
data_2b

_audit_creation_method            'SHELXL-2016/6'
_shelx_SHELXL_version_number      '2016/6'
_chemical_name_systematic         ?
_chemical_name_common             ?
_chemical_melting_point           ?
_chemical_formula_moiety          ?
_chemical_formula_sum
 'C42 H52 B2 Cl2 O6'
_chemical_formula_weight          745.35

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'
 'B'  'B'   0.0013   0.0007
 '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'
 'Cl'  'Cl'   0.1484   0.1585
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system       monoclinic
_space_group_IT_number            15
_space_group_name_H-M_alt         'C 2/c'
_space_group_name_Hall            '-C 2yc'

_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, -z+1/2'
 'x+1/2, y+1/2, z'
 '-x+1/2, y+1/2, -z+1/2'
 '-x, -y, -z'
 'x, -y, z-1/2'
 '-x+1/2, -y+1/2, -z'
 'x+1/2, -y+1/2, z-1/2'

_cell_length_a                    16.1154(5)
_cell_length_b                    12.2973(3)
_cell_length_c                    21.8677(6)
_cell_angle_alpha                 90
_cell_angle_beta                  113.366(4)
_cell_angle_gamma                 90
_cell_volume                      3978.2(2)
_cell_formula_units_Z             4
_cell_measurement_temperature     123(2)

_cell_measurement_reflns_used     11814

_cell_measurement_theta_min       2.1420

_cell_measurement_theta_max       30.4610


_exptl_crystal_description              'Block'
_exptl_crystal_colour                   'Yellow'

_exptl_crystal_density_meas       ?
_exptl_crystal_density_method     ?
_exptl_crystal_density_diffrn     1.244
_exptl_crystal_F_000              1584
_exptl_transmission_factor_min    ?
_exptl_transmission_factor_max    ?
_exptl_crystal_size_max           0.200
_exptl_crystal_size_mid           0.200
_exptl_crystal_size_min           0.100
_exptl_absorpt_coefficient_mu     0.209
_shelx_estimated_absorpt_T_min    0.959
_shelx_estimated_absorpt_T_max    0.979
_exptl_absorpt_correction_type    multi-scan

_exptl_absorpt_correction_T_min   0.84912

_exptl_absorpt_correction_T_max   1.00000

_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.41 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;

_exptl_absorpt_special_details    ?
_diffrn_ambient_temperature       123(2)
_diffrn_radiation_wavelength      0.71073
_diffrn_radiation_type            MoK\a
_diffrn_source                    'fine-focus sealed X-ray tube'
_diffrn_measurement_device_type   'dtrek-CrysAlisPro-abstract goniometer imported rigaku-d*trek images'

_diffrn_measurement_method        'ω scans'

_diffrn_detector_area_resol_mean  ?

_diffrn_reflns_number             20892
_diffrn_reflns_av_unetI/netI      0.0162
_diffrn_reflns_av_R_equivalents   0.0235
_diffrn_reflns_limit_h_min        -19
_diffrn_reflns_limit_h_max        19
_diffrn_reflns_limit_k_min        -14
_diffrn_reflns_limit_k_max        14
_diffrn_reflns_limit_l_min        -25
_diffrn_reflns_limit_l_max        25
_diffrn_reflns_theta_min          2.135
_diffrn_reflns_theta_max          24.994
_diffrn_reflns_theta_full         24.994
_diffrn_measured_fraction_theta_max   1.000
_diffrn_measured_fraction_theta_full  1.000
_diffrn_reflns_Laue_measured_fraction_max    1.000
_diffrn_reflns_Laue_measured_fraction_full   1.000
_diffrn_reflns_point_group_measured_fraction_max   1.000
_diffrn_reflns_point_group_measured_fraction_full  1.000
_reflns_number_total              3486
_reflns_number_gt                 3075
_reflns_threshold_expression      'I > 2σ(I)'
_reflns_Friedel_coverage          0.000
_reflns_Friedel_fraction_max      .
_reflns_Friedel_fraction_full     .

_reflns_special_details
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.

 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection        'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_cell_refinement        'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_reduction         'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_structure_solution     SIR-97

_computing_structure_refinement 'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics 'Yadokari-XG 2009 (Wakita Nemoto et al., 2009)'

_computing_publication_material
;Yadokari-XG 2009 (Wakita,Nemoto et al., 2009)
;

_refine_special_details           ?
_refine_ls_structure_factor_coef  Fsqd
_refine_ls_matrix_type            full
_refine_ls_weighting_scheme       calc
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0684P)²+9.0562P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary      ?
_atom_sites_solution_secondary    ?
_atom_sites_solution_hydrogens    geom
_refine_ls_hydrogen_treatment     constr

_refine_ls_extinction_method      none
_refine_ls_extinction_coef        .
_refine_ls_number_reflns          3486
_refine_ls_number_parameters      276
_refine_ls_number_restraints      0
_refine_ls_R_factor_all           0.0570
_refine_ls_R_factor_gt            0.0512
_refine_ls_wR_factor_ref          0.1431
_refine_ls_wR_factor_gt           0.1383
_refine_ls_goodness_of_fit_ref    1.056
_refine_ls_restrained_S_all       1.056
_refine_ls_shift/su_max           0.000
_refine_ls_shift/su_mean          0.000

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
O3 O 0.70244(10) 0.20291(11) 0.37834(6) 0.0198(3) Uani 1 1 d . . . . .
C2 C 0.74603(13) 0.30339(16) 0.38826(9) 0.0173(4) Uani 1 1 d . . . . .
C3 C 0.77937(12) 0.35517(16) 0.45109(9) 0.0158(4) Uani 1 1 d . . . . .
C4 C 0.77124(12) 0.30201(15) 0.50552(9) 0.0157(4) Uani 1 1 d . . . . .
C5 C 0.80497(13) 0.34887(16) 0.56757(9) 0.0172(4) Uani 1 1 d . . . . .
C6 C 0.84578(13) 0.45094(16) 0.57668(10) 0.0189(4) Uani 1 1 d . . . . .
H3 H 0.868220 0.483034 0.619726 0.023 Uiso 1 1 calc R U . . .
C7 C 0.85441(13) 0.50684(16) 0.52428(10) 0.0179(4) Uani 1 1 d . . . . .
C8 C 0.82269(12) 0.45728(15) 0.45917(10) 0.0170(4) Uani 1 1 d . . . . .
C9 C 0.83364(13) 0.50279(16) 0.40331(10) 0.0195(4) Uani 1 1 d . . . . .
H4 H 0.863393 0.570858 0.407907 0.023 Uiso 1 1 calc R U . . .
C10 C 0.80222(13) 0.45082(16) 0.34245(10) 0.0202(4) Uani 1 1 d . . . . .
C11 C 0.75675(13) 0.34978(17) 0.33508(10) 0.0199(4) Uani 1 1 d . . . . .
H5 H 0.733703 0.314271 0.293054 0.024 Uiso 1 1 calc R U . . .
B1 B 0.89163(15) 0.62557(19) 0.53919(11) 0.0199(5) Uani 1 1 d . . . . .
O1 O 0.88283(10) 0.70246(11) 0.49200(7) 0.0230(3) Uani 1 1 d . . . . .
C12 C 0.93492(14) 0.79739(16) 0.52707(11) 0.0233(5) Uani 1 1 d . . . . .
C13 C 0.93763(14) 0.78222(16) 0.59843(11) 0.0232(5) Uani 1 1 d . . . . .
O2 O 0.93202(10) 0.66382(11) 0.60302(7) 0.0229(3) Uani 1 1 d . . . . .
C14 C 0.88721(16) 0.89938(18) 0.49103(12) 0.0336(6) Uani 1 1 d . . . . .
H6 H 0.889982 0.902767 0.447105 0.050 Uiso 1 1 calc R U . . .
H7 H 0.916967 0.963555 0.517071 0.050 Uiso 1 1 calc R U . . .
H8 H 0.823893 0.897658 0.485654 0.050 Uiso 1 1 calc R U . . .
C15 C 1.02746(16) 0.78602(19) 0.52424(13) 0.0330(5) Uani 1 1 d . . . . .
H9 H 1.056932 0.719766 0.547775 0.050 Uiso 1 1 calc R U . . .
H10 H 1.064699 0.849312 0.545465 0.050 Uiso 1 1 calc R U . . .
H11 H 1.020283 0.781671 0.477657 0.050 Uiso 1 1 calc R U . . .
C16 C 1.02439(16) 0.82121(19) 0.65387(12) 0.0330(5) Uani 1 1 d . . . . .
H12 H 1.021390 0.807520 0.697089 0.050 Uiso 1 1 calc R U . . .
H13 H 1.031792 0.899342 0.648750 0.050 Uiso 1 1 calc R U . . .
H14 H 1.075946 0.781919 0.651502 0.050 Uiso 1 1 calc R U . . .
C17 C 0.85622(16) 0.82879(19) 0.60763(12) 0.0328(5) Uani 1 1 d . . . . .
H15 H 0.800759 0.803632 0.571406 0.049 Uiso 1 1 calc R U . . .
H16 H 0.858701 0.908390 0.607015 0.049 Uiso 1 1 calc R U . . .
H17 H 0.856584 0.804446 0.650406 0.049 Uiso 1 1 calc R U . . .
C18 C 0.81464(15) 0.49995(18) 0.28207(10) 0.0242(5) Uani 1 1 d . . . . .
C19 C 0.8733(2) 0.6056(3) 0.30051(16) 0.0380(10) Uani 0.742(5) 1 d . . P A 1
H18 H 0.932788 0.589115 0.335232 0.057 Uiso 0.742(5) 1 calc R U P A 1
H19 H 0.880526 0.633383 0.260915 0.057 Uiso 0.742(5) 1 calc R U P A 1
H20 H 0.843208 0.660700 0.316958 0.057 Uiso 0.742(5) 1 calc R U P A 1
C20 C 0.8661(2) 0.4186(3) 0.25667(16) 0.0375(9) Uani 0.742(5) 1 d . . P A 1
H21 H 0.924697 0.402022 0.292504 0.056 Uiso 0.742(5) 1 calc R U P A 1
H22 H 0.830747 0.351523 0.242470 0.056 Uiso 0.742(5) 1 calc R U P A 1
H23 H 0.875627 0.450291 0.218859 0.056 Uiso 0.742(5) 1 calc R U P A 1
C21 C 0.7244(2) 0.5280(3) 0.22906(16) 0.0362(9) Uani 0.742(5) 1 d . . P A 1
H24 H 0.732699 0.559270 0.190652 0.054 Uiso 0.742(5) 1 calc R U P A 1
H25 H 0.687454 0.462043 0.215235 0.054 Uiso 0.742(5) 1 calc R U P A 1
H26 H 0.693981 0.580932 0.246576 0.054 Uiso 0.742(5) 1 calc R U P A 1
C22 C 0.7532(8) 0.6046(9) 0.2632(5) 0.042(3) Uani 0.258(5) 1 d . . P A 2
H27 H 0.690811 0.584374 0.254954 0.062 Uiso 0.258(5) 1 calc R U P A 2
H28 H 0.775493 0.656962 0.299890 0.062 Uiso 0.258(5) 1 calc R U P A 2
H29 H 0.754930 0.637464 0.222873 0.062 Uiso 0.258(5) 1 calc R U P A 2
C23 C 0.9056(6) 0.5218(8) 0.2947(4) 0.029(2) Uani 0.258(5) 1 d . . P A 2
H30 H 0.909757 0.552905 0.254739 0.043 Uiso 0.258(5) 1 calc R U P A 2
H31 H 0.930091 0.573625 0.331609 0.043 Uiso 0.258(5) 1 calc R U P A 2
H32 H 0.940512 0.454105 0.306574 0.043 Uiso 0.258(5) 1 calc R U P A 2
C24 C 0.7711(8) 0.4239(9) 0.2175(5) 0.047(3) Uani 0.258(5) 1 d . . P A 2
H33 H 0.707741 0.409076 0.209070 0.071 Uiso 0.258(5) 1 calc R U P A 2
H34 H 0.774431 0.460926 0.178863 0.071 Uiso 0.258(5) 1 calc R U P A 2
H35 H 0.804541 0.355194 0.225154 0.071 Uiso 0.258(5) 1 calc R U P A 2
Cl1 Cl 0.50892(6) 0.36464(7) 0.35006(4) 0.0595(3) Uani 1 1 d . . . . .
C25 C 0.5035(6) 0.3211(5) 0.2731(3) 0.069(3) Uani 0.5 1 d . . P B -1
H36 H 0.559767 0.281880 0.278907 0.083 Uiso 0.5 1 calc R U P B -1
H37 H 0.452186 0.270221 0.253132 0.083 Uiso 0.5 1 calc R U P B -1
C26 C 0.4915(4) 0.4165(4) 0.2271(2) 0.0389(12) Uani 0.5 1 d . . P B -1
H38 H 0.541554 0.469037 0.247139 0.047 Uiso 0.5 1 calc R U P B -1
H39 H 0.433761 0.454162 0.219047 0.047 Uiso 0.5 1 calc R U P B -1


_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

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
O3 C5 1.390(2) 7_656 ?
O3 C2 1.395(2) . ?
C2 C11 1.366(3) . ?
C2 C3 1.413(3) . ?
C3 C4 1.409(3) . ?
C3 C8 1.413(3) . ?
C4 C5 1.373(3) . ?
C4 C4 1.425(4) 7_656 ?
C5 C6 1.394(3) . ?
C6 C7 1.390(3) . ?
C7 C8 1.443(3) . ?
C7 B1 1.563(3) . ?
C8 C9 1.417(3) . ?
C9 C10 1.379(3) . ?
C10 C11 1.419(3) . ?
C10 C18 1.536(3) . ?
B1 O1 1.365(3) . ?
B1 O2 1.368(3) . ?
O1 C12 1.465(2) . ?
C12 C14 1.518(3) . ?
C12 C15 1.523(3) . ?
C12 C13 1.555(3) . ?
C13 O2 1.465(2) . ?
C13 C17 1.516(3) . ?
C13 C16 1.520(3) . ?
C18 C23 1.406(9) . ?
C18 C21 1.497(4) . ?
C18 C20 1.537(4) . ?
C18 C19 1.563(4) . ?
C18 C22 1.576(9) . ?
C18 C24 1.605(9) . ?
Cl1 C25 1.735(8) . ?
C25 C26 1.507(7) . ?

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
C5 O3 C2 118.78(15) 7_656 . ?
C11 C2 O3 117.59(17) . . ?
C11 C2 C3 120.78(18) . . ?
O3 C2 C3 121.62(17) . . ?
C4 C3 C2 119.04(18) . . ?
C4 C3 C8 120.89(17) . . ?
C2 C3 C8 120.03(17) . . ?
C5 C4 C3 120.49(18) . . ?
C5 C4 C4 121.3(2) . 7_656 ?
C3 C4 C4 118.2(2) . 7_656 ?
C4 C5 O3 121.01(18) . 7_656 ?
C4 C5 C6 119.91(18) . . ?
O3 C5 C6 119.07(17) 7_656 . ?
C7 C6 C5 121.55(18) . . ?
C6 C7 C8 119.51(18) . . ?
C6 C7 B1 116.46(17) . . ?
C8 C7 B1 123.83(18) . . ?
C3 C8 C9 117.86(18) . . ?
C3 C8 C7 117.56(17) . . ?
C9 C8 C7 124.56(18) . . ?
C10 C9 C8 121.70(18) . . ?
C9 C10 C11 119.39(18) . . ?
C9 C10 C18 121.63(18) . . ?
C11 C10 C18 118.98(18) . . ?
C2 C11 C10 120.19(18) . . ?
O1 B1 O2 113.44(18) . . ?
O1 B1 C7 124.97(19) . . ?
O2 B1 C7 121.46(18) . . ?
B1 O1 C12 106.87(16) . . ?
O1 C12 C14 108.64(17) . . ?
O1 C12 C15 105.82(17) . . ?
C14 C12 C15 110.93(18) . . ?
O1 C12 C13 102.24(15) . . ?
C14 C12 C13 115.27(18) . . ?
C15 C12 C13 113.05(18) . . ?
O2 C13 C17 106.63(17) . . ?
O2 C13 C16 108.74(17) . . ?
C17 C13 C16 110.23(18) . . ?
O2 C13 C12 102.13(15) . . ?
C17 C13 C12 113.98(18) . . ?
C16 C13 C12 114.42(18) . . ?
B1 O2 C13 106.80(16) . . ?
C23 C18 C10 112.8(4) . . ?
C21 C18 C10 109.8(2) . . ?
C21 C18 C20 111.6(2) . . ?
C10 C18 C20 109.12(19) . . ?
C21 C18 C19 108.1(2) . . ?
C10 C18 C19 112.14(19) . . ?
C20 C18 C19 106.1(2) . . ?
C23 C18 C22 113.2(6) . . ?
C10 C18 C22 105.3(4) . . ?
C23 C18 C24 110.0(6) . . ?
C10 C18 C24 111.5(4) . . ?
C22 C18 C24 103.6(7) . . ?
C26 C25 Cl1 110.6(4) . . ?
C25 C26 Cl1 107.5(4) . 2_655 ?

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
C5 O3 C2 C11 176.51(17) 7_656 . . . ?
C5 O3 C2 C3 -2.5(3) 7_656 . . . ?
C11 C2 C3 C4 -176.64(18) . . . . ?
O3 C2 C3 C4 2.4(3) . . . . ?
C11 C2 C3 C8 1.4(3) . . . . ?
O3 C2 C3 C8 -179.61(16) . . . . ?
C2 C3 C4 C5 178.36(17) . . . . ?
C8 C3 C4 C5 0.3(3) . . . . ?
C2 C3 C4 C4 -0.5(3) . . . 7_656 ?
C8 C3 C4 C4 -178.5(2) . . . 7_656 ?
C3 C4 C5 O3 -179.83(16) . . . 7_656 ?
C4 C4 C5 O3 -1.0(3) 7_656 . . 7_656 ?
C3 C4 C5 C6 1.5(3) . . . . ?
C4 C4 C5 C6 -179.7(2) 7_656 . . . ?
C4 C5 C6 C7 -0.8(3) . . . . ?
O3 C5 C6 C7 -179.51(17) 7_656 . . . ?
C5 C6 C7 C8 -1.7(3) . . . . ?
C5 C6 C7 B1 173.46(18) . . . . ?
C4 C3 C8 C9 175.99(17) . . . . ?
C2 C3 C8 C9 -2.0(3) . . . . ?
C4 C3 C8 C7 -2.7(3) . . . . ?
C2 C3 C8 C7 179.29(17) . . . . ?
C6 C7 C8 C3 3.4(3) . . . . ?
B1 C7 C8 C3 -171.41(17) . . . . ?
C6 C7 C8 C9 -175.26(18) . . . . ?
B1 C7 C8 C9 10.0(3) . . . . ?
C3 C8 C9 C10 0.9(3) . . . . ?
C7 C8 C9 C10 179.55(18) . . . . ?
C8 C9 C10 C11 0.8(3) . . . . ?
C8 C9 C10 C18 -179.64(18) . . . . ?
O3 C2 C11 C10 -178.69(17) . . . . ?
C3 C2 C11 C10 0.4(3) . . . . ?
C9 C10 C11 C2 -1.4(3) . . . . ?
C18 C10 C11 C2 178.96(18) . . . . ?
C6 C7 B1 O1 -161.65(19) . . . . ?
C8 C7 B1 O1 13.3(3) . . . . ?
C6 C7 B1 O2 14.0(3) . . . . ?
C8 C7 B1 O2 -171.09(18) . . . . ?
O2 B1 O1 C12 9.7(2) . . . . ?
C7 B1 O1 C12 -174.38(19) . . . . ?
B1 O1 C12 C14 -145.96(19) . . . . ?
B1 O1 C12 C15 94.9(2) . . . . ?
B1 O1 C12 C13 -23.7(2) . . . . ?
O1 C12 C13 O2 28.57(18) . . . . ?
C14 C12 C13 O2 146.22(17) . . . . ?
C15 C12 C13 O2 -84.73(19) . . . . ?
O1 C12 C13 C17 -86.0(2) . . . . ?
C14 C12 C13 C17 31.6(2) . . . . ?
C15 C12 C13 C17 160.69(18) . . . . ?
O1 C12 C13 C16 145.85(17) . . . . ?
C14 C12 C13 C16 -96.5(2) . . . . ?
C15 C12 C13 C16 32.6(2) . . . . ?
O1 B1 O2 C13 10.1(2) . . . . ?
C7 B1 O2 C13 -166.04(18) . . . . ?
C17 C13 O2 B1 95.99(19) . . . . ?
C16 C13 O2 B1 -145.17(18) . . . . ?
C12 C13 O2 B1 -23.9(2) . . . . ?
C9 C10 C18 C23 56.2(5) . . . . ?
C11 C10 C18 C23 -124.2(5) . . . . ?
C9 C10 C18 C21 -114.7(3) . . . . ?
C11 C10 C18 C21 64.9(3) . . . . ?
C9 C10 C18 C20 122.7(2) . . . . ?
C11 C10 C18 C20 -57.7(3) . . . . ?
C9 C10 C18 C19 5.4(3) . . . . ?
C11 C10 C18 C19 -175.0(2) . . . . ?
C9 C10 C18 C22 -67.7(6) . . . . ?
C11 C10 C18 C22 111.9(6) . . . . ?
C9 C10 C18 C24 -179.4(5) . . . . ?
C11 C10 C18 C24 0.2(6) . . . . ?
Cl1 C25 C26 Cl1 177.7(4) . . . 2_655 ?

_refine_diff_density_max    0.715
_refine_diff_density_min   -0.887
_refine_diff_density_rms    0.057



_diffrn_radiation_source          ?
_diffrn_radiation_monochromator   graphite
_publ_section_references
;Wakita, K. (2001). Yadokari-XG. Software for Crystal Structure Analyses.
Release of Software (Yadokari-XG 2009) for Crystal Structure Analyses,
Kabuto, C., Akine, S., Nemoto, T. & Kwon, E. (2009).
J. Cryst. Soc.  Jpn. 51, 218-224.
;
_chemical_absolute_configuration  ?
