119(2) . . . . ?
C6AA C026 O00Q C7AA 141.3(19) . . . . ?
C6AA C026 C8AA C022 -20(2) . . . . ?
C6AA C026 C8AA C029 -11(3) . . . . ?
C6AA C026 C8AA C02B 127(3) . . . . ?
C6AA C026 C8AA C7AA -33(2) . . . . ?
C6AA C026 C8AA C1AA 89(3) . . . . ?
C6AA C026 C1AA C029 -98.9(17) . . . . ?
C6AA C026 C1AA C02B -143.0(18) . . . . ?
C6AA C026 C1AA C8AA -118.9(17) . . . . ?
C6AA C02B C8AA C022 22.7(16) . . . . ?
C6AA C02B C8AA C026 -12.6(9) . . . . ?
C6AA C02B C8AA C029 68(3) . . . . ?
C6AA C02B C8AA C7AA 14(2) . . . . ?
C6AA C02B C8AA C1AA 43.9(15) . . . . ?
C6AA C02B C1AA C026 15.0(7) . . . . ?
C6AA C02B C1AA C029 -79.6(13) . . . . ?
C6AA C02B C1AA C8AA -72(2) . . . . ?
C6AA O00Q C7AA O00P 31(3) . . . . ?
C6AA O00Q C7AA C022 -104.6(17) . . . . ?
C6AA O00Q C7AA C029 1.3(15) . . . . ?
C6AA O00Q C7AA C8AA 16.1(9) . . . . ?
O00Q C022 C029 C02B -28.6(14) . . . . ?
O00Q C022 C029 C7AA 83(2) . . . . ?
O00Q C022 C029 C8AA -11(2) . . . . ?
O00Q C022 C029 C1AA -44.0(11) . . . . ?
O00Q C022 C7AA O00P -8.3(6) . . . . ?
O00Q C022 C7AA C029 -109.8(16) . . . . ?
O00Q C022 C7AA C8AA -78.1(17) . . . . ?
O00Q C026 C02B C029 1.0(14) . . . . ?
O00Q C026 C02B C6AA 52(2) . . . . ?
O00Q C026 C02B C8AA -18(2) . . . . ?
O00Q C026 C02B C1AA 106.1(14) . . . . ?
O00Q C026 C6AA O00P 7.4(7) . . . . ?
O00Q C026 C6AA C02B -71(3) . . . . ?
O00Q C026 C6AA C1AA -101.5(13) . . . . ?
O00Q C026 C8AA C022 15.4(5) . . . . ?
O00Q C026 C8AA C029 24.4(15) . . . . ?
O00Q C026 C8AA C02B 163(2) . . . . ?
O00Q C026 C8AA C7AA 2.7(6) . . . . ?
O00Q C026 C8AA C1AA 124.0(12) . . . . ?
O00Q C026 C1AA C029 -41.1(10) . . . . ?
O00Q C026 C1AA C02B -85.1(13) . . . . ?
O00Q C026 C1AA C6AA 57.9(14) . . . . ?
O00Q C026 C1AA C8AA -61.0(11) . . . . ?
O00Q C6AA C1AA C026 -94.3(18) . . . . ?
O00Q C6AA C1AA C029 -10.5(9) . . . . ?
O00Q C6AA C1AA C02B -54.2(15) . . . . ?
O00Q C6AA C1AA C8AA -30.8(11) . . . . ?
O00Q C7AA C8AA C022 -51.4(16) . . . . ?
O00Q C7AA C8AA C026 -3.0(7) . . . . ?
O00Q C7AA C8AA C029 -152.2(19) . . . . ?
O00Q C7AA C8AA C02B -22(2) . . . . ?
O00Q C7AA C8AA C1AA -35.4(9) . . . . ?
C7AA O00P C022 C029 -37.6(11) . . . . ?
C7AA O00P C022 O00Q 125(5) . . . . ?
C7AA O00P C022 C8AA -40.6(13) . . . . ?
C7AA O00P C026 C02B -0.6(13) . . . . ?
C7AA O00P C026 C6AA 133(2) . . . . ?
C7AA O00P C026 O00Q 33(6) . . . . ?
C7AA O00P C026 C8AA -6.1(8) . . . . ?
C7AA O00P C026 C1AA 38.0(15) . . . . ?
C7AA O00P C6AA C026 -52(2) . . . . ?
C7AA O00P C6AA C02B -20.9(11) . . . . ?
C7AA O00P C6AA O00Q 62(5) . . . . ?
C7AA O00P C6AA C1AA -3.3(14) . . . . ?
C7AA C022 C029 C02B -111(2) . . . . ?
C7AA C022 C029 C8AA -94(3) . . . . ?
C7AA C022 C029 C1AA -127(2) . . . . ?
C7AA C022 O00Q K1 -72.9(17) . . . . ?
C7AA C022 O00Q C026 65.5(17) . . . . ?
C7AA C022 O00Q C6AA 84.1(18) . . . . ?
C7AA C029 C02B C026 -8.5(18) . . . . ?
C7AA C029 C02B C6AA -18.6(15) . . . . ?
C7AA C029 C02B C8AA 97(3) . . . . ?
C7AA C029 C02B C1AA -63.0(18) . . . . ?
C7AA C029 C8AA C022 -23.6(9) . . . . ?
C7AA C029 C8AA C026 -36(2) . . . . ?
C7AA C029 C8AA C02B -91(3) . . . . ?
C7AA C029 C8AA C1AA -78.8(18) . . . . ?
C7AA C8AA C1AA C026 62.2(11) . . . . ?
C7AA C8AA C1AA C029 -39.8(11) . . . . ?
C7AA C8AA C1AA C02B 156(3) . . . . ?
C7AA C8AA C1AA C6AA 41.3(10) . . . . ?
C8AA C022 C029 C02B -17.2(12) . . . . ?
C8AA C022 C029 C7AA 94(3) . . . . ?
C8AA C022 C029 C1AA -32.6(13) . . . . ?
C8AA C022 O00Q K1 -115.2(7) . . . . ?
C8AA C022 O00Q C026 23.1(8) . . . . ?
C8AA C022 O00Q C6AA 41.8(9) . . . . ?
C8AA C022 O00Q C7AA -42.3(13) . . . . ?
C8AA C022 C7AA O00P 69.8(16) . . . . ?
C8AA C022 C7AA C029 -31.8(9) . . . . ?
C8AA C022 C7AA O00Q 78.1(17) . . . . ?
C8AA C026 C02B C029 18.7(13) . . . . ?
C8AA C026 C02B C6AA 70(4) . . . . ?
C8AA C026 C02B C1AA 124(2) . . . . ?
C8AA C026 C6AA O00P 52(2) . . . . ?
C8AA C026 C6AA C02B -26.1(13) . . . . ?
C8AA C026 C6AA O00Q 45(2) . . . . ?
C8AA C026 C6AA C1AA -56.7(15) . . . . ?
C8AA C026 O00Q K1 122.9(5) . . . . ?
C8AA C026 O00Q C022 -24.8(9) . . . . ?
C8AA C026 O00Q C6AA -144(2) . . . . ?
C8AA C026 O00Q C7AA -2.7(7) . . . . ?
C8AA C026 C1AA C029 20.0(5) . . . . ?
C8AA C026 C1AA C02B -24.1(8) . . . . ?
C8AA C026 C1AA C6AA 118.9(17) . . . . ?
C8AA C029 C02B C026 -105(3) . . . . ?
C8AA C029 C02B C6AA -115(3) . . . . ?
C8AA C029 C02B C1AA -160(3) . . . . ?
C8AA C029 C7AA O00P 28(2) . . . . ?
C8AA C029 C7AA C022 96(3) . . . . ?
C8AA C029 C7AA O00Q 33(2) . . . . ?
C8AA C02B C6AA O00P 7.8(18) . . . . ?
C8AA C02B C6AA C026 114(3) . . . . ?
C8AA C02B C6AA O00Q -0.1(17) . . . . ?
C8AA C02B C6AA C1AA -130(2) . . . . ?
C8AA C02B C1AA C026 87(2) . . . . ?
C8AA C02B C1AA C029 -8.0(15) . . . . ?
C8AA C02B C1AA C6AA 72(2) . . . . ?
C1AA C026 C02B C029 -105.1(16) . . . . ?
C1AA C026 C02B C6AA -54(3) . . . . ?
C1AA C026 C02B C8AA -124(2) . . . . ?
C1AA C026 C6AA O00P 109.0(13) . . . . ?
C1AA C026 C6AA C02B 30.6(17) . . . . ?
C1AA C026 C6AA O00Q 101.5(13) . . . . ?
C1AA C026 O00Q K1 167.2(9) . . . . ?
C1AA C026 O00Q C022 19.5(13) . . . . ?
C1AA C026 O00Q C6AA -100(2) . . . . ?
C1AA C026 O00Q C7AA 41.5(12) . . . . ?
C1AA C026 C8AA C022 -108.6(11) . . . . ?
C1AA C026 C8AA C029 -99.6(18) . . . . ?
C1AA C026 C8AA C02B 38.6(18) . . . . ?
C1AA C026 C8AA C7AA -121.3(11) . . . . ?
C1AA C029 C02B C026 54.5(11) . . . . ?
C1AA C029 C02B C6AA 44.4(9) . . . . ?
C1AA C029 C02B C8AA 160(3) . . . . ?
C1AA C029 C7AA O00P -13.1(12) . . . . ?
C1AA C029 C7AA C022 55(2) . . . . ?
C1AA C029 C7AA O00Q -7.5(14) . . . . ?
C1AA C029 C7AA C8AA -40.8(13) . . . . ?
C1AA C029 C8AA C022 55.2(17) . . . . ?
C1AA C029 C8AA C026 42.8(8) . . . . ?
C1AA C029 C8AA C02B -12.4(19) . . . . ?
C1AA C029 C8AA C7AA 78.8(18) . . . . ?
C1AA C02B C6AA O00P 137.6(15) . . . . ?
C1AA C02B C6AA C026 -116(3) . . . . ?
C1AA C02B C6AA O00Q 129.8(14) . . . . ?
C1AA C02B C8AA C022 -21(3) . . . . ?
C1AA C02B C8AA C026 -56.5(16) . . . . ?
C1AA C02B C8AA C029 25(4) . . . . ?
C1AA C02B C8AA C7AA -30(3) . . . . ?
C1AA C6AA O00Q K1 144.7(6) . . . . ?
C1AA C6AA O00Q C022 -17.0(12) . . . . ?
C1AA C6AA O00Q C026 49.4(17) . . . . ?
C1AA C6AA O00Q C7AA 8.4(10) . . . . ?
C1BA C2BA C44 C9AA -151(3) . . . . ?
C1BA C2BA C44 C0BA -134(6) . . . . ?
C1BA C2BA C44 C4BA -80(2) . . . . ?
C1BA C0BA C4BA C2BA -39.8(6) . . . . ?
C1BA C0BA C4BA C9AA -112.6(9) . . . . ?
C1BA C0BA C4BA C3BA -112.6(19) . . . . ?
C1BA C0BA C4BA C44 -11(3) . . . . ?
C1BA C0BA C44 C2BA 85(9) . . . . ?
C1BA C0BA C44 C9AA 106(8) . . . . ?
C1BA C0BA C44 C4BA 33(8) . . . . ?
C1BA C4BA C44 C2BA 55(2) . . . . ?
C1BA C4BA C44 C9AA 143(3) . . . . ?
C1BA C4BA C44 C0BA -161(5) . . . . ?
C2BA C1BA C0BA C9AA 8.3(10) . . . . ?
C2BA C1BA C0BA C4BA 74.6(11) . . . . ?
C2BA C1BA C0BA C44 -68(9) . . . . ?
C2BA C1BA C4BA C9AA -69.3(8) . . . . ?
C2BA C1BA C4BA C0BA -112.4(8) . . . . ?
C2BA C1BA C4BA C3BA -10(2) . . . . ?
C2BA C1BA C4BA C44 -101(3) . . . . ?
C2BA C1BA C44 C9AA 37(4) . . . . ?
C2BA C1BA C44 C0BA 116(8) . . . . ?
C2BA C1BA C44 C4BA 82.7(13) . . . . ?
C2BA C4BA C44 C1BA -55(2) . . . . ?
C2BA C4BA C44 C9AA 88.6(12) . . . . ?
C2BA C4BA C44 C0BA 144(3) . . . . ?
C9AA C0BA C4BA C1BA 112.6(9) . . . . ?
C9AA C0BA C4BA C2BA 72.8(8) . . . . ?
C9AA C0BA C4BA C3BA 0.0(16) . . . . ?
C9AA C0BA C4BA C44 102(3) . . . . ?
C9AA C0BA C44 C1BA -106(8) . . . . ?
C9AA C0BA C44 C2BA -22(4) . . . . ?
C9AA C0BA C44 C4BA -73.6(14) . . . . ?
C9AA O5 C3BA C4BA -39.1(18) . . . . ?
C9AA C3BA C4BA C1BA -70.3(18) . . . . ?
C9AA C3BA C4BA C2BA -77.2(7) . . . . ?
C9AA C3BA C4BA C0BA 0.0(13) . . . . ?
C9AA C3BA C4BA C44 -36(2) . . . . ?
C9AA C4BA C44 C1BA -143(3) . . . . ?
C9AA C4BA C44 C2BA -88.6(12) . . . . ?
C9AA C4BA C44 C0BA 56(2) . . . . ?
C0BA C1BA C2BA C4BA -58.5(11) . . . . ?
C0BA C1BA C2BA C44 17(2) . . . . ?
C0BA C1BA C4BA C2BA 112.4(8) . . . . ?
C0BA C1BA C4BA C9AA 43.1(7) . . . . ?
C0BA C1BA C4BA C3BA 103(2) . . . . ?
C0BA C1BA C4BA C44 11(3) . . . . ?
C0BA C1BA C44 C2BA -116(8) . . . . ?
C0BA C1BA C44 C9AA -79(8) . . . . ?
C0BA C1BA C44 C4BA -34(8) . . . . ?
C0BA C9AA O5 C3BA 59.6(18) . . . . ?
C0BA C9AA C44 C1BA 136(5) . . . . ?
C0BA C9AA C44 C2BA 165(3) . . . . ?
C0BA C9AA C44 C4BA 89(2) . . . . ?
C0BA C4BA C44 C1BA 161(5) . . . . ?
C0BA C4BA C44 C2BA -144(3) . . . . ?
C0BA C4BA C44 C9AA -56(2) . . . . ?
O5 C9AA C0BA C1BA 17.9(14) . . . . ?
O5 C9AA C0BA C4BA -33.3(15) . . . . ?
O5 C9AA C0BA C44 34(3) . . . . ?
O5 C9AA C44 C1BA -17(4) . . . . ?
O5 C9AA C44 C2BA 11.3(12) . . . . ?
O5 C9AA C44 C0BA -153(2) . . . . ?
O5 C9AA C44 C4BA -64.0(16) . . . . ?
O5 C3BA C4BA C1BA -42(3) . . . . ?
O5 C3BA C4BA C2BA -48.7(16) . . . . ?
O5 C3BA C4BA C9AA 28.6(14) . . . . ?
O5 C3BA C4BA C0BA 29(2) . . . . ?
O5 C3BA C4BA C44 -7(3) . . . . ?
C3BA C9AA C0BA C1BA 51.3(10) . . . . ?
C3BA C9AA C0BA C4BA 0.0(13) . . . . ?
C3BA C9AA C0BA C44 67(3) . . . . ?
C3BA C9AA C44 C1BA 19(4) . . . . ?
C3BA C9AA C44 C2BA 48.0(11) . . . . ?
C3BA C9AA C44 C0BA -117(2) . . . . ?
C3BA C9AA C44 C4BA -27.3(16) . . . . ?
C3BA C4BA C44 C1BA -105(3) . . . . ?
C3BA C4BA C44 C2BA -51(2) . . . . ?
C3BA C4BA C44 C9AA 38(2) . . . . ?
C3BA C4BA C44 C0BA 94(3) . . . . ?
C4BA C1BA C2BA C44 76(3) . . . . ?
C4BA C1BA C0BA C9AA -66.2(11) . . . . ?
C4BA C1BA C0BA C44 -142(9) . . . . ?
C4BA C1BA C44 C2BA -82.7(13) . . . . ?
C4BA C1BA C44 C9AA -45(3) . . . . ?
C4BA C1BA C44 C0BA 34(8) . . . . ?
C4BA C2BA C44 C1BA 80(2) . . . . ?
C4BA C2BA C44 C9AA -70.7(15) . . . . ?
C4BA C2BA C44 C0BA -53(4) . . . . ?
C4BA C9AA C0BA C1BA 51.3(9) . . . . ?
C4BA C9AA C0BA C44 68(2) . . . . ?
C4BA C9AA O5 C3BA 32.2(15) . . . . ?
C4BA C9AA C44 C1BA 47(3) . . . . ?
C4BA C9AA C44 C2BA 75.3(16) . . . . ?
C4BA C9AA C44 C0BA -89(2) . . . . ?
C4BA C0BA C44 C1BA -33(8) . . . . ?
C4BA C0BA C44 C2BA 52(3) . . . . ?
C4BA C0BA C44 C9AA 73.6(14) . . . . ?
C44 C1BA C2BA C4BA -76(3) . . . . ?
C44 C1BA C0BA C9AA 76(9) . . . . ?
C44 C1BA C0BA C4BA 142(9) . . . . ?
C44 C1BA C4BA C2BA 101(3) . . . . ?
C44 C1BA C4BA C9AA 32(3) . . . . ?
C44 C1BA C4BA C0BA -11(3) . . . . ?
C44 C1BA C4BA C3BA 91(3) . . . . ?
C44 C9AA C0BA C1BA -16(2) . . . . ?
C44 C9AA C0BA C4BA -68(2) . . . . ?
C44 C9AA O5 C3BA 76.2(17) . . . . ?
C44 C0BA C4BA C1BA 11(3) . . . . ?
C44 C0BA C4BA C2BA -29(3) . . . . ?
C44 C0BA C4BA C9AA -102(3) . . . . ?
C44 C0BA C4BA C3BA -102(3) . . . . ?
