#------------------------------------------------------------------------------
#$Date: 2019-11-23 06:44:46 +0200 (Sat, 23 Nov 2019) $
#$Revision: 232351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/75/4347510.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_4347510
loop_
_publ_author_name
'Reuter, Kirsten'
'Buchner, Magnus R.'
'Thiele, Günther'
'von Hänisch, Carsten'
_publ_section_title
;
 Stable Alkali-Metal Complexes of Hybrid Disila-Crown Ethers.
;
_journal_issue                   9
_journal_name_full               'Inorganic chemistry'
_journal_page_first              4441
_journal_page_last               4447
_journal_paper_doi               10.1021/acs.inorgchem.6b00267
_journal_volume                  55
_journal_year                    2016
_chemical_formula_sum            'C14 H32 F6 K O6 P Si2'
_chemical_formula_weight         536.64
_space_group_crystal_system      monoclinic
_space_group_IT_number           4
_space_group_name_Hall           'P 2yb'
_space_group_name_H-M_alt        'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 119.580(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.4027(13)
_cell_length_b                   12.3519(11)
_cell_length_c                   10.4989(9)
_cell_measurement_reflns_used    4607
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      25.29
_cell_measurement_theta_min      2.25
_cell_volume                     1173.2(2)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0631
_diffrn_reflns_av_unetI/netI     0.0589
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            15778
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.308
_diffrn_reflns_theta_min         2.255
_diffrn_source                   'sealed tube'
_exptl_absorpt_coefficient_mu    0.471
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.6656
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS V2014/4 (Bruker AXS Inc.)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.519
_exptl_crystal_description       block
_exptl_crystal_F_000             560
_exptl_crystal_size_max          0.394
_exptl_crystal_size_mid          0.155
_exptl_crystal_size_min          0.125
_refine_diff_density_max         0.292
_refine_diff_density_min         -0.208
_refine_diff_density_rms         0.055
_refine_ls_abs_structure_details
;
 Flack x determined using 1492 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.01(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.020
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     275
_refine_ls_number_reflns         4295
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.019
_refine_ls_R_factor_all          0.0474
_refine_ls_R_factor_gt           0.0330
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0241P)²+0.0362P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0564
_refine_ls_wR_factor_ref         0.0603
_reflns_Friedel_coverage         0.902
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.995
_reflns_number_gt                3721
_reflns_number_total             4295
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic6b00267_si_003.cif
_cod_data_source_block           kr168p21
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               4347510
_shelx_shelxl_version_number     2014/7
_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.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -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
K1 K 0.37877(8) 0.54978(6) 0.63049(8) 0.0128(2) Uani 1 1 d . .
C1 C 0.0811(4) 0.2832(3) 0.1526(4) 0.0141(9) Uani 1 1 d . .
H1A H 0.0173 0.3293 0.0725 0.021 Uiso 1 1 calc R U
H1B H 0.0328 0.2152 0.1441 0.021 Uiso 1 1 calc R U
H1C H 0.1711 0.2710 0.1503 0.021 Uiso 1 1 calc R U
C2 C -0.0496(4) 0.3859(3) 0.3290(4) 0.0174(9) Uani 1 1 d . .
H2A H -0.0255 0.4176 0.4217 0.026 Uiso 1 1 calc R U
H2B H -0.1081 0.3221 0.3136 0.026 Uiso 1 1 calc R U
H2C H -0.1045 0.4370 0.2521 0.026 Uiso 1 1 calc R U
C3 C 0.3729(4) 0.1389(3) 0.4629(4) 0.0148(9) Uani 1 1 d . .
H3A H 0.4464 0.0993 0.5455 0.022 Uiso 1 1 calc R U
H3B H 0.4191 0.1765 0.4160 0.022 Uiso 1 1 calc R U
H3C H 0.3001 0.0896 0.3947 0.022 Uiso 1 1 calc R U
C4 C 0.1883(4) 0.1654(3) 0.6121(4) 0.0185(9) Uani 1 1 d . .
H4A H 0.2549 0.1131 0.6805 0.028 Uiso 1 1 calc R U
H4B H 0.1023 0.1292 0.5376 0.028 Uiso 1 1 calc R U
H4C H 0.1593 0.2162 0.6625 0.028 Uiso 1 1 calc R U
C5 C 0.1968(4) 0.5328(3) 0.2348(3) 0.0146(9) Uani 1 1 d . .
H5A H 0.1277 0.4996 0.1421 0.018 Uiso 1 1 calc R U
H5B H 0.2879 0.5472 0.2335 0.018 Uiso 1 1 calc R U
C6 C 0.1340(4) 0.6367(3) 0.2516(4) 0.0169(10) Uani 1 1 d . .
H6A H 0.1068 0.6824 0.1669 0.020 Uiso 1 1 calc R U
H6B H 0.0459 0.6225 0.2584 0.020 Uiso 1 1 calc R U
C7 C 0.1898(4) 0.7914(3) 0.4011(4) 0.0173(9) Uani 1 1 d . .
H7A H 0.1090 0.7806 0.4209 0.021 Uiso 1 1 calc R U
H7B H 0.1542 0.8353 0.3134 0.021 Uiso 1 1 calc R U
C8 C 0.3147(4) 0.8476(3) 0.5273(4) 0.0174(9) Uani 1 1 d . .
H8A H 0.3942 0.8607 0.5061 0.021 Uiso 1 1 calc R U
H8B H 0.2816 0.9168 0.5442 0.021 Uiso 1 1 calc R U
C9 C 0.4773(4) 0.8323(3) 0.7814(4) 0.0180(9) Uani 1 1 d . .
H9A H 0.4360 0.8933 0.8072 0.022 Uiso 1 1 calc R U
H9B H 0.5552 0.8588 0.7642 0.022 Uiso 1 1 calc R U
C10 C 0.5383(4) 0.7517(3) 0.9026(4) 0.0193(9) Uani 1 1 d . .
H10A H 0.6118 0.7854 0.9929 0.023 Uiso 1 1 calc R U
H10B H 0.4601 0.7230 0.9177 0.023 Uiso 1 1 calc R U
C11 C 0.6997(4) 0.5993(3) 0.9809(4) 0.0166(9) Uani 1 1 d . .
H11A H 0.6441 0.5621 1.0195 0.020 Uiso 1 1 calc R U
H11B H 0.7759 0.6426 1.0586 0.020 Uiso 1 1 calc R U
C12 C 0.7681(4) 0.5189(3) 0.9254(4) 0.0151(9) Uani 1 1 d . .
H12A H 0.8182 0.5577 0.8822 0.018 Uiso 1 1 calc R U
H12B H 0.8419 0.4776 1.0076 0.018 Uiso 1 1 calc R U
C13 C 0.6214(4) 0.3607(3) 0.8820(4) 0.0142(8) Uani 1 1 d . .
H13A H 0.5576 0.3889 0.9172 0.017 Uiso 1 1 calc R U
H13B H 0.7082 0.3294 0.9643 0.017 Uiso 1 1 calc R U
C14 C 0.5417(4) 0.2766(3) 0.7680(4) 0.0127(9) Uani 1 1 d . .
H14A H 0.6057 0.2496 0.7323 0.015 Uiso 1 1 calc R U
H14B H 0.5163 0.2164 0.8107 0.015 Uiso 1 1 calc R U
F1 F 0.1733(3) 0.6129(2) 0.7185(3) 0.0357(7) Uani 1 1 d . .
F2 F 0.3499(2) 0.5064(2) 0.8881(2) 0.0280(6) Uani 1 1 d . .
F3 F 0.1509(3) 0.4324(2) 0.6989(3) 0.0398(7) Uani 1 1 d . .
F4 F 0.1768(3) 0.4230(2) 0.9245(3) 0.0414(8) Uani 1 1 d . .
F5 F 0.0005(2) 0.5299(2) 0.7540(2) 0.0287(6) Uani 1 1 d . .
F6 F 0.2009(3) 0.6042(2) 0.9447(3) 0.0357(7) Uani 1 1 d . .
O1 O 0.2261(3) 0.4593(2) 0.3523(3) 0.0136(6) Uani 1 1 d . .
O2 O 0.2405(3) 0.6900(2) 0.3797(3) 0.0133(6) Uani 1 1 d . .
O3 O 0.3657(3) 0.7813(2) 0.6533(3) 0.0144(6) Uani 1 1 d . .
O4 O 0.6042(3) 0.6666(2) 0.8613(2) 0.0139(6) Uani 1 1 d . .
O5 O 0.6640(3) 0.4455(2) 0.8191(3) 0.0144(6) Uani 1 1 d . .
O6 O 0.4098(3) 0.3207(2) 0.6484(3) 0.0133(6) Uani 1 1 d . .
P1 P 0.17435(10) 0.51757(9) 0.82178(10) 0.0146(2) Uani 1 1 d . .
Si1 Si 0.12420(11) 0.34912(9) 0.32860(11) 0.0108(2) Uani 1 1 d . .
Si2 Si 0.28207(11) 0.23867(8) 0.52610(11) 0.0110(2) Uani 1 1 d . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 '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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
O1 K1 O4 156.46(8) . .
O1 K1 F1 108.82(8) . .
O4 K1 F1 91.15(8) . .
O1 K1 O6 69.92(7) . .
O4 K1 O6 115.86(8) . .
F1 K1 O6 109.42(8) . .
O1 K1 O2 60.76(7) . .
O4 K1 O2 108.00(8) . .
F1 K1 O2 90.92(7) . .
O6 K1 O2 130.49(7) . .
O1 K1 O3 117.46(8) . .
O4 K1 O3 57.98(7) . .
F1 K1 O3 67.92(8) . .
O6 K1 O3 172.53(7) . .
O2 K1 O3 56.97(7) . .
O1 K1 F2 129.36(7) . .
O4 K1 F2 73.59(7) . .
F1 K1 F2 46.05(7) . .
O6 K1 F2 79.39(7) . .
O2 K1 F2 136.60(7) . .
O3 K1 F2 94.28(8) . .
O1 K1 O5 113.35(7) . .
O4 K1 O5 60.38(7) . .
F1 K1 O5 125.28(7) . .
O6 K1 O5 58.25(7) . .
O2 K1 O5 139.99(8) . .
O3 K1 O5 117.01(7) . .
F2 K1 O5 79.97(6) . .
O1 K1 F3 87.17(7) . .
O4 K1 F3 116.27(7) . .
F1 K1 F3 43.63(7) . .
O6 K1 F3 66.45(7) . .
O2 K1 F3 113.18(7) . .
O3 K1 F3 111.51(7) . .
F2 K1 F3 43.08(6) . .
O5 K1 F3 105.58(7) . .
O1 K1 C3 87.02(8) . 2_656
O4 K1 C3 69.44(8) . 2_656
F1 K1 C3 144.86(9) . 2_656
O6 K1 C3 105.43(8) . 2_656
O2 K1 C3 69.23(8) . 2_656
O3 K1 C3 76.94(8) . 2_656
F2 K1 C3 140.84(8) . 2_656
O5 K1 C3 70.98(8) . 2_656
F3 K1 C3 171.33(8) . 2_656
O1 K1 P1 110.72(6) . .
O4 K1 P1 92.69(6) . .
F1 K1 P1 25.35(5) . .
O6 K1 P1 86.11(6) . .
O2 K1 P1 114.31(6) . .
O3 K1 P1 89.89(6) . .
F2 K1 P1 25.98(4) . .
O5 K1 P1 104.75(6) . .
F3 K1 P1 26.16(5) . .
C3 K1 P1 161.55(7) 2_656 .
O1 K1 Si1 22.29(5) . .
O4 K1 Si1 169.38(6) . .
F1 K1 Si1 97.04(6) . .
O6 K1 Si1 54.91(5) . .
O2 K1 Si1 78.72(5) . .
O3 K1 Si1 131.65(6) . .
F2 K1 Si1 107.49(5) . .
O5 K1 Si1 109.15(6) . .
F3 K1 Si1 66.63(5) . .
C3 K1 Si1 106.54(7) 2_656 .
P1 K1 Si1 91.85(3) . .
Si1 C1 H1A 109.5 . .
Si1 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
Si1 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
Si1 C2 H2A 109.5 . .
Si1 C2 H2B 109.5 . .
H2A C2 H2B 109.5 . .
Si1 C2 H2C 109.5 . .
H2A C2 H2C 109.5 . .
H2B C2 H2C 109.5 . .
Si2 C3 K1 156.43(18) . 2_646
Si2 C3 H3A 109.5 . .
K1 C3 H3A 73.3 2_646 .
Si2 C3 H3B 109.5 . .
K1 C3 H3B 50.1 2_646 .
H3A C3 H3B 109.5 . .
Si2 C3 H3C 109.5 . .
K1 C3 H3C 90.6 2_646 .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
Si2 C4 H4A 109.5 . .
Si2 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
Si2 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
O1 C5 C6 111.2(3) . .
O1 C5 H5A 109.4 . .
C6 C5 H5A 109.4 . .
O1 C5 H5B 109.4 . .
C6 C5 H5B 109.4 . .
H5A C5 H5B 108.0 . .
O2 C6 C5 109.3(3) . .
O2 C6 H6A 109.8 . .
C5 C6 H6A 109.8 . .
O2 C6 H6B 109.8 . .
C5 C6 H6B 109.8 . .
H6A C6 H6B 108.3 . .
O2 C7 C8 108.8(3) . .
O2 C7 H7A 109.9 . .
C8 C7 H7A 109.9 . .
O2 C7 H7B 109.9 . .
C8 C7 H7B 109.9 . .
H7A C7 H7B 108.3 . .
O3 C8 C7 108.7(3) . .
O3 C8 H8A 109.9 . .
C7 C8 H8A 109.9 . .
O3 C8 H8B 109.9 . .
C7 C8 H8B 109.9 . .
H8A C8 H8B 108.3 . .
O3 C9 C10 108.5(3) . .
O3 C9 H9A 110.0 . .
C10 C9 H9A 110.0 . .
O3 C9 H9B 110.0 . .
C10 C9 H9B 110.0 . .
H9A C9 H9B 108.4 . .
O4 C10 C9 107.3(3) . .
O4 C10 H10A 110.2 . .
C9 C10 H10A 110.2 . .
O4 C10 H10B 110.2 . .
C9 C10 H10B 110.2 . .
H10A C10 H10B 108.5 . .
O4 C11 C12 107.7(3) . .
O4 C11 H11A 110.2 . .
C12 C11 H11A 110.2 . .
O4 C11 H11B 110.2 . .
C12 C11 H11B 110.2 . .
H11A C11 H11B 108.5 . .
O5 C12 C11 113.7(3) . .
O5 C12 H12A 108.8 . .
C11 C12 H12A 108.8 . .
O5 C12 H12B 108.8 . .
C11 C12 H12B 108.8 . .
H12A C12 H12B 107.7 . .
O5 C13 C14 108.6(3) . .
O5 C13 H13A 110.0 . .
C14 C13 H13A 110.0 . .
O5 C13 H13B 110.0 . .
C14 C13 H13B 110.0 . .
H13A C13 H13B 108.4 . .
O6 C14 C13 110.6(3) . .
O6 C14 H14A 109.5 . .
C13 C14 H14A 109.5 . .
O6 C14 H14B 109.5 . .
C13 C14 H14B 109.5 . .
H14A C14 H14B 108.1 . .
P1 F1 K1 105.44(12) . .
P1 F2 K1 101.40(10) . .
P1 F3 K1 92.83(12) . .
C5 O1 Si1 122.5(2) . .
C5 O1 K1 114.6(2) . .
Si1 O1 K1 118.46(12) . .
C6 O2 C7 112.6(3) . .
C6 O2 K1 113.2(2) . .
C7 O2 K1 116.4(2) . .
C9 O3 C8 112.5(3) . .
C9 O3 K1 118.0(2) . .
C8 O3 K1 120.5(2) . .
C11 O4 C10 113.1(3) . .
C11 O4 K1 112.6(2) . .
C10 O4 K1 108.6(2) . .
C13 O5 C12 113.2(3) . .
C13 O5 K1 101.20(19) . .
C12 O5 K1 111.9(2) . .
C14 O6 Si2 120.0(2) . .
C14 O6 K1 117.7(2) . .
Si2 O6 K1 122.31(12) . .
F4 P1 F3 90.51(16) . .
F4 P1 F5 90.46(14) . .
F3 P1 F5 90.86(13) . .
F4 P1 F6 90.33(15) . .
F3 P1 F6 178.67(17) . .
F5 P1 F6 90.17(14) . .
F4 P1 F1 179.49(15) . .
F3 P1 F1 89.42(14) . .
F5 P1 F1 90.05(13) . .
F6 P1 F1 89.73(16) . .
F4 P1 F2 90.49(14) . .
F3 P1 F2 88.90(13) . .
F5 P1 F2 179.03(15) . .
F6 P1 F2 90.05(14) . .
F1 P1 F2 89.01(14) . .
F4 P1 K1 130.36(11) . .
F3 P1 K1 61.01(11) . .
F5 P1 K1 126.49(10) . .
F6 P1 K1 117.67(12) . .
F1 P1 K1 49.21(10) . .
F2 P1 K1 52.61(9) . .
O1 Si1 C1 109.22(16) . .
O1 Si1 C2 110.26(17) . .
C1 Si1 C2 110.52(17) . .
O1 Si1 Si2 103.12(10) . .
C1 Si1 Si2 110.11(13) . .
C2 Si1 Si2 113.33(13) . .
O1 Si1 K1 39.24(9) . .
C1 Si1 K1 145.84(13) . .
C2 Si1 K1 96.56(13) . .
Si2 Si1 K1 75.55(4) . .
O6 Si2 C4 109.45(16) . .
O6 Si2 C3 109.02(16) . .
C4 Si2 C3 109.34(18) . .
O6 Si2 Si1 105.83(10) . .
C4 Si2 Si1 113.98(13) . .
C3 Si2 Si1 109.08(12) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
K1 O1 2.779(2) .
K1 O4 2.801(3) .
K1 F1 2.824(3) .
K1 O6 2.844(3) .
K1 O2 2.874(3) .
K1 O3 2.879(3) .
K1 F2 2.915(2) .
K1 O5 2.930(3) .
K1 F3 3.149(3) .
K1 C3 3.368(4) 2_656
K1 P1 3.5959(13) .
K1 Si1 3.8620(13) .
C1 Si1 1.861(4) .
C1 H1A 0.9600 .
C1 H1B 0.9600 .
C1 H1C 0.9600 .
C2 Si1 1.866(4) .
C2 H2A 0.9600 .
C2 H2B 0.9600 .
C2 H2C 0.9600 .
C3 Si2 1.863(4) .
C3 K1 3.368(4) 2_646
C3 H3A 0.9600 .
C3 H3B 0.9600 .
C3 H3C 0.9600 .
C4 Si2 1.858(4) .
C4 H4A 0.9600 .
C4 H4B 0.9600 .
C4 H4C 0.9600 .
C5 O1 1.438(4) .
C5 C6 1.489(5) .
C5 H5A 0.9700 .
C5 H5B 0.9700 .
C6 O2 1.413(4) .
C6 H6A 0.9700 .
C6 H6B 0.9700 .
C7 O2 1.420(5) .
C7 C8 1.491(5) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C8 O3 1.418(4) .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 O3 1.418(4) .
C9 C10 1.489(5) .
C9 H9A 0.9700 .
C9 H9B 0.9700 .
C10 O4 1.433(5) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 O4 1.422(4) .
C11 C12 1.497(5) .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 O5 1.430(4) .
C12 H12A 0.9700 .
C12 H12B 0.9700 .
C13 O5 1.421(4) .
C13 C14 1.490(5) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 O6 1.433(4) .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
F1 P1 1.597(3) .
F2 P1 1.607(2) .
F3 P1 1.587(3) .
F4 P1 1.581(3) .
F5 P1 1.591(2) .
F6 P1 1.592(3) .
O1 Si1 1.666(3) .
O6 Si2 1.660(3) .
Si1 Si2 2.3444(14) .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
C10 H10A F4 0.97 2.57 3.353(5) 138.2 2_657
C13 H13A F2 0.97 2.49 3.376(4) 151.3 .
C14 H14A O2 0.97 2.52 3.486(4) 175.0 2_646
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
O1 C5 C6 O2 64.6(4) .
O2 C7 C8 O3 -58.9(4) .
O3 C9 C10 O4 62.6(4) .
O4 C11 C12 O5 -64.9(4) .
O5 C13 C14 O6 -62.1(4) .
C6 C5 O1 Si1 108.0(3) .
C6 C5 O1 K1 -48.1(3) .
C5 C6 O2 C7 178.4(3) .
C5 C6 O2 K1 -47.0(3) .
C8 C7 O2 C6 -173.1(3) .
C8 C7 O2 K1 53.9(3) .
C10 C9 O3 C8 -172.2(3) .
C10 C9 O3 K1 -24.7(4) .
C7 C8 O3 C9 -175.5(3) .
C7 C8 O3 K1 38.0(4) .
C12 C11 O4 C10 -176.5(3) .
C12 C11 O4 K1 60.0(3) .
C9 C10 O4 C11 164.4(3) .
C9 C10 O4 K1 -69.9(3) .
C14 C13 O5 C12 -167.3(3) .
C14 C13 O5 K1 72.8(3) .
C11 C12 O5 C13 -78.5(4) .
C11 C12 O5 K1 35.0(3) .
C13 C14 O6 Si2 -166.0(2) .
C13 C14 O6 K1 14.2(4) .
K1 F3 P1 F4 -137.34(12) .
K1 F3 P1 F5 132.20(11) .
K1 F3 P1 F1 42.16(11) .
K1 F3 P1 F2 -46.86(11) .
K1 F1 P1 F3 -50.84(13) .
K1 F1 P1 F5 -141.70(12) .
K1 F1 P1 F6 128.13(13) .
K1 F1 P1 F2 38.07(13) .
K1 F2 P1 F4 143.95(13) .
K1 F2 P1 F3 53.45(14) .
K1 F2 P1 F6 -125.72(13) .
K1 F2 P1 F1 -35.99(13) .
C5 O1 Si1 C1 41.3(3) .
K1 O1 Si1 C1 -163.41(15) .
C5 O1 Si1 C2 -80.3(3) .
K1 O1 Si1 C2 74.97(18) .
C5 O1 Si1 Si2 158.4(2) .
K1 O1 Si1 Si2 -46.33(14) .
C5 O1 Si1 K1 -155.3(3) .
C14 O6 Si2 C4 70.5(3) .
K1 O6 Si2 C4 -109.72(18) .
C14 O6 Si2 C3 -49.0(3) .
K1 O6 Si2 C3 130.73(16) .
C14 O6 Si2 Si1 -166.2(2) .
K1 O6 Si2 Si1 13.52(15) .
K1 C3 Si2 O6 -34.9(5) 2_646
K1 C3 Si2 C4 -154.5(4) 2_646
K1 C3 Si2 Si1 80.3(4) 2_646
