data_exp_1711
_audit_creation_date               2021-01-11
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number       '2016/6'
_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. (2008). Acta Cryst. A64, 112-122.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           'C25 H22 F N O2'
_chemical_formula_sum              'C25 H22 F N O2'
_chemical_formula_weight           387.43
_chemical_absolute_configuration   unk
_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' 0.0181 0.0091 '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' 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'N' 'N' 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'O' 'O' 0.0492 0.0322 '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        'monoclinic'
_space_group_IT_number             4
_space_group_name_H-M_alt          'P 1 21 1'
_space_group_name_Hall             'P 2yb'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'
 '-x, y+1/2, -z'

_cell_length_a                     9.74590(10)
_cell_length_b                     7.33210(10)
_cell_length_c                     13.62350(10)
_cell_angle_alpha                  90
_cell_angle_beta                   102.8440(10)
_cell_angle_gamma                  90
_cell_volume                       949.149(18)
_cell_formula_units_Z              2
_cell_measurement_reflns_used      16475
_cell_measurement_temperature      170.00(10)
_cell_measurement_theta_max        74.2160
_cell_measurement_theta_min        3.3200
_shelx_estimated_absorpt_T_max     ?
_shelx_estimated_absorpt_T_min     ?
_exptl_absorpt_coefficient_mu      0.746
_exptl_absorpt_correction_T_max    1.00000
_exptl_absorpt_correction_T_min    0.75092
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.39.32a (Rigaku Oxford Diffraction, 2017)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              'clear light blue'
_exptl_crystal_colour_lustre       clear
_exptl_crystal_colour_modifier     light
_exptl_crystal_colour_primary      blue
_exptl_crystal_density_diffrn      1.356
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         block
_exptl_crystal_F_000               408
_exptl_crystal_size_max            0.42
_exptl_crystal_size_mid            0.36
_exptl_crystal_size_min            0.28
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0449
_diffrn_reflns_av_unetI/netI       0.0253
_diffrn_reflns_Laue_measured_fraction_full  1.000
_diffrn_reflns_Laue_measured_fraction_max  0.995
_diffrn_reflns_limit_h_max         12
_diffrn_reflns_limit_h_min         -12
_diffrn_reflns_limit_k_max         9
_diffrn_reflns_limit_k_min         -9
_diffrn_reflns_limit_l_max         17
_diffrn_reflns_limit_l_min         -17
_diffrn_reflns_number              20278
_diffrn_reflns_point_group_measured_fraction_full  0.998
_diffrn_reflns_point_group_measured_fraction_max  0.985
_diffrn_reflns_theta_full          67.684
_diffrn_reflns_theta_max           74.361
_diffrn_reflns_theta_min           3.327
_diffrn_ambient_environment        N~2~
_diffrn_ambient_temperature        170.00(10)
_diffrn_detector                   'CCD plate'
_diffrn_detector_area_resol_mean   ?
_diffrn_measured_fraction_theta_full  1.000
_diffrn_measured_fraction_theta_max  0.995
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
--------------------------------------------------------------------------
  1  ω    -28.00  39.00   1.00    1.00    --    0.00  82.00  30.00   67
  2  ω     17.00  88.00   1.00    1.00    --    0.00  19.00-120.00   71
  3  ω    -36.00   7.00   1.00    1.00    --    0.00 -38.00-180.00   43
  4  ω    -55.00  23.00   1.00    1.00    --    0.00 -19.00 -90.00   78
  5  ω     50.00  89.00   1.00    1.00    --    0.00  77.00 -30.00   39
  6  ω    -19.00  35.00   1.00    1.00    --    0.00  38.00 150.00   54
  7  ω      3.00  38.00   1.00    1.00    --    0.00  77.00 -30.00   35
  8  ω    -29.00  -2.00   1.00    1.00    --    0.00  77.00 -30.00   27
  9  ω    -87.00 -56.00   1.00    1.00    --    0.00 -38.00  90.00   31
 10  ω    -14.00  19.00   1.00    1.00    --    0.00 -38.00  90.00   33
 11  ω    -24.00  10.00   1.00    1.00    --    0.00  19.00-120.00   34
 12  ω     76.00 106.00   1.00    1.00    --   95.80  45.00-150.00   30
 13  ω     67.00  93.00   1.00    1.00    --   95.80  75.00 -67.14   26
 14  ω     73.00 148.00   1.00    1.00    --   95.80  61.00 -30.00   75
 15  ω     65.00  95.00   1.00    1.00    --   95.80  77.00  90.00   30
 16  ω      6.00 127.00   1.00    1.00    --   95.80 -82.00  60.00  121
 17  ω    131.00 157.00   1.00    1.00    --   95.80  70.00 125.79   26
 18  ω     64.00  98.00   1.00    1.00    --   95.80  79.00  -9.59   34
 19  ω     65.00  91.00   1.00    1.00    --   95.80  82.00  90.00   26
 20  ω     63.00  88.00   1.00    1.00    --   95.80  82.00-180.00   25
 21  ω     63.00  89.00   1.00    1.00    --   95.80  82.00 150.00   26
 22  ω     66.00  92.00   1.00    1.00    --   95.80  77.00 -90.00   26
 23  ω    134.00 160.00   1.00    1.00    --   95.80  77.00 -90.00   26
 24  ω     63.00  89.00   1.00    1.00    --   95.80  82.00-150.00   26
 25  ω     54.00 106.00   1.00    1.00    --   95.80 -82.00-120.00   52
 26  ω     63.00  89.00   1.00    1.00    --   95.80  82.00-120.00   26
 27  ω     67.00  92.00   1.00    1.00    --   95.80  77.00  30.00   25
 28  ω     63.00  89.00   1.00    1.00    --   95.80  82.00 120.00   26
 29  ω     64.00 113.00   1.00    1.00    --   95.80 -82.00-180.00   49
 30  ω     64.00 105.00   1.00    1.00    --   95.80  82.00   0.00   41
 31  ω    126.00 185.00   1.00    1.00    --   95.80  82.00 -30.00   59
 32  ω     67.00 102.00   1.00    1.00    --   95.80  72.00  64.38   35
 33  ω     68.00  94.00   1.00    1.00    --   95.80  70.00 125.79   26
 34  ω      6.00 120.00   1.00    1.00    --   95.80 -61.00 -60.00  114
 35  ω     63.00  88.00   1.00    1.00    --   95.80  82.00 -30.00   25
 36  ω     75.00 100.00   1.00    1.00    --   95.80  45.00 -90.00   25
 37  ω     65.00 114.00   1.00    1.00    --   95.80  77.00 -30.00   49
 38  ω     78.00 127.00   1.00    1.00    --   95.80  45.00  60.00   49
 39  ω     73.00 101.00   1.00    1.00    --   95.80  54.00-124.20   28
 40  ω     66.00  91.00   1.00    1.00    --   95.80  77.00 -60.00   25
 41  ω    160.00 185.00   1.00    1.00    --   95.80  61.00 -60.00   25
 42  ω    121.00 185.00   1.00    1.00    --   95.80  82.00  30.00   64
 43  ω     73.00  99.00   1.00    1.00    --   95.80  61.00 -60.00   26
 44  ω     63.00  88.00   1.00    1.00    --   95.80  82.00  60.00   25
 45  ω     94.00 120.00   1.00    1.00    --   95.80  82.00  90.00   26
 46  ω     82.00 117.00   1.00    1.00    --   95.80  30.00-120.00   35
 47  ω     77.00 148.00   1.00    1.00    --   95.80  30.00 -60.00   71
 48  ω     76.00 176.00   1.00    1.00    --   95.80  45.00 150.00  100
 49  ω      9.00 120.00   1.00    1.00    --   95.80 -61.00  60.00  111
 50  ω     65.00  90.00   1.00    1.00    --   95.80  77.00 150.00   25
 51  ω     63.00  88.00   1.00    1.00    --   95.80  82.00  30.00   25
 52  ω     69.00 133.00   1.00    1.00    --   95.80  65.00  95.35   64
 53  ω    127.00 176.00   1.00    1.00    --   95.80  79.00  -9.59   49
 54  ω    127.00 152.00   1.00    1.00    --   95.80  67.00-107.32   25
 55  ω     80.00 105.00   1.00    1.00    --   95.80  30.00  60.00   25
 56  ω    123.00 179.00   1.00    1.00    --   95.80  30.00  60.00   56
 57  ω     75.00 166.00   1.00    1.00    --   95.80  45.00-180.00   91
 58  ω     75.00 178.00   1.00    1.00    --   95.80  45.00 -60.00  103
 59  ω     25.00 115.00   1.00    1.00    --   95.80 -82.00 -60.00   90
 60  ω     69.00  95.00   1.00    1.00    --   95.80  67.00-107.32   26
;
_diffrn_measurement_device         'four-circle diffractometer'
_diffrn_measurement_device_type    'XtaLAB AFC12 (RINC): Kappa dual home/near'
_diffrn_measurement_method         'ω scans'
_diffrn_orient_matrix_type        
 'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11        0.0566646000
_diffrn_orient_matrix_UB_12        0.0452550000
_diffrn_orient_matrix_UB_13        0.1121063000
_diffrn_orient_matrix_UB_21        0.1375250000
_diffrn_orient_matrix_UB_22        -0.1019843000
_diffrn_orient_matrix_UB_23        -0.0019218000
_diffrn_orient_matrix_UB_31        0.0644359000
_diffrn_orient_matrix_UB_32        0.1780870000
_diffrn_orient_matrix_UB_33        -0.0296635000
_diffrn_radiation_monochromator    graphite
_diffrn_radiation_probe            x-ray
_diffrn_radiation_type             CuK\a
_diffrn_radiation_wavelength       1.54184
_diffrn_source                     'fine-focus sealed X-ray tube'
_diffrn_source_type                'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage           0.830
_reflns_Friedel_fraction_full      0.996
_reflns_Friedel_fraction_max       0.973
_reflns_number_gt                  3774
_reflns_number_total               3804
_reflns_odcompleteness_completeness  100.00
_reflns_odcompleteness_iscentric   1
_reflns_odcompleteness_theta       66.97
_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         'CrysAlisPro 1.171.39.32a (Rigaku OD, 2017)'
_computing_data_collection         'CrysAlisPro 1.171.39.32a (Rigaku OD, 2017)'
_computing_data_reduction          'CrysAlisPro 1.171.39.32a (Rigaku OD, 2017)'
_computing_molecular_graphics      'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement    'XL (Sheldrick, 2008)'
_computing_structure_solution      'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max           0.173
_refine_diff_density_min           -0.110
_refine_diff_density_rms           0.030
_refine_ls_abs_structure_details
;
 Flack x determined using 1693 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack     -0.01(5)
_refine_ls_extinction_coef         0.0257(16)
_refine_ls_extinction_expression  
 'Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^'
_refine_ls_extinction_method       'SHELXL-2016/6 (Sheldrick 2016)'
_refine_ls_goodness_of_fit_ref     1.041
_refine_ls_hydrogen_treatment      constr
_refine_ls_matrix_type             full
_refine_ls_number_parameters       265
_refine_ls_number_reflns           3804
_refine_ls_number_restraints       1
_refine_ls_R_factor_all            0.0266
_refine_ls_R_factor_gt             0.0265
_refine_ls_restrained_S_all        1.041
_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)+(0.0401P)²+0.1214P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.0703
_refine_ls_wR_factor_ref           0.0704
_refine_special_details            ?
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C9(H9)
2.b Secondary CH2 refined with riding coordinates:
 C16(H16A,H16B)
2.c Aromatic/amide H refined with riding coordinates:
 C22(H22), C8(H8), C18(H18), C15(H15), C11(H11), C21(H21), C5(H5), C12(H12),
 C14(H14), C13(H13), C20(H20), C2(H2), C19(H19)
2.d Idealised Me refined as rotating group:
 C24(H24A,H24B,H24C), C25(H25A,H25B,H25C)
;
_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 0.05167(14) 0.01298(16) 0.89929(9) 0.0434(3) Uani 1 1 d . . . . .
 O2 O -0.01303(12) 0.92616(18) 0.60771(9) 0.0301(3) Uani 1 1 d . . . . .
 O1 O -0.13169(13) 0.82184(19) 0.71879(10) 0.0351(3) Uani 1 1 d . . . . .
 N1 N 0.30370(14) 0.4206(2) 0.73236(11) 0.0268(3) Uani 1 1 d . . . . .
 C23 C -0.03136(16) 0.8123(2) 0.68118(11) 0.0235(3) Uani 1 1 d . . . . .
 C10 C 0.44019(16) 0.6974(2) 0.80486(11) 0.0211(3) Uani 1 1 d . . . . .
 C6 C 0.07606(16) 0.5091(2) 0.76327(12) 0.0219(3) Uani 1 1 d . . . . .
 C22 C 0.26583(17) 0.1636(2) 0.57028(12) 0.0246(3) Uani 1 1 d . . . . .
 H22 H 0.193818 0.243216 0.576212 0.030 Uiso 1 1 calc R . . . .
 C8 C 0.20976(16) 0.7223(2) 0.68330(11) 0.0221(3) Uani 1 1 d . . . . .
 H8 H 0.213199 0.826063 0.644664 0.027 Uiso 1 1 calc R . . . .
 C18 C 0.49712(17) 0.0424(2) 0.63281(13) 0.0269(3) Uani 1 1 d . . . . .
 H18 H 0.580620 0.039295 0.681661 0.032 Uiso 1 1 calc R . . . .
 C1 C 0.18642(17) 0.3797(2) 0.77012(12) 0.0230(3) Uani 1 1 d . . . . .
 C15 C 0.58437(17) 0.7069(2) 0.80837(12) 0.0256(3) Uani 1 1 d . . . . .
 H15 H 0.619631 0.657209 0.756181 0.031 Uiso 1 1 calc R . . . .
 C17 C 0.39033(16) 0.1622(2) 0.64358(12) 0.0224(3) Uani 1 1 d . . . . .
 C11 C 0.38971(17) 0.7733(2) 0.88407(12) 0.0239(3) Uani 1 1 d . . . . .
 H11 H 0.294191 0.766944 0.883367 0.029 Uiso 1 1 calc R . . . .
 C7 C 0.08832(16) 0.6799(2) 0.70843(11) 0.0221(3) Uani 1 1 d . . . . .
 C21 C 0.24832(18) 0.0465(3) 0.48800(13) 0.0292(4) Uani 1 1 d . . . . .
 H21 H 0.163841 0.046455 0.440101 0.035 Uiso 1 1 calc R . . . .
 C5 C -0.03778(18) 0.4658(2) 0.80574(13) 0.0271(4) Uani 1 1 d . . . . .
 H5 H -0.108978 0.551668 0.801996 0.033 Uiso 1 1 calc R . . . .
 C16 C 0.41467(17) 0.2875(2) 0.73467(14) 0.0287(4) Uani 1 1 d . . . . .
 H16A H 0.423739 0.213640 0.794843 0.034 Uiso 1 1 calc R . . . .
 H16B H 0.502934 0.351628 0.739287 0.034 Uiso 1 1 calc R . . . .
 C12 C 0.48068(18) 0.8581(2) 0.96366(13) 0.0289(4) Uani 1 1 d . . . . .
 H12 H 0.445921 0.909508 1.015637 0.035 Uiso 1 1 calc R . . . .
 C14 C 0.67556(17) 0.7895(2) 0.88881(13) 0.0289(4) Uani 1 1 d . . . . .
 H14 H 0.771543 0.793305 0.890884 0.035 Uiso 1 1 calc R . . . .
 C9 C 0.34005(16) 0.6096(2) 0.71484(12) 0.0225(3) Uani 1 1 d . . . . .
 H9 H 0.387839 0.609055 0.658688 0.027 Uiso 1 1 calc R . . . .
 C3 C 0.0573(2) 0.1777(2) 0.85394(13) 0.0303(4) Uani 1 1 d . . . . .
 C13 C 0.62362(18) 0.8663(2) 0.96588(13) 0.0294(4) Uani 1 1 d . . . . .
 H13 H 0.684513 0.923488 1.019258 0.035 Uiso 1 1 calc R . . . .
 C20 C 0.3554(2) -0.0697(3) 0.47695(14) 0.0330(4) Uani 1 1 d . . . . .
 H20 H 0.344152 -0.145689 0.421070 0.040 Uiso 1 1 calc R . . . .
 C2 C 0.17201(19) 0.2099(2) 0.81333(13) 0.0284(4) Uani 1 1 d . . . . .
 H2 H 0.239418 0.119653 0.814579 0.034 Uiso 1 1 calc R . . . .
 C19 C 0.48007(19) -0.0721(3) 0.55001(14) 0.0330(4) Uani 1 1 d . . . . .
 H19 H 0.552321 -0.150711 0.543353 0.040 Uiso 1 1 calc R . . . .
 C24 C -0.11309(19) 1.0729(3) 0.58418(14) 0.0336(4) Uani 1 1 d . . . . .
 H24A H -0.090020 1.147753 0.532336 0.050 Uiso 1 1 calc GR . . . .
 H24B H -0.110088 1.145227 0.643353 0.050 Uiso 1 1 calc GR . . . .
 H24C H -0.205906 1.023471 0.561175 0.050 Uiso 1 1 calc GR . . . .
 C4 C -0.04998(19) 0.3008(3) 0.85332(13) 0.0305(4) Uani 1 1 d . . . . .
 C25 C -0.1723(2) 0.2578(3) 0.90046(17) 0.0439(5) Uani 1 1 d . . . . .
 H25A H -0.228506 0.365320 0.900401 0.066 Uiso 1 1 calc GR . . . .
 H25B H -0.137539 0.217343 0.968470 0.066 Uiso 1 1 calc GR . . . .
 H25C H -0.228619 0.163406 0.862535 0.066 Uiso 1 1 calc GR . . . .


_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 C3 1.363(2) . ?
 O2 C23 1.345(2) . ?
 O2 C24 1.439(2) . ?
 O1 C23 1.203(2) . ?
 N1 C1 1.387(2) . ?
 N1 C16 1.452(2) . ?
 N1 C9 1.463(2) . ?
 C23 C7 1.499(2) . ?
 C10 C15 1.397(2) . ?
 C10 C11 1.397(2) . ?
 C10 C9 1.530(2) . ?
 C6 C1 1.422(2) . ?
 C6 C7 1.476(2) . ?
 C6 C5 1.397(2) . ?
 C22 H22 0.9300 . ?
 C22 C17 1.390(2) . ?
 C22 C21 1.392(2) . ?
 C8 H8 0.9300 . ?
 C8 C7 1.340(2) . ?
 C8 C9 1.496(2) . ?
 C18 H18 0.9300 . ?
 C18 C17 1.395(2) . ?
 C18 C19 1.386(3) . ?
 C1 C2 1.397(2) . ?
 C15 H15 0.9300 . ?
 C15 C14 1.387(2) . ?
 C17 C16 1.520(2) . ?
 C11 H11 0.9300 . ?
 C11 C12 1.386(2) . ?
 C21 H21 0.9300 . ?
 C21 C20 1.381(3) . ?
 C5 H5 0.9300 . ?
 C5 C4 1.390(3) . ?
 C16 H16A 0.9700 . ?
 C16 H16B 0.9700 . ?
 C12 H12 0.9300 . ?
 C12 C13 1.388(2) . ?
 C14 H14 0.9300 . ?
 C14 C13 1.383(3) . ?
 C9 H9 0.9800 . ?
 C3 C2 1.374(3) . ?
 C3 C4 1.380(3) . ?
 C13 H13 0.9300 . ?
 C20 H20 0.9300 . ?
 C20 C19 1.389(3) . ?
 C2 H2 0.9300 . ?
 C19 H19 0.9300 . ?
 C24 H24A 0.9600 . ?
 C24 H24B 0.9600 . ?
 C24 H24C 0.9600 . ?
 C4 C25 1.507(3) . ?
 C25 H25A 0.9600 . ?
 C25 H25B 0.9600 . ?
 C25 H25C 0.9600 . ?

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
 C23 O2 C24 115.72(13) . . ?
 C1 N1 C16 121.20(15) . . ?
 C1 N1 C9 121.00(13) . . ?
 C16 N1 C9 115.72(13) . . ?
 O2 C23 C7 111.19(13) . . ?
 O1 C23 O2 122.39(15) . . ?
 O1 C23 C7 126.41(15) . . ?
 C15 C10 C11 118.56(14) . . ?
 C15 C10 C9 120.39(14) . . ?
 C11 C10 C9 121.03(14) . . ?
 C1 C6 C7 117.00(14) . . ?
 C5 C6 C1 118.67(15) . . ?
 C5 C6 C7 124.30(15) . . ?
 C17 C22 H22 119.8 . . ?
 C17 C22 C21 120.35(15) . . ?
 C21 C22 H22 119.8 . . ?
 C7 C8 H8 118.7 . . ?
 C7 C8 C9 122.68(15) . . ?
 C9 C8 H8 118.7 . . ?
 C17 C18 H18 119.7 . . ?
 C19 C18 H18 119.7 . . ?
 C19 C18 C17 120.66(16) . . ?
 N1 C1 C6 120.35(15) . . ?
 N1 C1 C2 121.15(15) . . ?
 C2 C1 C6 118.48(15) . . ?
 C10 C15 H15 119.6 . . ?
 C14 C15 C10 120.76(15) . . ?
 C14 C15 H15 119.6 . . ?
 C22 C17 C18 118.81(15) . . ?
 C22 C17 C16 122.37(14) . . ?
 C18 C17 C16 118.82(14) . . ?
 C10 C11 H11 119.7 . . ?
 C12 C11 C10 120.60(15) . . ?
 C12 C11 H11 119.7 . . ?
 C6 C7 C23 121.90(14) . . ?
 C8 C7 C23 117.97(15) . . ?
 C8 C7 C6 120.12(15) . . ?
 C22 C21 H21 119.7 . . ?
 C20 C21 C22 120.53(16) . . ?
 C20 C21 H21 119.7 . . ?
 C6 C5 H5 118.3 . . ?
 C4 C5 C6 123.31(16) . . ?
 C4 C5 H5 118.3 . . ?
 N1 C16 C17 114.10(14) . . ?
 N1 C16 H16A 108.7 . . ?
 N1 C16 H16B 108.7 . . ?
 C17 C16 H16A 108.7 . . ?
 C17 C16 H16B 108.7 . . ?
 H16A C16 H16B 107.6 . . ?
 C11 C12 H12 120.0 . . ?
 C11 C12 C13 120.06(16) . . ?
 C13 C12 H12 120.0 . . ?
 C15 C14 H14 120.0 . . ?
 C13 C14 C15 119.95(15) . . ?
 C13 C14 H14 120.0 . . ?
 N1 C9 C10 113.74(13) . . ?
 N1 C9 C8 110.44(13) . . ?
 N1 C9 H9 107.4 . . ?
 C10 C9 H9 107.4 . . ?
 C8 C9 C10 110.31(13) . . ?
 C8 C9 H9 107.4 . . ?
 F1 C3 C2 116.94(17) . . ?
 F1 C3 C4 118.42(16) . . ?
 C2 C3 C4 124.63(16) . . ?
 C12 C13 H13 120.0 . . ?
 C14 C13 C12 120.06(16) . . ?
 C14 C13 H13 120.0 . . ?
 C21 C20 H20 120.3 . . ?
 C21 C20 C19 119.43(16) . . ?
 C19 C20 H20 120.3 . . ?
 C1 C2 H2 120.3 . . ?
 C3 C2 C1 119.33(16) . . ?
 C3 C2 H2 120.3 . . ?
 C18 C19 C20 120.20(17) . . ?
 C18 C19 H19 119.9 . . ?
 C20 C19 H19 119.9 . . ?
 O2 C24 H24A 109.5 . . ?
 O2 C24 H24B 109.5 . . ?
 O2 C24 H24C 109.5 . . ?
 H24A C24 H24B 109.5 . . ?
 H24A C24 H24C 109.5 . . ?
 H24B C24 H24C 109.5 . . ?
 C5 C4 C25 122.57(18) . . ?
 C3 C4 C5 115.41(16) . . ?
 C3 C4 C25 122.02(18) . . ?
 C4 C25 H25A 109.5 . . ?
 C4 C25 H25B 109.5 . . ?
 C4 C25 H25C 109.5 . . ?
 H25A C25 H25B 109.5 . . ?
 H25A C25 H25C 109.5 . . ?
 H25B C25 H25C 109.5 . . ?

_olex2_submission_special_instructions  'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max  1.702
_oxdiff_exptl_absorpt_empirical_full_min  0.519
