#------------------------------------------------------------------------------
#$Date: 2017-05-06 00:59:54 +0300 (Sat, 06 May 2017) $
#$Revision: 196398 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/04/16/7041685.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_7041685
loop_
_publ_author_name
'Han, Haixiang'
'Wei, Zheng'
'Barry, Matthew C.'
'Filatov, Alexander S.'
'Dikarev, Evgeny V.'
_publ_section_title
;
 Heterometallic molecular precursors for a lithium-iron oxide material:
 synthesis, solid state structure, solution and gas-phase behaviour, and
 thermal decomposition.
;
_journal_issue                   17
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5644
_journal_page_last               5649
_journal_paper_doi               10.1039/c6dt04602a
_journal_volume                  46
_journal_year                    2017
_chemical_formula_moiety         'C48 H78 Mg3 O18'
_chemical_formula_sum            'C48 H78 Mg3 O18'
_chemical_formula_weight         1016.03
_chemical_name_systematic
; 
 ? 
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2016-11-21 deposited with the CCDC.
2017-01-13 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 101.082(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   9.7090(8)
_cell_length_b                   17.0101(14)
_cell_length_c                   17.5059(15)
_cell_measurement_reflns_used    9518
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      30.45
_cell_measurement_theta_min      2.90
_cell_volume                     2837.2(4)
_computing_cell_refinement       'SAINT V.8.27 (Bruker AXS Inc., 2012)'
_computing_data_collection       'APEX2 v.2016.1-0 (Bruker AXS Inc., 2016)'
_computing_data_reduction        'SAINT V.8.27 (Bruker AXS Inc., 2012)'
_computing_molecular_graphics    'SHELXTL Ver. 6.14'
_computing_publication_material  'SHELXTL Ver. 6.14'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker D8 Venture PHOTON 100 CMOS'
_diffrn_measurement_method       'omega and phi scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0664
_diffrn_reflns_av_sigmaI/netI    0.0469
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            82688
_diffrn_reflns_theta_full        30.59
_diffrn_reflns_theta_max         30.59
_diffrn_reflns_theta_min         3.11
_exptl_absorpt_coefficient_mu    0.118
_exptl_absorpt_correction_T_max  0.9918
_exptl_absorpt_correction_T_min  0.9698
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS V2012/1 (Bruker AXS Inc.)
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.189
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    none
_exptl_crystal_description       block
_exptl_crystal_F_000             1092
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.07
_refine_diff_density_max         0.410
_refine_diff_density_min         -0.229
_refine_diff_density_rms         0.056
_refine_ls_extinction_coef       noref
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     325
_refine_ls_number_reflns         8695
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.030
_refine_ls_R_factor_all          0.0879
_refine_ls_R_factor_gt           0.0473
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0453P)²+0.9581P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0950
_refine_ls_wR_factor_ref         0.1089
_reflns_number_gt                5929
_reflns_number_total             8695
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6dt04602a2.cif
_cod_data_source_block           Mgtbaoac2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 4268 2015-11-12 08:31:59Z antanas 

 Adding full bibliography for 7041683--7041687.cif.
;
_cod_database_code               7041685
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Mg1 Mg 0.5000 0.5000 0.5000 0.01321(13) Uani 1 2 d S
Mg2 Mg 0.63489(4) 0.43076(3) 0.64145(3) 0.01424(10) Uani 1 1 d .
O1 O 0.82854(11) 0.21753(6) 0.60286(6) 0.0265(2) Uani 1 1 d .
O2 O 0.74990(10) 0.33225(6) 0.64112(6) 0.0207(2) Uani 1 1 d .
O3 O 0.50875(9) 0.38542(5) 0.54103(5) 0.01535(19) Uani 1 1 d .
O4 O 0.99566(10) 0.54083(6) 0.76544(6) 0.0234(2) Uani 1 1 d .
O5 O 0.78915(9) 0.48149(6) 0.71954(5) 0.0187(2) Uani 1 1 d .
O6 O 0.70790(9) 0.49463(5) 0.55622(5) 0.01531(19) Uani 1 1 d .
O7 O 0.37519(10) 0.39348(6) 0.80349(6) 0.0239(2) Uani 1 1 d .
O8 O 0.53293(9) 0.39784(6) 0.72521(5) 0.0187(2) Uani 1 1 d .
O9 O 0.48186(9) 0.51751(5) 0.61443(5) 0.01504(19) Uani 1 1 d .
C1 C 0.39552(15) 0.29707(9) 0.44405(9) 0.0235(3) Uani 1 1 d .
H1A H 0.3074 0.2929 0.4632 0.035 Uiso 1 1 calc R
H1B H 0.4150 0.2470 0.4206 0.035 Uiso 1 1 calc R
H1C H 0.3874 0.3389 0.4049 0.035 Uiso 1 1 calc R
C2 C 0.51316(14) 0.31611(8) 0.51063(8) 0.0165(3) Uani 1 1 d .
C3 C 0.61580(15) 0.26159(8) 0.53508(8) 0.0203(3) Uani 1 1 d .
H3 H 0.6088 0.2120 0.5096 0.024 Uiso 1 1 calc R
C4 C 0.73240(14) 0.27509(8) 0.59658(8) 0.0193(3) Uani 1 1 d .
C5 C 0.95714(16) 0.21928(11) 0.66365(9) 0.0316(4) Uani 1 1 d .
C6 C 1.0301(2) 0.14372(13) 0.64620(12) 0.0483(5) Uani 1 1 d .
H6A H 0.9691 0.0986 0.6505 0.072 Uiso 1 1 calc R
H6B H 1.1185 0.1378 0.6836 0.072 Uiso 1 1 calc R
H6C H 1.0494 0.1462 0.5933 0.072 Uiso 1 1 calc R
C7 C 1.04579(18) 0.28990(13) 0.65403(12) 0.0462(5) Uani 1 1 d .
H7A H 1.0608 0.2922 0.6003 0.069 Uiso 1 1 calc R
H7B H 1.1365 0.2857 0.6897 0.069 Uiso 1 1 calc R
H7C H 0.9977 0.3378 0.6658 0.069 Uiso 1 1 calc R
C8 C 0.91802(19) 0.21450(12) 0.74325(10) 0.0395(4) Uani 1 1 d .
H8A H 0.8676 0.2623 0.7528 0.059 Uiso 1 1 calc R
H8B H 1.0034 0.2094 0.7832 0.059 Uiso 1 1 calc R
H8C H 0.8577 0.1687 0.7453 0.059 Uiso 1 1 calc R
C9 C 0.28950(13) 0.60217(8) 0.61784(8) 0.0180(3) Uani 1 1 d .
H9A H 0.3504 0.6480 0.6174 0.027 Uiso 1 1 calc R
H9B H 0.2215 0.6129 0.6513 0.027 Uiso 1 1 calc R
H9C H 0.2394 0.5913 0.5648 0.027 Uiso 1 1 calc R
C10 C 0.37675(13) 0.53237(8) 0.64847(7) 0.0148(3) Uani 1 1 d .
C11 C 0.34475(14) 0.48982(8) 0.70927(8) 0.0178(3) Uani 1 1 d .
H11 H 0.2642 0.5045 0.7293 0.021 Uiso 1 1 calc R
C12 C 0.42577(14) 0.42495(8) 0.74391(8) 0.0172(3) Uani 1 1 d .
C13 C 0.45446(16) 0.33249(10) 0.85369(10) 0.0301(4) Uani 1 1 d .
C14 C 0.4728(2) 0.25936(11) 0.80770(12) 0.0450(5) Uani 1 1 d .
H14A H 0.3820 0.2438 0.7766 0.067 Uiso 1 1 calc R
H14B H 0.5095 0.2167 0.8436 0.067 Uiso 1 1 calc R
H14C H 0.5389 0.2701 0.7731 0.067 Uiso 1 1 calc R
C15 C 0.59234(18) 0.36712(13) 0.89612(11) 0.0427(5) Uani 1 1 d .
H15A H 0.6531 0.3780 0.8587 0.064 Uiso 1 1 calc R
H15B H 0.6389 0.3296 0.9352 0.064 Uiso 1 1 calc R
H15C H 0.5740 0.4161 0.9219 0.064 Uiso 1 1 calc R
C16 C 0.35810(19) 0.31544(12) 0.91056(11) 0.0424(5) Uani 1 1 d .
H16A H 0.3444 0.3636 0.9389 0.064 Uiso 1 1 calc R
H16B H 0.4005 0.2749 0.9475 0.064 Uiso 1 1 calc R
H16C H 0.2672 0.2968 0.8819 0.064 Uiso 1 1 calc R
C17 C 0.85467(14) 0.57229(9) 0.49158(8) 0.0208(3) Uani 1 1 d .
H17A H 0.8844 0.5310 0.4592 0.031 Uiso 1 1 calc R
H17B H 0.9303 0.6109 0.5054 0.031 Uiso 1 1 calc R
H17C H 0.7707 0.5984 0.4626 0.031 Uiso 1 1 calc R
C18 C 0.82186(13) 0.53640(8) 0.56449(8) 0.0159(3) Uani 1 1 d .
C19 C 0.91233(14) 0.54801(9) 0.63359(8) 0.0192(3) Uani 1 1 d .
H19 H 0.9957 0.5768 0.6325 0.023 Uiso 1 1 calc R
C20 C 0.89080(13) 0.52005(8) 0.70721(8) 0.0172(3) Uani 1 1 d .
C21 C 0.99655(15) 0.51685(10) 0.84663(8) 0.0247(3) Uani 1 1 d .
C22 C 1.00405(18) 0.42856(10) 0.85368(10) 0.0322(4) Uani 1 1 d .
H22A H 0.9166 0.4055 0.8252 0.048 Uiso 1 1 calc R
H22B H 1.0173 0.4137 0.9087 0.048 Uiso 1 1 calc R
H22C H 1.0831 0.4091 0.8317 0.048 Uiso 1 1 calc R
C23 C 0.87156(18) 0.55159(11) 0.87487(9) 0.0346(4) Uani 1 1 d .
H23A H 0.8667 0.6082 0.8642 0.052 Uiso 1 1 calc R
H23B H 0.8819 0.5428 0.9310 0.052 Uiso 1 1 calc R
H23C H 0.7853 0.5263 0.8477 0.052 Uiso 1 1 calc R
C24 C 1.13245(19) 0.55385(13) 0.88943(10) 0.0427(5) Uani 1 1 d .
H24A H 1.2118 0.5322 0.8692 0.064 Uiso 1 1 calc R
H24B H 1.1445 0.5423 0.9452 0.064 Uiso 1 1 calc R
H24C H 1.1285 0.6109 0.8815 0.064 Uiso 1 1 calc R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mg Mg 0.0486 0.0363 '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
O9 Mg1 O9 180.00(5) 3_666 .
O9 Mg1 O6 78.61(3) 3_666 3_666
O9 Mg1 O6 101.39(3) . 3_666
O9 Mg1 O6 101.39(3) 3_666 .
O9 Mg1 O6 78.61(3) . .
O6 Mg1 O6 180.0 3_666 .
O9 Mg1 O3 101.24(4) 3_666 .
O9 Mg1 O3 78.76(4) . .
O6 Mg1 O3 100.22(4) 3_666 .
O6 Mg1 O3 79.78(3) . .
O9 Mg1 O3 78.76(4) 3_666 3_666
O9 Mg1 O3 101.24(4) . 3_666
O6 Mg1 O3 79.78(3) 3_666 3_666
O6 Mg1 O3 100.22(4) . 3_666
O3 Mg1 O3 180.0 . 3_666
O9 Mg1 Mg2 47.32(3) 3_666 3_666
O9 Mg1 Mg2 132.68(3) . 3_666
O6 Mg1 Mg2 47.15(3) 3_666 3_666
O6 Mg1 Mg2 132.85(3) . 3_666
O3 Mg1 Mg2 132.58(3) . 3_666
O3 Mg1 Mg2 47.42(3) 3_666 3_666
O8 Mg2 O2 97.01(4) . .
O8 Mg2 O5 91.75(4) . .
O2 Mg2 O5 91.03(4) . .
O8 Mg2 O6 163.36(4) . .
O2 Mg2 O6 99.62(4) . .
O5 Mg2 O6 87.23(4) . .
O8 Mg2 O9 86.15(4) . .
O2 Mg2 O9 163.81(5) . .
O5 Mg2 O9 104.78(4) . .
O6 Mg2 O9 78.07(4) . .
O8 Mg2 O3 102.77(4) . .
O2 Mg2 O3 85.76(4) . .
O5 Mg2 O3 165.40(4) . .
O6 Mg2 O3 79.30(4) . .
O9 Mg2 O3 78.06(4) . .
C4 O1 C5 121.50(12) . .
C4 O2 Mg2 130.27(9) . .
C2 O3 Mg1 135.59(8) . .
C2 O3 Mg2 128.38(9) . .
Mg1 O3 Mg2 85.57(4) . .
C20 O4 C21 121.42(11) . .
C20 O5 Mg2 128.42(9) . .
C18 O6 Mg1 139.48(9) . .
C18 O6 Mg2 127.36(8) . .
Mg1 O6 Mg2 85.89(3) . .
C12 O7 C13 120.95(11) . .
C12 O8 Mg2 130.46(9) . .
C10 O9 Mg1 133.82(8) . .
C10 O9 Mg2 128.42(8) . .
Mg1 O9 Mg2 85.87(4) . .
C2 C1 H1A 109.5 . .
C2 C1 H1B 109.5 . .
H1A C1 H1B 109.5 . .
C2 C1 H1C 109.5 . .
H1A C1 H1C 109.5 . .
H1B C1 H1C 109.5 . .
O3 C2 C3 124.53(13) . .
O3 C2 C1 115.72(12) . .
C3 C2 C1 119.74(13) . .
C2 C3 C4 123.57(13) . .
C2 C3 H3 118.2 . .
C4 C3 H3 118.2 . .
O2 C4 O1 120.82(13) . .
O2 C4 C3 126.62(12) . .
O1 C4 C3 112.57(13) . .
O1 C5 C7 110.95(13) . .
O1 C5 C8 109.56(13) . .
C7 C5 C8 113.29(17) . .
O1 C5 C6 101.50(14) . .
C7 C5 C6 110.62(15) . .
C8 C5 C6 110.29(14) . .
C5 C6 H6A 109.5 . .
C5 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
C5 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
C5 C7 H7A 109.5 . .
C5 C7 H7B 109.5 . .
H7A C7 H7B 109.5 . .
C5 C7 H7C 109.5 . .
H7A C7 H7C 109.5 . .
H7B C7 H7C 109.5 . .
C5 C8 H8A 109.5 . .
C5 C8 H8B 109.5 . .
H8A C8 H8B 109.5 . .
C5 C8 H8C 109.5 . .
H8A C8 H8C 109.5 . .
H8B C8 H8C 109.5 . .
C10 C9 H9A 109.5 . .
C10 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C10 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
O9 C10 C11 124.57(12) . .
O9 C10 C9 115.44(11) . .
C11 C10 C9 119.98(12) . .
C10 C11 C12 123.47(12) . .
C10 C11 H11 118.3 . .
C12 C11 H11 118.3 . .
O8 C12 O7 120.46(12) . .
O8 C12 C11 126.90(12) . .
O7 C12 C11 112.63(11) . .
O7 C13 C14 111.27(14) . .
O7 C13 C15 109.15(14) . .
C14 C13 C15 113.36(15) . .
O7 C13 C16 102.00(12) . .
C14 C13 C16 110.03(15) . .
C15 C13 C16 110.45(15) . .
C13 C14 H14A 109.5 . .
C13 C14 H14B 109.5 . .
H14A C14 H14B 109.5 . .
C13 C14 H14C 109.5 . .
H14A C14 H14C 109.5 . .
H14B C14 H14C 109.5 . .
C13 C15 H15A 109.5 . .
C13 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C13 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
C13 C16 H16A 109.5 . .
C13 C16 H16B 109.5 . .
H16A C16 H16B 109.5 . .
C13 C16 H16C 109.5 . .
H16A C16 H16C 109.5 . .
H16B C16 H16C 109.5 . .
C18 C17 H17A 109.5 . .
C18 C17 H17B 109.5 . .
H17A C17 H17B 109.5 . .
C18 C17 H17C 109.5 . .
H17A C17 H17C 109.5 . .
H17B C17 H17C 109.5 . .
O6 C18 C19 124.52(12) . .
O6 C18 C17 116.25(11) . .
C19 C18 C17 119.22(12) . .
C18 C19 C20 124.82(12) . .
C18 C19 H19 117.6 . .
C20 C19 H19 117.6 . .
O5 C20 O4 121.39(12) . .
O5 C20 C19 126.47(12) . .
O4 C20 C19 112.14(11) . .
O4 C21 C22 110.19(13) . .
O4 C21 C23 110.44(13) . .
C22 C21 C23 113.01(14) . .
O4 C21 C24 101.74(12) . .
C22 C21 C24 110.36(14) . .
C23 C21 C24 110.54(14) . .
C21 C22 H22A 109.5 . .
C21 C22 H22B 109.5 . .
H22A C22 H22B 109.5 . .
C21 C22 H22C 109.5 . .
H22A C22 H22C 109.5 . .
H22B C22 H22C 109.5 . .
C21 C23 H23A 109.5 . .
C21 C23 H23B 109.5 . .
H23A C23 H23B 109.5 . .
C21 C23 H23C 109.5 . .
H23A C23 H23C 109.5 . .
H23B C23 H23C 109.5 . .
C21 C24 H24A 109.5 . .
C21 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C21 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mg1 O9 2.0659(9) 3_666
Mg1 O9 2.0660(9) .
Mg1 O6 2.0707(9) 3_666
Mg1 O6 2.0707(9) .
Mg1 O3 2.0732(9) .
Mg1 O3 2.0733(9) 3_666
Mg1 Mg2 2.8262(5) 3_666
Mg2 O8 2.0003(10) .
Mg2 O2 2.0142(11) .
Mg2 O5 2.0173(10) .
Mg2 O6 2.0774(10) .
Mg2 O9 2.0830(10) .
Mg2 O3 2.0874(10) .
O1 C4 1.3426(16) .
O1 C5 1.4770(19) .
O2 C4 1.2375(17) .
O3 C2 1.2977(16) .
O4 C20 1.3423(16) .
O4 C21 1.4771(17) .
O5 C20 1.2380(16) .
O6 C18 1.2994(15) .
O7 C12 1.3462(16) .
O7 C13 1.4768(18) .
O8 C12 1.2382(16) .
O9 C10 1.3017(15) .
C1 C2 1.5020(19) .
C1 H1A 0.9800 .
C1 H1B 0.9800 .
C1 H1C 0.9800 .
C2 C3 1.3684(19) .
C3 C4 1.423(2) .
C3 H3 0.9500 .
C5 C7 1.506(3) .
C5 C8 1.515(2) .
C5 C6 1.526(2) .
C6 H6A 0.9800 .
C6 H6B 0.9800 .
C6 H6C 0.9800 .
C7 H7A 0.9800 .
C7 H7B 0.9800 .
C7 H7C 0.9800 .
C8 H8A 0.9800 .
C8 H8B 0.9800 .
C8 H8C 0.9800 .
C9 C10 1.4967(19) .
C9 H9A 0.9800 .
C9 H9B 0.9800 .
C9 H9C 0.9800 .
C10 C11 1.3712(18) .
C11 C12 1.4216(19) .
C11 H11 0.9500 .
C13 C14 1.511(3) .
C13 C15 1.519(2) .
C13 C16 1.519(2) .
C14 H14A 0.9800 .
C14 H14B 0.9800 .
C14 H14C 0.9800 .
C15 H15A 0.9800 .
C15 H15B 0.9800 .
C15 H15C 0.9800 .
C16 H16A 0.9800 .
C16 H16B 0.9800 .
C16 H16C 0.9800 .
C17 C18 1.5032(18) .
C17 H17A 0.9800 .
C17 H17B 0.9800 .
C17 H17C 0.9800 .
C18 C19 1.3657(19) .
C19 C20 1.4264(19) .
C19 H19 0.9500 .
C21 C22 1.507(2) .
C21 C23 1.515(2) .
C21 C24 1.523(2) .
C22 H22A 0.9800 .
C22 H22B 0.9800 .
C22 H22C 0.9800 .
C23 H23A 0.9800 .
C23 H23B 0.9800 .
C23 H23C 0.9800 .
C24 H24A 0.9800 .
C24 H24B 0.9800 .
C24 H24C 0.9800 .
