# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2018

data_mol6
_audit_creation_date               2018-04-23
# end Validation Reply Form
_audit_creation_method
;
Olex2 1.2
(compiled 2018.04.18 svn.r3501 for OlexSys, GUI svn.r5488)
;
_shelx_SHELXL_version_number       '2018/3'
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.

Sheldrick, G.M. (2015). Acta Cryst. C71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           'C6 H2 F10 O2'
_chemical_formula_sum              'C6 H2 F10 O2'
_chemical_formula_weight           296.08
_chemical_absolute_configuration   ad
_chemical_melting_point            ?
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'
 'O' 'O' 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system        'orthorhombic'
_space_group_IT_number             29
_space_group_name_H-M_alt          'P c a 21'
_space_group_name_Hall             'P 2c -2ac'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'
 '-x, -y, z+1/2'
 'x+1/2, -y, z'
 '-x+1/2, y, z+1/2'

_cell_length_a                     10.3768(4)
_cell_length_b                     20.2598(6)
_cell_length_c                     8.3401(3)
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       1753.35(11)
_cell_formula_units_Z              8
_cell_measurement_reflns_used      7976
_cell_measurement_temperature      100(2)
_cell_measurement_theta_max        27.442
_cell_measurement_theta_min        3.291
_shelx_estimated_absorpt_T_max     0.965
_shelx_estimated_absorpt_T_min     0.943
_exptl_absorpt_coefficient_mu      0.297
_exptl_absorpt_correction_T_max    0.7456
_exptl_absorpt_correction_T_min    0.7137
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details    
 'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.0593 before and 0.0373 after correction. The Ratio of minimum to maximum transmission is 0.9572. The λ/2 correction factor is Not present.'
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              colourless
_exptl_crystal_colour_primary      colourless
_exptl_crystal_density_diffrn      2.243
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         block
_exptl_crystal_F_000               1152
_exptl_crystal_recrystallization_method 
 'The material was recrystallised from DCM by slow evaporation'
_exptl_crystal_size_max            0.2
_exptl_crystal_size_mid            0.12
_exptl_crystal_size_min            0.12
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0228
_diffrn_reflns_av_unetI/netI       0.0176
_diffrn_reflns_Laue_measured_fraction_full  0.991
_diffrn_reflns_Laue_measured_fraction_max  0.991
_diffrn_reflns_limit_h_max         13
_diffrn_reflns_limit_h_min         -13
_diffrn_reflns_limit_k_max         26
_diffrn_reflns_limit_k_min         -26
_diffrn_reflns_limit_l_max         10
_diffrn_reflns_limit_l_min         -10
_diffrn_reflns_number              18866
_diffrn_reflns_point_group_measured_fraction_full  0.993
_diffrn_reflns_point_group_measured_fraction_max  0.993
_diffrn_reflns_theta_full          25.242
_diffrn_reflns_theta_max           27.490
_diffrn_reflns_theta_min           2.010
_diffrn_ambient_temperature        100.02
_diffrn_detector                   'Bruker APEX2 area detector'
_diffrn_detector_area_resol_mean   7.9
_diffrn_detector_type              'CCD area detector'
_diffrn_measured_fraction_theta_full  0.991
_diffrn_measured_fraction_theta_max  0.991
_diffrn_measurement_device         'fixed-chi two circle goniometer'
_diffrn_measurement_device_type    'Bruker APEX-II CCD'
_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_source                     'microfocus sealed X-ray tube'
_diffrn_source_current             50
_diffrn_source_type                'Incoatec Mo I\ms'
_diffrn_source_voltage             0.6
_reflns_Friedel_coverage           0.869
_reflns_Friedel_fraction_full      0.996
_reflns_Friedel_fraction_max       0.995
_reflns_number_gt                  3719
_reflns_number_total               4001
_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.
;
_reflns_threshold_expression       'I > 2σ(I)'
_computing_cell_refinement         'SAINT V8.38A (Madison, 2016)'
_computing_data_collection         'Bruker APEX2 software'
_computing_data_reduction          'SAINT V8.38A (Madison, 2016)'
_computing_molecular_graphics      'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement    'ShelXL (Sheldrick, 2015)'
_computing_structure_solution      'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max           0.454
_refine_diff_density_min           -0.236
_refine_diff_density_rms           0.044
_refine_ls_abs_structure_details
;
 Flack x determined using 1651 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack     0.0(3)
_refine_ls_extinction_coef         .
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.086
_refine_ls_hydrogen_treatment      mixed
_refine_ls_matrix_type             full
_refine_ls_number_parameters       333
_refine_ls_number_reflns           4001
_refine_ls_number_restraints       7
_refine_ls_R_factor_all            0.0283
_refine_ls_R_factor_gt             0.0258
_refine_ls_restrained_S_all        1.085
_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)+(0.0352P)²+0.4431P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.0669
_refine_ls_wR_factor_ref           0.0685
_refine_special_details            ?
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.5 times of:
  All O(H) groups
2. Restrained distances
 O1-H1 \\sim O2-H2 \\sim O3-H3 \\sim O4-H4
 with sigma of 0.02
3.a Idealised tetrahedral OH refined as rotating group with stretchable bonds:
 O1(H1), O2(H2), O4(H4), O3(H3)
;
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary       dual
_atom_sites_solution_secondary     ?
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
 F1 F 0.35316(16) 0.44502(7) 0.8132(2) 0.0167(4) Uani 1 1 d . . . . .
 C1 C 0.3698(2) 0.34695(11) 0.6635(3) 0.0111(5) Uani 1 1 d . . . . .
 O1 O 0.38726(18) 0.32814(8) 0.5059(2) 0.0130(4) Uani 1 1 d D . . . .
 H1 H 0.396(3) 0.2893(10) 0.5015(4) 0.020 Uiso 1 1 calc DGR . . . .
 F2 F 0.32484(16) 0.45181(7) 0.5543(2) 0.0174(3) Uani 1 1 d . . . . .
 C2 C 0.3947(3) 0.42231(11) 0.6696(3) 0.0125(6) Uani 1 1 d . . . . .
 O2 O 0.2420(2) 0.33321(7) 0.7083(2) 0.0136(4) Uani 1 1 d D . . . .
 H2 H 0.2298(9) 0.3460(12) 0.797(3) 0.020 Uiso 1 1 calc DGR . . . .
 C6 C 0.4638(3) 0.30974(11) 0.7767(3) 0.0124(5) Uani 1 1 d . . . . .
 F6 F 0.75087(19) 0.41693(7) 0.7220(2) 0.0240(4) Uani 1 1 d . . . . .
 C5 C 0.6065(3) 0.32866(13) 0.7565(3) 0.0139(5) Uani 1 1 d . . . . .
 F5 F 0.60793(17) 0.42469(7) 0.9133(2) 0.0200(4) Uani 1 1 d . . . . .
 O4 O 0.32520(19) 0.20441(9) 0.1292(2) 0.0145(4) Uani 1 1 d D . . . .
 H4 H 0.316(3) 0.2420(10) 0.149(2) 0.022 Uiso 1 1 calc DGR . . . .
 F4 F 0.57329(17) 0.43138(8) 0.4970(2) 0.0200(4) Uani 1 1 d . . . . .
 C4 C 0.6278(3) 0.40377(13) 0.7628(4) 0.0153(6) Uani 1 1 d . . . . .
 O3 O 0.36610(18) 0.19758(8) 0.4032(2) 0.0127(4) Uani 1 1 d D . . . .
 H3 H 0.299(2) 0.1830(11) 0.4293(15) 0.019 Uiso 1 1 calc DGR . . . .
 F3 F 0.54883(16) 0.50724(7) 0.6799(2) 0.0225(4) Uani 1 1 d . . . . .
 C3 C 0.5374(3) 0.44237(12) 0.6492(4) 0.0146(6) Uani 1 1 d . . . . .
 F9 F 0.42876(16) 0.32117(7) 0.9297(2) 0.0159(4) Uani 1 1 d . . . . .
 C9 C 0.4622(3) 0.05769(12) 0.3435(4) 0.0151(6) Uani 1 1 d . . . . .
 F8 F 0.64842(17) 0.30568(8) 0.61520(19) 0.0187(4) Uani 1 1 d . . . . .
 C8 C 0.3722(3) 0.09968(12) 0.2370(4) 0.0136(6) Uani 1 1 d . . . . .
 F7 F 0.67518(17) 0.30031(8) 0.8739(2) 0.0203(4) Uani 1 1 d . . . . .
 C7 C 0.3972(2) 0.17476(11) 0.2495(3) 0.0107(5) Uani 1 1 d . . . . .
 F10 F 0.45162(16) 0.24425(6) 0.7484(2) 0.0171(4) Uani 1 1 d . . . . .
 C10 C 0.6060(3) 0.07492(12) 0.3227(4) 0.0140(6) Uani 1 1 d . . . . .
 F20 F 0.56016(15) 0.25560(6) 0.2588(2) 0.0174(4) Uani 1 1 d . . . . .
 F19 F 0.57501(17) 0.18013(8) 0.0731(2) 0.0175(4) Uani 1 1 d . . . . .
 F18 F 0.61927(16) 0.16893(7) 0.4871(2) 0.0180(4) Uani 1 1 d . . . . .
 F17 F 0.75555(17) 0.16072(6) 0.2901(2) 0.0200(4) Uani 1 1 d . . . . .
 F16 F 0.67441(17) 0.04350(7) 0.4345(2) 0.0228(4) Uani 1 1 d . . . . .
 F15 F 0.64415(17) 0.05383(8) 0.1774(2) 0.0201(4) Uani 1 1 d . . . . .
 F14 F 0.42911(17) 0.06719(7) 0.4975(2) 0.0195(4) Uani 1 1 d . . . . .
 F13 F 0.44498(15) -0.00650(7) 0.3077(2) 0.0220(4) Uani 1 1 d . . . . .
 F12 F 0.24933(18) 0.08821(6) 0.2806(2) 0.0195(3) Uani 1 1 d . . . . .
 C12 C 0.5420(2) 0.19082(12) 0.2274(3) 0.0116(5) Uani 1 1 d . . . . .
 F11 F 0.38677(17) 0.08027(8) 0.0836(2) 0.0189(4) Uani 1 1 d . . . . .
 C11 C 0.6333(3) 0.14990(12) 0.3343(3) 0.0135(6) Uani 1 1 d . . . . .


_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
 F1 C2 1.353(3) . ?
 C1 O1 1.380(3) . ?
 C1 C2 1.549(3) . ?
 C1 O2 1.406(3) . ?
 C1 C6 1.552(4) . ?
 O1 H1 0.79(2) . ?
 F2 C2 1.344(3) . ?
 C2 C3 1.546(4) . ?
 O2 H2 0.80(2) . ?
 C6 C5 1.539(4) . ?
 C6 F9 1.347(3) . ?
 C6 F10 1.354(3) . ?
 F6 C4 1.348(3) . ?
 C5 C4 1.539(4) . ?
 C5 F8 1.340(3) . ?
 C5 F7 1.340(3) . ?
 F5 C4 1.341(4) . ?
 O4 H4 0.79(2) . ?
 O4 C7 1.387(3) . ?
 F4 C3 1.342(4) . ?
 C4 C3 1.545(4) . ?
 O3 H3 0.79(2) . ?
 O3 C7 1.401(3) . ?
 F3 C3 1.344(3) . ?
 C9 C8 1.544(4) . ?
 C9 C10 1.542(4) . ?
 C9 F14 1.344(3) . ?
 C9 F13 1.346(3) . ?
 C8 C7 1.547(3) . ?
 C8 F12 1.346(3) . ?
 C8 F11 1.347(3) . ?
 C7 C12 1.548(3) . ?
 C10 F16 1.334(3) . ?
 C10 F15 1.345(3) . ?
 C10 C11 1.548(4) . ?
 F20 C12 1.352(3) . ?
 F19 C12 1.349(3) . ?
 F18 C11 1.339(3) . ?
 F17 C11 1.339(3) . ?
 C12 C11 1.543(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
 O1 C1 C2 106.3(2) . . ?
 O1 C1 O2 108.8(2) . . ?
 O1 C1 C6 111.2(2) . . ?
 C2 C1 C6 110.7(2) . . ?
 O2 C1 C2 110.10(19) . . ?
 O2 C1 C6 109.5(2) . . ?
 C1 O1 H1 109.5 . . ?
 F1 C2 C1 108.1(2) . . ?
 F1 C2 C3 108.2(2) . . ?
 F2 C2 F1 108.09(19) . . ?
 F2 C2 C1 109.0(2) . . ?
 F2 C2 C3 108.7(2) . . ?
 C3 C2 C1 114.5(2) . . ?
 C1 O2 H2 109.5 . . ?
 C5 C6 C1 114.7(2) . . ?
 F9 C6 C1 108.9(2) . . ?
 F9 C6 C5 108.7(2) . . ?
 F9 C6 F10 108.0(2) . . ?
 F10 C6 C1 108.2(2) . . ?
 F10 C6 C5 108.3(2) . . ?
 C4 C5 C6 112.4(2) . . ?
 F8 C5 C6 108.8(2) . . ?
 F8 C5 C4 109.1(2) . . ?
 F8 C5 F7 108.7(2) . . ?
 F7 C5 C6 109.0(2) . . ?
 F7 C5 C4 108.8(2) . . ?
 C7 O4 H4 109.5 . . ?
 F6 C4 C5 108.9(2) . . ?
 F6 C4 C3 108.7(2) . . ?
 C5 C4 C3 113.1(2) . . ?
 F5 C4 F6 108.6(2) . . ?
 F5 C4 C5 108.8(2) . . ?
 F5 C4 C3 108.7(2) . . ?
 C7 O3 H3 109.5 . . ?
 F4 C3 C2 109.0(2) . . ?
 F4 C3 C4 109.1(2) . . ?
 F4 C3 F3 108.5(2) . . ?
 C4 C3 C2 112.4(2) . . ?
 F3 C3 C2 108.7(2) . . ?
 F3 C3 C4 109.0(2) . . ?
 C10 C9 C8 113.3(2) . . ?
 F14 C9 C8 108.4(2) . . ?
 F14 C9 C10 108.8(3) . . ?
 F14 C9 F13 108.4(2) . . ?
 F13 C9 C8 108.9(2) . . ?
 F13 C9 C10 108.8(2) . . ?
 C9 C8 C7 113.7(2) . . ?
 F12 C8 C9 108.8(2) . . ?
 F12 C8 C7 108.1(2) . . ?
 F12 C8 F11 108.2(2) . . ?
 F11 C8 C9 108.5(2) . . ?
 F11 C8 C7 109.4(2) . . ?
 O4 C7 O3 113.26(19) . . ?
 O4 C7 C8 106.7(2) . . ?
 O4 C7 C12 110.2(2) . . ?
 O3 C7 C8 110.3(2) . . ?
 O3 C7 C12 105.2(2) . . ?
 C8 C7 C12 111.20(19) . . ?
 C9 C10 C11 113.1(2) . . ?
 F16 C10 C9 109.2(2) . . ?
 F16 C10 F15 108.8(2) . . ?
 F16 C10 C11 109.1(2) . . ?
 F15 C10 C9 108.3(2) . . ?
 F15 C10 C11 108.3(2) . . ?
 F20 C12 C7 108.47(19) . . ?
 F20 C12 C11 108.9(2) . . ?
 F19 C12 C7 109.0(2) . . ?
 F19 C12 F20 107.8(2) . . ?
 F19 C12 C11 108.0(2) . . ?
 C11 C12 C7 114.5(2) . . ?
 F18 C11 C10 108.8(2) . . ?
 F18 C11 C12 109.1(2) . . ?
 F17 C11 C10 108.5(2) . . ?
 F17 C11 F18 108.6(2) . . ?
 F17 C11 C12 109.6(2) . . ?
 C12 C11 C10 112.2(2) . . ?

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
 F1 C2 C3 F4 -168.58(19) . . . . ?
 F1 C2 C3 C4 70.3(3) . . . . ?
 F1 C2 C3 F3 -50.4(3) . . . . ?
 C1 C2 C3 F4 70.8(3) . . . . ?
 C1 C2 C3 C4 -50.4(3) . . . . ?
 C1 C2 C3 F3 -171.1(2) . . . . ?
 C1 C6 C5 C4 51.1(3) . . . . ?
 C1 C6 C5 F8 -69.8(3) . . . . ?
 C1 C6 C5 F7 171.8(2) . . . . ?
 O1 C1 C2 F1 167.6(2) . . . . ?
 O1 C1 C2 F2 50.4(3) . . . . ?
 O1 C1 C2 C3 -71.7(3) . . . . ?
 O1 C1 C6 C5 68.3(3) . . . . ?
 O1 C1 C6 F9 -169.73(19) . . . . ?
 O1 C1 C6 F10 -52.7(3) . . . . ?
 F2 C2 C3 F4 -51.4(3) . . . . ?
 F2 C2 C3 C4 -172.5(2) . . . . ?
 F2 C2 C3 F3 66.7(3) . . . . ?
 C2 C1 C6 C5 -49.7(3) . . . . ?
 C2 C1 C6 F9 72.2(3) . . . . ?
 C2 C1 C6 F10 -170.7(2) . . . . ?
 O2 C1 C2 F1 49.9(3) . . . . ?
 O2 C1 C2 F2 -67.4(3) . . . . ?
 O2 C1 C2 C3 170.6(2) . . . . ?
 O2 C1 C6 C5 -171.3(2) . . . . ?
 O2 C1 C6 F9 -49.4(3) . . . . ?
 O2 C1 C6 F10 67.7(3) . . . . ?
 C6 C1 C2 F1 -71.4(3) . . . . ?
 C6 C1 C2 F2 171.3(2) . . . . ?
 C6 C1 C2 C3 49.3(3) . . . . ?
 C6 C5 C4 F6 -171.4(2) . . . . ?
 C6 C5 C4 F5 70.4(3) . . . . ?
 C6 C5 C4 C3 -50.5(3) . . . . ?
 F6 C4 C3 C2 171.2(2) . . . . ?
 F6 C4 C3 F4 50.1(3) . . . . ?
 F6 C4 C3 F3 -68.2(3) . . . . ?
 C5 C4 C3 C2 50.2(3) . . . . ?
 C5 C4 C3 F4 -70.9(3) . . . . ?
 C5 C4 C3 F3 170.8(2) . . . . ?
 F5 C4 C3 C2 -70.7(3) . . . . ?
 F5 C4 C3 F4 168.2(2) . . . . ?
 F5 C4 C3 F3 49.8(3) . . . . ?
 O4 C7 C12 F20 69.3(3) . . . . ?
 O4 C7 C12 F19 -47.8(3) . . . . ?
 O4 C7 C12 C11 -168.9(2) . . . . ?
 O3 C7 C12 F20 -53.2(2) . . . . ?
 O3 C7 C12 F19 -170.25(18) . . . . ?
 O3 C7 C12 C11 68.7(2) . . . . ?
 F9 C6 C5 C4 -71.0(3) . . . . ?
 F9 C6 C5 F8 168.11(18) . . . . ?
 F9 C6 C5 F7 49.7(2) . . . . ?
 C9 C8 C7 O4 170.3(2) . . . . ?
 C9 C8 C7 O3 -66.3(3) . . . . ?
 C9 C8 C7 C12 50.0(3) . . . . ?
 C9 C10 C11 F18 71.7(3) . . . . ?
 C9 C10 C11 F17 -170.4(2) . . . . ?
 C9 C10 C11 C12 -49.2(3) . . . . ?
 F8 C5 C4 F6 -50.7(3) . . . . ?
 F8 C5 C4 F5 -168.9(2) . . . . ?
 F8 C5 C4 C3 70.2(3) . . . . ?
 C8 C9 C10 F16 171.1(2) . . . . ?
 C8 C9 C10 F15 -70.6(3) . . . . ?
 C8 C9 C10 C11 49.5(3) . . . . ?
 C8 C7 C12 F20 -172.6(2) . . . . ?
 C8 C7 C12 F19 70.3(3) . . . . ?
 C8 C7 C12 C11 -50.8(3) . . . . ?
 F7 C5 C4 F6 67.8(3) . . . . ?
 F7 C5 C4 F5 -50.4(3) . . . . ?
 F7 C5 C4 C3 -171.3(2) . . . . ?
 C7 C12 C11 C10 50.7(3) . . . . ?
 C7 C12 C11 F18 -70.0(3) . . . . ?
 C7 C12 C11 F17 171.3(2) . . . . ?
 F10 C6 C5 C4 171.9(2) . . . . ?
 F10 C6 C5 F8 51.1(3) . . . . ?
 F10 C6 C5 F7 -67.3(3) . . . . ?
 C10 C9 C8 C7 -50.4(3) . . . . ?
 C10 C9 C8 F12 -170.9(2) . . . . ?
 C10 C9 C8 F11 71.6(3) . . . . ?
 F20 C12 C11 C10 172.3(2) . . . . ?
 F20 C12 C11 F18 51.6(3) . . . . ?
 F20 C12 C11 F17 -67.1(3) . . . . ?
 F19 C12 C11 C10 -70.9(3) . . . . ?
 F19 C12 C11 F18 168.4(2) . . . . ?
 F19 C12 C11 F17 49.6(3) . . . . ?
 F16 C10 C11 F18 -50.0(3) . . . . ?
 F16 C10 C11 F17 67.9(3) . . . . ?
 F16 C10 C11 C12 -170.9(2) . . . . ?
 F15 C10 C11 F18 -168.2(2) . . . . ?
 F15 C10 C11 F17 -50.3(3) . . . . ?
 F15 C10 C11 C12 70.9(3) . . . . ?
 F14 C9 C8 C7 70.6(3) . . . . ?
 F14 C9 C8 F12 -50.0(3) . . . . ?
 F14 C9 C8 F11 -167.5(2) . . . . ?
 F14 C9 C10 F16 50.4(3) . . . . ?
 F14 C9 C10 F15 168.69(19) . . . . ?
 F14 C9 C10 C11 -71.2(3) . . . . ?
 F13 C9 C8 C7 -171.6(2) . . . . ?
 F13 C9 C8 F12 67.8(3) . . . . ?
 F13 C9 C8 F11 -49.7(3) . . . . ?
 F13 C9 C10 F16 -67.6(3) . . . . ?
 F13 C9 C10 F15 50.7(3) . . . . ?
 F13 C9 C10 C11 170.8(2) . . . . ?
 F12 C8 C7 O4 -68.8(3) . . . . ?
 F12 C8 C7 O3 54.6(3) . . . . ?
 F12 C8 C7 C12 171.0(2) . . . . ?
 F11 C8 C7 O4 48.8(3) . . . . ?
 F11 C8 C7 O3 172.2(2) . . . . ?
 F11 C8 C7 C12 -71.4(3) . . . . ?

_olex2_diffrn_ambient_temperature_device  'Oxford Cryosystems 700'
_olex2_exptl_crystal_mounting_method 
 'The crystal was mounted on a MITIGEN holder in perfluoroether oil'
_olex2_submission_special_instructions  'No special instructions were received'
# start Validation Reply Form
_vrf_PLAT111_mol6
;
PROBLEM: ADDSYM Detects New (Pseudo) Centre of Symmetry .        100 %Fit  
RESPONSE: Pbca does not lead to a suitable model.
;
_vrf_PLAT112_mol6
;
PROBLEM: ADDSYM Detects New (Pseudo) Symm. Elem         b        100 %Fit  
RESPONSE: Pbca does not lead to a suitable model.
;
_vrf_PLAT113_mol6
;
PROBLEM: ADDSYM Suggests Possible Pseudo/New  Space Group       Pbca Check 
RESPONSE: Pbca does not lead to a suitable model.
;
