# Supplementary Information (SI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2025

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_oyt_qj_1226
_audit_block_doi                 10.25505/fiz.icsd.cc2mj37j
_database_code_depnum_ccdc_archive 'CCDC 2428547'
loop_
_audit_author_name
_audit_author_address
'Tao Ouyang'
;Fuzhou University
China
;
_audit_update_record             
;
2025-03-03 deposited with the CCDC.	2025-04-30 downloaded from the CCDC.
;
_audit_creation_date             2024-12-26
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '2(F O3 P), F2 O2 P, Ba, Sr, K'
_chemical_formula_sum            'Ba F4 K O8 P3 Sr'
_chemical_formula_weight         560.97
_chemical_melting_point          ?
_chemical_oxdiff_formula         'K Ba P O H F'
_chemical_oxdiff_usercomment     'K Ba P O H F'
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ba Ba -0.3244 2.2819 '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'
Sr Sr -1.5307 3.2498 '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           14
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_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'

_cell_length_a                   7.06380(10)
_cell_length_b                   7.43060(10)
_cell_length_c                   21.3633(3)
_cell_angle_alpha                90
_cell_angle_beta                 93.3860(10)
_cell_angle_gamma                90
_cell_volume                     1119.37(3)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    29631
_cell_measurement_temperature    100.00(10)
_cell_measurement_theta_max      30.5380
_cell_measurement_theta_min      1.9850
_shelx_estimated_absorpt_T_max   0.407
_shelx_estimated_absorpt_T_min   0.341
_exptl_absorpt_coefficient_mu    9.147
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.67839
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.43.101a (Rigaku Oxford Diffraction, 2023)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    3.329
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1032
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.12
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0396
_diffrn_reflns_av_unetI/netI     0.0178
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.910
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            47769
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.910
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         30.751
_diffrn_reflns_theta_min         1.910
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100.00(10)
_diffrn_detector                 'Hybrid Pixel Array Detector'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_detector_type            HyPix
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.910
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -23.00  27.00   0.50    0.17    --   -5.49 -97.00 -89.00  100
  2  ω    -38.00  26.00   0.50    0.17    --   -5.49  97.00  18.00  128
  3  ω    -23.00  39.00   0.50    0.17    --    6.35 -97.00 -89.00  124
  4  ω    -26.00  26.00   0.50    0.17    --    6.35  97.00  18.00  104
  5  ω    -18.00  28.00   0.50    0.17    --   -5.49 -99.00  60.00   92
  6  ω    -69.00  22.00   0.50    0.17    --    6.35 -28.00-122.99  182
  7  ω    -67.00  21.00   0.50    0.17    --    6.35 -38.00 -60.00  176
  8  ω    -69.00  22.00   0.50    0.17    --    6.35 -34.00 -23.94  182
  9  ω    -69.00  22.00   0.50    0.17    --    6.35 -34.00 -23.94  182
 10  ω    -67.00  21.00   0.50    0.17    --    6.35 -38.00 -60.00  176
 11  ω    -69.00  22.00   0.50    0.17    --    6.35 -19.00  60.00  182
 12  ω    -67.00  21.00   0.50    0.17    --    6.35 -38.00  30.00  176
 13  ω    -68.00  21.00   0.50    0.17    --    6.35 -35.00-163.04  178
 14  ω    -68.00  22.00   0.50    0.17    --    6.35 -30.00 146.62  180
 15  ω    -67.00  21.00   0.50    0.17    --    6.35 -38.00 120.00  176
 16  ω    -18.00  28.00   0.50    0.17    --   -5.49 -99.00 -30.00   92
 17  ω    -18.00  28.00   0.50    0.17    --   -5.49 -99.00 120.00   92
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy R, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0141370000
_diffrn_orient_matrix_UB_12      -0.0592217000
_diffrn_orient_matrix_UB_13      -0.0253471000
_diffrn_orient_matrix_UB_21      0.0729729000
_diffrn_orient_matrix_UB_22      -0.0444990000
_diffrn_orient_matrix_UB_23      0.0182543000
_diffrn_orient_matrix_UB_31      -0.0677739000
_diffrn_orient_matrix_UB_32      -0.0602175000
_diffrn_orient_matrix_UB_33      0.0114202000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'Mova (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                2992
_reflns_number_total             3179
_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 1.171.43.101a (Rigaku OD, 2023)'
_computing_data_collection       
'CrysAlisPro system (CCD 43.101a 64-bit (release 13-12-2023))'
_computing_data_reduction        'CrysAlisPro 1.171.43.101a (Rigaku OD, 2023)'
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    ?
_refine_diff_density_max         0.892
_refine_diff_density_min         -0.964
_refine_diff_density_rms         0.169
_refine_ls_extinction_coef       0.00055(10)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.053
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     164
_refine_ls_number_reflns         3179
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0260
_refine_ls_R_factor_gt           0.0236
_refine_ls_restrained_S_all      1.053
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0211P)²+7.0914P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0564
_refine_ls_wR_factor_ref         0.0575
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   .
_atom_sites_solution_primary     ?
_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
Ba1 Ba 1.05073(2) 0.81182(2) 0.41712(2) 0.00590(6) Uani 1 1 d . . . . .
K1 K 0.65380(10) 0.68803(9) 0.58385(3) 0.00932(13) Uani 1 1 d . . . . .
P2 P 0.55156(11) 0.81482(11) 0.41306(4) 0.00546(15) Uani 1 1 d . . . . .
P3 P 0.86358(11) 1.31063(10) 0.42086(4) 0.00530(15) Uani 1 1 d . . . . .
F2 F 0.4253(3) 0.9486(3) 0.44804(10) 0.0178(4) Uani 1 1 d . . . . .
F3 F 0.9711(3) 1.1541(3) 0.45033(11) 0.0197(5) Uani 1 1 d . . . . .
F4 F 0.9813(3) 1.4580(3) 0.39451(11) 0.0189(4) Uani 1 1 d . . . . .
O4 O 0.6919(3) 0.7219(3) 0.45936(11) 0.0082(4) Uani 1 1 d . . . . .
O5 O 0.4123(3) 0.6765(3) 0.38061(10) 0.0077(4) Uani 1 1 d . . . . .
O6 O 0.6611(3) 0.9132(3) 0.36366(11) 0.0090(4) Uani 1 1 d . . . . .
O7 O 0.7374(3) 1.3907(3) 0.47317(11) 0.0092(4) Uani 1 1 d . . . . .
O8 O 0.7209(3) 1.2428(3) 0.36611(11) 0.0094(4) Uani 1 1 d . . . . .
Sr1 Sr 0.60614(4) -0.07916(4) 0.23606(2) 0.00836(8) Uani 1 1 d . . . . .
P1 P 0.40666(11) 0.41710(11) 0.24488(4) 0.00718(15) Uani 1 1 d . . . . .
F1 F 0.5274(3) 0.2769(3) 0.21563(11) 0.0234(5) Uani 1 1 d . . . . .
O1 O 0.2902(4) 0.5153(3) 0.18917(12) 0.0164(5) Uani 1 1 d . . . . .
O2 O 0.5319(3) 0.5653(3) 0.27822(11) 0.0088(4) Uani 1 1 d . . . . .
O3 O 0.2685(3) 0.3423(3) 0.29026(11) 0.0104(4) 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
Ba1 P2 3.5220(8) . ?
Ba1 P2 3.5440(8) 1_655 ?
Ba1 F2 2.875(2) 1_655 ?
Ba1 F3 2.708(2) . ?
Ba1 F3 2.856(2) 3_776 ?
Ba1 F4 2.713(2) 1_545 ?
Ba1 O4 2.821(2) . ?
Ba1 O5 2.894(2) 1_655 ?
Ba1 O6 3.013(2) . ?
Ba1 O7 3.096(2) 3_776 ?
Ba1 F1 2.869(2) 2_655 ?
Ba1 O1 3.001(3) 2_655 ?
K1 P3 3.4166(10) 3_776 ?
K1 P3 3.6501(10) 3_676 ?
K1 F2 2.832(2) 3_676 ?
K1 F3 3.026(2) 3_776 ?
K1 F4 2.810(2) 3_776 ?
K1 O4 2.700(2) . ?
K1 O5 2.859(2) 3_666 ?
K1 O7 3.011(2) 3_676 ?
K1 O7 3.315(2) 1_545 ?
K1 O8 2.958(2) 3_676 ?
K1 O1 3.255(3) 4_676 ?
K1 O3 2.722(2) 3_666 ?
P2 F2 1.556(2) . ?
P2 O4 1.524(2) . ?
P2 O5 1.557(2) . ?
P2 O6 1.531(2) . ?
P3 F3 1.507(2) . ?
P3 F4 1.504(2) . ?
P3 O7 1.586(2) . ?
P3 O8 1.581(2) . ?
P3 Sr1 3.4698(8) 2_665 ?
F4 Sr1 2.835(2) 2_665 ?
O6 Sr1 2.731(2) 1_565 ?
O8 Sr1 2.885(2) 2_665 ?
Sr1 Sr1 4.2598(3) 2_655 ?
Sr1 P1 3.6691(9) 2_545 ?
Sr1 P1 3.4416(9) 2_645 ?
Sr1 F1 2.733(3) . ?
Sr1 F1 2.932(2) 2_645 ?
Sr1 O2 2.850(2) 1_545 ?
Sr1 O2 2.806(2) 2_645 ?
Sr1 O3 2.736(2) 2_545 ?
P1 F1 1.505(2) . ?
P1 O1 1.584(3) . ?
P1 O2 1.558(2) . ?
P1 O3 1.521(2) . ?

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
P2 Ba1 P2 177.10(3) . 1_655 ?
F2 Ba1 P2 25.42(4) 1_655 1_655 ?
F2 Ba1 P2 155.50(5) 1_655 . ?
F2 Ba1 O5 50.94(6) 1_655 1_655 ?
F2 Ba1 O6 143.76(6) 1_655 . ?
F2 Ba1 O7 66.46(6) 1_655 3_776 ?
F2 Ba1 O1 67.37(7) 1_655 2_655 ?
F3 Ba1 P2 97.83(5) 3_776 1_655 ?
F3 Ba1 P2 102.92(5) . 1_655 ?
F3 Ba1 P2 84.91(5) 3_776 . ?
F3 Ba1 P2 77.14(5) . . ?
F3 Ba1 F2 81.01(6) 3_776 1_655 ?
F3 Ba1 F2 79.07(7) . 1_655 ?
F3 Ba1 F3 68.46(8) . 3_776 ?
F3 Ba1 F4 156.73(7) . 1_545 ?
F3 Ba1 O4 86.23(7) . . ?
F3 Ba1 O5 113.46(6) 3_776 1_655 ?
F3 Ba1 O5 126.65(7) . 1_655 ?
F3 Ba1 O6 70.44(7) . . ?
F3 Ba1 O6 104.60(6) 3_776 . ?
F3 Ba1 O7 110.90(6) . 3_776 ?
F3 Ba1 O7 49.04(6) 3_776 3_776 ?
F3 Ba1 F1 165.84(7) 3_776 2_655 ?
F3 Ba1 F1 108.24(7) . 2_655 ?
F3 Ba1 O1 79.51(7) . 2_655 ?
F3 Ba1 O1 138.60(7) 3_776 2_655 ?
F4 Ba1 P2 99.90(5) 1_545 1_655 ?
F4 Ba1 P2 80.30(5) 1_545 . ?
F4 Ba1 F2 122.54(7) 1_545 1_655 ?
F4 Ba1 F3 104.05(7) 1_545 3_776 ?
F4 Ba1 O4 70.78(7) 1_545 . ?
F4 Ba1 O5 76.61(6) 1_545 1_655 ?
F4 Ba1 O6 91.34(7) 1_545 . ?
F4 Ba1 O7 74.81(6) 1_545 3_776 ?
F4 Ba1 F1 73.39(7) 1_545 2_655 ?
F4 Ba1 O1 115.17(7) 1_545 2_655 ?
O4 Ba1 P2 157.90(5) . 1_655 ?
O4 Ba1 P2 24.79(5) . . ?
O4 Ba1 F2 147.41(6) . 1_655 ?
O4 Ba1 F3 66.53(7) . 3_776 ?
O4 Ba1 O5 145.88(6) . 1_655 ?
O4 Ba1 O6 50.39(6) . . ?
O4 Ba1 O7 92.64(6) . 3_776 ?
O4 Ba1 F1 99.84(7) . 2_655 ?
O4 Ba1 O1 138.17(7) . 2_655 ?
O5 Ba1 P2 153.33(5) 1_655 . ?
O5 Ba1 P2 25.52(5) 1_655 1_655 ?
O5 Ba1 O6 141.78(6) 1_655 . ?
O5 Ba1 O7 68.92(6) 1_655 3_776 ?
O5 Ba1 O1 66.13(7) 1_655 2_655 ?
O6 Ba1 P2 151.65(5) . 1_655 ?
O6 Ba1 P2 25.60(4) . . ?
O6 Ba1 O7 143.00(6) . 3_776 ?
O7 Ba1 P2 117.41(4) 3_776 . ?
O7 Ba1 P2 65.35(4) 3_776 1_655 ?
F1 Ba1 P2 96.33(5) 2_655 1_655 ?
F1 Ba1 P2 80.94(5) 2_655 . ?
F1 Ba1 F2 112.32(7) 2_655 1_655 ?
F1 Ba1 O5 79.83(7) 2_655 1_655 ?
F1 Ba1 O6 61.96(6) 2_655 . ?
F1 Ba1 O7 139.52(7) 2_655 3_776 ?
F1 Ba1 O1 49.92(7) 2_655 2_655 ?
O1 Ba1 P2 113.40(5) 2_655 . ?
O1 Ba1 P2 63.86(5) 2_655 1_655 ?
O1 Ba1 O6 87.80(7) 2_655 . ?
O1 Ba1 O7 129.19(7) 2_655 3_776 ?
P3 K1 P3 176.72(3) 3_776 3_676 ?
F2 K1 P3 99.97(5) 3_676 3_776 ?
F2 K1 P3 78.92(5) 3_676 3_676 ?
F2 K1 F3 74.66(6) 3_676 3_776 ?
F2 K1 O5 159.09(7) 3_676 3_666 ?
F2 K1 O7 85.67(7) 3_676 3_676 ?
F2 K1 O7 120.32(6) 3_676 1_545 ?
F2 K1 O8 75.71(7) 3_676 3_676 ?
F2 K1 O1 64.33(6) 3_676 4_676 ?
F3 K1 P3 26.15(4) 3_776 3_776 ?
F3 K1 P3 151.85(5) 3_776 3_676 ?
F3 K1 O7 83.73(6) 3_776 1_545 ?
F3 K1 O1 71.13(7) 3_776 4_676 ?
F4 K1 P3 155.91(5) 3_776 3_676 ?
F4 K1 P3 25.66(5) 3_776 3_776 ?
F4 K1 F2 125.01(7) 3_776 3_676 ?
F4 K1 F3 51.80(6) 3_776 3_776 ?
F4 K1 O5 75.70(7) 3_776 3_666 ?
F4 K1 O7 70.10(6) 3_776 1_545 ?
F4 K1 O7 143.40(7) 3_776 3_676 ?
F4 K1 O8 147.10(7) 3_776 3_676 ?
F4 K1 O1 85.21(7) 3_776 4_676 ?
O4 K1 P3 97.49(5) . 3_676 ?
O4 K1 P3 79.23(5) . 3_776 ?
O4 K1 F2 72.78(7) . 3_676 ?
O4 K1 F3 65.59(7) . 3_776 ?
O4 K1 F4 93.11(7) . 3_776 ?
O4 K1 O5 112.15(7) . 3_666 ?
O4 K1 O7 47.72(6) . 1_545 ?
O4 K1 O7 76.23(7) . 3_676 ?
O4 K1 O8 118.88(7) . 3_676 ?
O4 K1 O1 125.10(7) . 4_676 ?
O4 K1 O3 162.67(7) . 3_666 ?
O5 K1 P3 80.27(5) 3_666 3_676 ?
O5 K1 P3 100.92(5) 3_666 3_776 ?
O5 K1 F3 126.18(7) 3_666 3_776 ?
O5 K1 O7 66.21(6) 3_666 1_545 ?
O5 K1 O7 76.29(7) 3_666 3_676 ?
O5 K1 O8 84.55(7) 3_666 3_676 ?
O5 K1 O1 120.30(7) 3_666 4_676 ?
O7 K1 P3 151.91(5) 3_676 3_776 ?
O7 K1 P3 101.68(5) 1_545 3_676 ?
O7 K1 P3 25.28(4) 3_676 3_676 ?
O7 K1 P3 76.16(5) 1_545 3_776 ?
O7 K1 F3 140.66(7) 3_676 3_776 ?
O7 K1 O7 77.28(7) 3_676 1_545 ?
O7 K1 O1 129.68(7) 3_676 4_676 ?
O8 K1 P3 24.97(5) 3_676 3_676 ?
O8 K1 P3 157.83(5) 3_676 3_776 ?
O8 K1 F3 146.60(7) 3_676 3_776 ?
O8 K1 O7 125.07(7) 3_676 1_545 ?
O8 K1 O7 50.23(6) 3_676 3_676 ?
O8 K1 O1 82.37(7) 3_676 4_676 ?
O1 K1 P3 76.30(5) 4_676 3_776 ?
O1 K1 P3 105.80(5) 4_676 3_676 ?
O1 K1 O7 152.45(7) 4_676 1_545 ?
O3 K1 P3 99.83(5) 3_666 3_676 ?
O3 K1 P3 83.45(5) 3_666 3_776 ?
O3 K1 F2 110.01(7) 3_666 3_676 ?
O3 K1 F3 98.17(7) 3_666 3_776 ?
O3 K1 F4 71.09(7) 3_666 3_776 ?
O3 K1 O5 71.68(7) 3_666 3_666 ?
O3 K1 O7 120.69(7) 3_666 3_676 ?
O3 K1 O7 127.98(7) 3_666 1_545 ?
O3 K1 O8 77.88(7) 3_666 3_676 ?
O3 K1 O1 48.63(7) 3_666 4_676 ?
Ba1 P2 Ba1 177.10(3) . 1_455 ?
Ba1 P2 K1 96.22(2) 1_455 . ?
Ba1 P2 K1 80.874(19) . . ?
F2 P2 Ba1 52.48(9) . 1_455 ?
F2 P2 Ba1 126.42(9) . . ?
F2 P2 K1 77.22(9) . . ?
F2 P2 O5 105.70(13) . . ?
O4 P2 Ba1 50.90(9) . . ?
O4 P2 Ba1 126.38(9) . 1_455 ?
O4 P2 K1 35.32(9) . . ?
O4 P2 F2 110.31(13) . . ?
O4 P2 O5 111.07(13) . . ?
O4 P2 O6 109.16(14) . . ?
O5 P2 Ba1 127.74(9) . . ?
O5 P2 Ba1 53.22(9) . 1_455 ?
O5 P2 K1 110.09(9) . . ?
O6 P2 Ba1 124.46(10) . 1_455 ?
O6 P2 Ba1 58.26(9) . . ?
O6 P2 K1 134.90(10) . . ?
O6 P2 F2 110.70(13) . . ?
O6 P2 O5 109.89(13) . . ?
Ba1 P3 K1 97.97(2) 3_776 3_676 ?
K1 P3 Ba1 85.27(2) 3_776 3_776 ?
K1 P3 K1 176.72(3) 3_776 3_676 ?
K1 P3 Sr1 81.51(2) 3_776 2_665 ?
F3 P3 Ba1 49.48(9) . 3_776 ?
F3 P3 K1 119.53(10) . 3_676 ?
F3 P3 K1 62.30(9) . 3_776 ?
F3 P3 O7 106.60(13) . . ?
F3 P3 O8 110.28(13) . . ?
F3 P3 Sr1 121.84(10) . 2_665 ?
F4 P3 Ba1 118.63(9) . 3_776 ?
F4 P3 K1 54.00(9) . 3_776 ?
F4 P3 K1 124.23(10) . 3_676 ?
F4 P3 F3 116.24(14) . . ?
F4 P3 O7 109.69(13) . . ?
F4 P3 O8 107.31(13) . . ?
F4 P3 Sr1 53.10(9) . 2_665 ?
O7 P3 Ba1 59.08(9) . 3_776 ?
O7 P3 K1 128.54(10) . 3_776 ?
O7 P3 K1 54.19(9) . 3_676 ?
O7 P3 Sr1 131.43(9) . 2_665 ?
O8 P3 Ba1 134.06(9) . 3_776 ?
O8 P3 K1 52.19(9) . 3_676 ?
O8 P3 K1 124.94(10) . 3_776 ?
O8 P3 O7 106.32(13) . . ?
O8 P3 Sr1 55.48(9) . 2_665 ?
Sr1 P3 Ba1 166.74(3) 2_665 3_776 ?
Sr1 P3 K1 95.25(2) 2_665 3_676 ?
K1 F2 Ba1 96.66(7) 3_676 1_455 ?
P2 F2 Ba1 102.10(10) . 1_455 ?
P2 F2 K1 127.16(12) . 3_676 ?
Ba1 F3 Ba1 111.54(8) . 3_776 ?
Ba1 F3 K1 95.88(7) . 3_776 ?
Ba1 F3 K1 107.71(7) 3_776 3_776 ?
P3 F3 Ba1 136.30(13) . . ?
P3 F3 Ba1 106.88(11) . 3_776 ?
P3 F3 K1 91.54(11) . 3_776 ?
Ba1 F4 K1 100.98(7) 1_565 3_776 ?
Ba1 F4 Sr1 107.23(8) 1_565 2_665 ?
K1 F4 Sr1 105.59(7) 3_776 2_665 ?
P3 F4 Ba1 137.47(13) . 1_565 ?
P3 F4 K1 100.34(11) . 3_776 ?
P3 F4 Sr1 101.79(11) . 2_665 ?
K1 O4 Ba1 118.73(8) . . ?
P2 O4 Ba1 104.31(11) . . ?
P2 O4 K1 125.64(12) . . ?
K1 O5 Ba1 95.56(7) 3_666 1_455 ?
P2 O5 Ba1 101.26(10) . 1_455 ?
P2 O5 K1 128.02(12) . 3_666 ?
P2 O6 Ba1 96.14(11) . . ?
P2 O6 Sr1 130.55(13) . 1_565 ?
Sr1 O6 Ba1 117.15(8) 1_565 . ?
Ba1 O7 K1 83.25(6) 3_776 1_565 ?
K1 O7 Ba1 127.09(8) 3_676 3_776 ?
K1 O7 K1 102.72(7) 3_676 1_565 ?
P3 O7 Ba1 94.85(10) . 3_776 ?
P3 O7 K1 100.52(11) . 3_676 ?
P3 O7 K1 152.12(13) . 1_565 ?
P3 O8 K1 102.83(11) . 3_676 ?
P3 O8 Sr1 97.69(10) . 2_665 ?
Sr1 O8 K1 128.44(8) 2_665 3_676 ?
P3 Sr1 Sr1 106.549(17) 2_635 2_655 ?
P3 Sr1 P1 102.890(19) 2_635 2_545 ?
F4 Sr1 P3 25.11(5) 2_635 2_635 ?
F4 Sr1 O8 51.50(6) 2_635 2_635 ?
F4 Sr1 Sr1 97.31(5) 2_635 2_655 ?
F4 Sr1 P1 87.18(5) 2_635 2_545 ?
F4 Sr1 P1 105.99(5) 2_635 2_645 ?
F4 Sr1 F1 121.23(7) 2_635 2_645 ?
F4 Sr1 O2 111.58(7) 2_635 1_545 ?
O6 Sr1 P3 161.11(5) 1_545 2_635 ?
O6 Sr1 F4 173.74(7) 1_545 2_635 ?
O6 Sr1 O8 134.76(7) 1_545 2_635 ?
O6 Sr1 Sr1 80.79(5) 1_545 2_655 ?
O6 Sr1 P1 78.43(5) 1_545 2_645 ?
O6 Sr1 P1 88.40(5) 1_545 2_545 ?
O6 Sr1 F1 64.57(7) 1_545 2_645 ?
O6 Sr1 F1 101.24(7) 1_545 . ?
O6 Sr1 O2 71.54(7) 1_545 1_545 ?
O6 Sr1 O2 92.28(7) 1_545 2_645 ?
O6 Sr1 O3 106.23(7) 1_545 2_545 ?
O8 Sr1 P3 26.83(5) 2_635 2_635 ?
O8 Sr1 Sr1 106.62(5) 2_635 2_655 ?
O8 Sr1 P1 67.71(5) 2_635 2_645 ?
O8 Sr1 P1 123.05(5) 2_635 2_545 ?
O8 Sr1 F1 72.21(7) 2_635 2_645 ?
P1 Sr1 P3 89.67(2) 2_645 2_635 ?
P1 Sr1 Sr1 117.200(15) 2_545 2_655 ?
P1 Sr1 Sr1 61.641(16) 2_645 2_655 ?
P1 Sr1 P1 166.82(3) 2_645 2_545 ?
F1 Sr1 P3 95.62(5) . 2_635 ?
F1 Sr1 P3 98.65(5) 2_645 2_635 ?
F1 Sr1 F4 73.64(7) . 2_635 ?
F1 Sr1 O8 114.49(7) . 2_635 ?
F1 Sr1 Sr1 43.03(5) . 2_655 ?
F1 Sr1 Sr1 82.23(5) 2_645 2_655 ?
F1 Sr1 P1 102.68(5) . 2_645 ?
F1 Sr1 P1 80.33(5) . 2_545 ?
F1 Sr1 P1 144.61(5) 2_645 2_545 ?
F1 Sr1 P1 25.76(5) 2_645 2_645 ?
F1 Sr1 F1 125.20(7) . 2_645 ?
F1 Sr1 O2 77.92(7) . 2_645 ?
F1 Sr1 O2 155.27(7) . 1_545 ?
F1 Sr1 O3 89.33(7) . 2_545 ?
O2 Sr1 P3 82.92(5) 2_645 2_635 ?
O2 Sr1 P3 96.29(5) 1_545 2_635 ?
O2 Sr1 F4 90.16(7) 2_645 2_635 ?
O2 Sr1 O8 70.36(7) 2_645 2_635 ?
O2 Sr1 O8 84.72(7) 1_545 2_635 ?
O2 Sr1 Sr1 149.26(5) 1_545 2_655 ?
O2 Sr1 Sr1 41.53(5) 2_645 2_655 ?
O2 Sr1 P1 75.92(5) 1_545 2_545 ?
O2 Sr1 P1 98.99(5) 1_545 2_645 ?
O2 Sr1 P1 26.47(5) 2_645 2_645 ?
O2 Sr1 P1 157.94(5) 2_645 2_545 ?
O2 Sr1 F1 74.07(7) 1_545 2_645 ?
O2 Sr1 F1 52.16(7) 2_645 2_645 ?
O2 Sr1 O2 125.08(6) 2_645 1_545 ?
O3 Sr1 P3 82.25(5) 2_545 2_635 ?
O3 Sr1 F4 70.52(7) 2_545 2_635 ?
O3 Sr1 O8 101.21(7) 2_545 2_635 ?
O3 Sr1 Sr1 131.49(5) 2_545 2_655 ?
O3 Sr1 P1 166.17(5) 2_545 2_645 ?
O3 Sr1 P1 21.85(5) 2_545 2_545 ?
O3 Sr1 F1 144.88(7) 2_545 2_645 ?
O3 Sr1 O2 159.35(7) 2_545 2_645 ?
O3 Sr1 O2 70.95(7) 2_545 1_545 ?
Ba1 P1 K1 155.42(3) 2_645 3_666 ?
Ba1 P1 Sr1 104.42(2) 2_645 2 ?
Sr1 P1 Ba1 88.601(19) 2_655 2_645 ?
Sr1 P1 K1 93.23(2) 2_655 3_666 ?
Sr1 P1 K1 74.104(19) 2 3_666 ?
Sr1 P1 Sr1 166.82(3) 2_655 2 ?
F1 P1 Ba1 50.59(10) . 2_645 ?
F1 P1 K1 110.91(10) . 3_666 ?
F1 P1 Sr1 129.68(10) . 2 ?
F1 P1 Sr1 57.84(10) . 2_655 ?
F1 P1 O1 106.78(14) . . ?
F1 P1 O2 111.00(14) . . ?
F1 P1 O3 114.36(14) . . ?
O1 P1 Ba1 56.20(10) . 2_645 ?
O1 P1 K1 137.48(11) . 3_666 ?
O1 P1 Sr1 66.91(11) . 2 ?
O1 P1 Sr1 123.80(11) . 2_655 ?
O2 P1 Ba1 121.24(9) . 2_645 ?
O2 P1 K1 78.32(9) . 3_666 ?
O2 P1 Sr1 118.79(9) . 2 ?
O2 P1 Sr1 53.36(9) . 2_655 ?
O2 P1 O1 105.88(14) . . ?
O3 P1 Ba1 129.09(10) . 2_645 ?
O3 P1 K1 36.50(9) . 3_666 ?
O3 P1 Sr1 42.01(10) . 2 ?
O3 P1 Sr1 127.04(10) . 2_655 ?
O3 P1 O1 108.84(15) . . ?
O3 P1 O2 109.58(13) . . ?
Ba1 F1 Sr1 115.42(8) 2_645 2_655 ?
Sr1 F1 Ba1 105.71(8) . 2_645 ?
Sr1 F1 Sr1 97.45(8) . 2_655 ?
P1 F1 Ba1 105.50(12) . 2_645 ?
P1 F1 Sr1 135.94(14) . . ?
P1 F1 Sr1 96.41(11) . 2_655 ?
Ba1 O1 K1 85.81(6) 2_645 4_575 ?
P1 O1 Ba1 97.79(12) . 2_645 ?
P1 O1 K1 161.92(14) . 4_575 ?
Sr1 O2 Sr1 97.73(7) 2_655 1_565 ?
P1 O2 Sr1 128.36(12) . 1_565 ?
P1 O2 Sr1 100.17(11) . 2_655 ?
K1 O3 Sr1 110.91(8) 3_666 2 ?
P1 O3 K1 124.09(13) . 3_666 ?
P1 O3 Sr1 116.14(13) . 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
Ba1 P2 F2 Ba1 -176.64(3) . . . 1_455 ?
Ba1 P2 F2 K1 -108.14(15) 1_455 . . 3_676 ?
Ba1 P2 F2 K1 75.22(15) . . . 3_676 ?
Ba1 P2 O4 Ba1 -178.71(3) 1_455 . . . ?
Ba1 P2 O4 K1 -36.21(19) 1_455 . . . ?
Ba1 P2 O4 K1 142.50(19) . . . . ?
Ba1 P2 O5 Ba1 176.56(3) . . . 1_455 ?
Ba1 P2 O5 K1 -106.33(15) 1_455 . . 3_666 ?
Ba1 P2 O5 K1 70.23(16) . . . 3_666 ?
Ba1 P2 O6 Ba1 178.80(3) 1_455 . . . ?
Ba1 P2 O6 Sr1 -47.10(19) 1_455 . . 1_565 ?
Ba1 P2 O6 Sr1 134.11(18) . . . 1_565 ?
Ba1 P3 F3 Ba1 150.8(2) 3_776 . . . ?
Ba1 P3 F3 K1 -109.04(10) 3_776 . . 3_776 ?
Ba1 P3 F4 Ba1 -59.9(2) 3_776 . . 1_565 ?
Ba1 P3 F4 K1 59.15(10) 3_776 . . 3_776 ?
Ba1 P3 F4 Sr1 167.65(3) 3_776 . . 2_665 ?
Ba1 P3 O7 K1 -129.15(10) 3_776 . . 3_676 ?
Ba1 P3 O7 K1 84.7(3) 3_776 . . 1_565 ?
Ba1 P3 O8 K1 59.56(14) 3_776 . . 3_676 ?
Ba1 P3 O8 Sr1 -168.05(5) 3_776 . . 2_665 ?
Ba1 P1 F1 Sr1 -133.7(2) 2_645 . . . ?
Ba1 P1 F1 Sr1 118.64(12) 2_645 . . 2_655 ?
Ba1 P1 O1 K1 -100.4(5) 2_645 . . 4_575 ?
Ba1 P1 O2 Sr1 47.56(17) 2_645 . . 1_565 ?
Ba1 P1 O2 Sr1 -60.87(11) 2_645 . . 2_655 ?
Ba1 P1 O3 K1 150.68(7) 2_645 . . 3_666 ?
Ba1 P1 O3 Sr1 -65.01(16) 2_645 . . 2 ?
K1 P2 F2 Ba1 -108.32(7) . . . 1_455 ?
K1 P2 F2 K1 143.54(14) . . . 3_676 ?
K1 P2 O4 Ba1 -142.50(19) . . . . ?
K1 P2 O5 Ba1 82.57(8) . . . 1_455 ?
K1 P2 O5 K1 -23.75(16) . . . 3_666 ?
K1 P2 O6 Ba1 28.39(14) . . . . ?
K1 P2 O6 Sr1 162.50(7) . . . 1_565 ?
K1 P3 F3 Ba1 -100.17(18) 3_776 . . . ?
K1 P3 F3 Ba1 76.73(19) 3_676 . . . ?
K1 P3 F3 Ba1 109.04(10) 3_776 . . 3_776 ?
K1 P3 F3 Ba1 -74.06(11) 3_676 . . 3_776 ?
K1 P3 F3 K1 176.90(4) 3_676 . . 3_776 ?
K1 P3 F4 Ba1 -119.0(2) 3_776 . . 1_565 ?
K1 P3 F4 Ba1 64.3(2) 3_676 . . 1_565 ?
K1 P3 F4 K1 -176.63(4) 3_676 . . 3_776 ?
K1 P3 F4 Sr1 108.50(10) 3_776 . . 2_665 ?
K1 P3 F4 Sr1 -68.13(11) 3_676 . . 2_665 ?
K1 P3 O7 Ba1 129.15(10) 3_676 . . 3_776 ?
K1 P3 O7 Ba1 -53.14(11) 3_776 . . 3_776 ?
K1 P3 O7 K1 -146.1(3) 3_676 . . 1_565 ?
K1 P3 O7 K1 31.6(3) 3_776 . . 1_565 ?
K1 P3 O7 K1 177.71(4) 3_776 . . 3_676 ?
K1 P3 O8 K1 -178.03(4) 3_776 . . 3_676 ?
K1 P3 O8 Sr1 -45.64(12) 3_776 . . 2_665 ?
K1 P3 O8 Sr1 132.39(12) 3_676 . . 2_665 ?
K1 P1 F1 Ba1 161.09(5) 3_666 . . 2_645 ?
K1 P1 F1 Sr1 -80.27(8) 3_666 . . 2_655 ?
K1 P1 F1 Sr1 27.4(2) 3_666 . . . ?
K1 P1 O1 Ba1 -152.77(7) 3_666 . . 2_645 ?
K1 P1 O1 K1 106.8(5) 3_666 . . 4_575 ?
K1 P1 O2 Sr1 -148.54(14) 3_666 . . 1_565 ?
K1 P1 O2 Sr1 103.02(7) 3_666 . . 2_655 ?
K1 P1 O3 Sr1 144.3(2) 3_666 . . 2 ?
F2 P2 O4 Ba1 -120.99(11) . . . . ?
F2 P2 O4 K1 21.51(19) . . . . ?
F2 P2 O5 Ba1 0.73(13) . . . 1_455 ?
F2 P2 O5 K1 -105.59(15) . . . 3_666 ?
F2 P2 O6 Ba1 120.83(11) . . . . ?
F2 P2 O6 Sr1 -105.07(17) . . . 1_565 ?
F3 P3 F4 Ba1 -116.10(19) . . . 1_565 ?
F3 P3 F4 K1 2.94(15) . . . 3_776 ?
F3 P3 F4 Sr1 111.44(13) . . . 2_665 ?
F3 P3 O7 Ba1 14.36(13) . . . 3_776 ?
F3 P3 O7 K1 -114.79(11) . . . 3_676 ?
F3 P3 O7 K1 99.1(3) . . . 1_565 ?
F3 P3 O8 K1 112.24(12) . . . 3_676 ?
F3 P3 O8 Sr1 -115.37(12) . . . 2_665 ?
F4 P3 F3 Ba1 106.35(13) . . . 3_776 ?
F4 P3 F3 Ba1 -102.86(19) . . . . ?
F4 P3 F3 K1 -2.69(14) . . . 3_776 ?
F4 P3 O7 Ba1 -112.26(11) . . . 3_776 ?
F4 P3 O7 K1 118.59(11) . . . 3_676 ?
F4 P3 O7 K1 -27.5(3) . . . 1_565 ?
F4 P3 O8 K1 -120.26(11) . . . 3_676 ?
F4 P3 O8 Sr1 12.13(13) . . . 2_665 ?
O4 P2 F2 Ba1 -120.88(11) . . . 1_455 ?
O4 P2 F2 K1 130.99(14) . . . 3_676 ?
O4 P2 O5 Ba1 120.37(11) . . . 1_455 ?
O4 P2 O5 K1 14.04(19) . . . 3_666 ?
O4 P2 O6 Ba1 -0.77(13) . . . . ?
O4 P2 O6 Sr1 133.34(15) . . . 1_565 ?
O5 P2 F2 Ba1 -0.74(13) . . . 1_455 ?
O5 P2 F2 K1 -108.88(15) . . . 3_676 ?
O5 P2 O4 Ba1 122.16(11) . . . . ?
O5 P2 O4 K1 -95.34(16) . . . . ?
O5 P2 O6 Ba1 -122.80(11) . . . . ?
O5 P2 O6 Sr1 11.3(2) . . . 1_565 ?
O6 P2 F2 Ba1 118.20(12) . . . 1_455 ?
O6 P2 F2 K1 10.06(19) . . . 3_676 ?
O6 P2 O4 Ba1 0.84(14) . . . . ?
O6 P2 O4 K1 143.35(14) . . . . ?
O6 P2 O5 Ba1 -118.74(12) . . . 1_455 ?
O6 P2 O5 K1 134.93(14) . . . 3_666 ?
O7 P3 F3 Ba1 134.53(18) . . . . ?
O7 P3 F3 Ba1 -16.26(14) . . . 3_776 ?
O7 P3 F3 K1 -125.29(10) . . . 3_776 ?
O7 P3 F4 Ba1 4.9(2) . . . 1_565 ?
O7 P3 F4 K1 123.91(11) . . . 3_776 ?
O7 P3 F4 Sr1 -127.59(11) . . . 2_665 ?
O7 P3 O8 K1 -2.94(13) . . . 3_676 ?
O7 P3 O8 Sr1 129.45(10) . . . 2_665 ?
O8 P3 F3 Ba1 19.5(2) . . . . ?
O8 P3 F3 Ba1 -131.26(11) . . . 3_776 ?
O8 P3 F3 K1 119.71(11) . . . 3_776 ?
O8 P3 F4 Ba1 119.96(18) . . . 1_565 ?
O8 P3 F4 K1 -121.00(11) . . . 3_776 ?
O8 P3 F4 Sr1 -12.50(14) . . . 2_665 ?
O8 P3 O7 Ba1 132.02(10) . . . 3_776 ?
O8 P3 O7 K1 -143.3(2) . . . 1_565 ?
O8 P3 O7 K1 2.86(13) . . . 3_676 ?
Sr1 P3 F3 Ba1 167.54(4) 2_665 . . 3_776 ?
Sr1 P3 F3 Ba1 -41.7(2) 2_665 . . . ?
Sr1 P3 F3 K1 58.50(10) 2_665 . . 3_776 ?
Sr1 P3 F4 Ba1 132.5(2) 2_665 . . 1_565 ?
Sr1 P3 F4 K1 -108.50(11) 2_665 . . 3_776 ?
Sr1 P3 O7 Ba1 -169.94(5) 2_665 . . 3_776 ?
Sr1 P3 O7 K1 -85.2(3) 2_665 . . 1_565 ?
Sr1 P3 O7 K1 60.91(13) 2_665 . . 3_676 ?
Sr1 P3 O8 K1 -132.39(12) 2_665 . . 3_676 ?
Sr1 P1 F1 Ba1 -118.64(12) 2_655 . . 2_645 ?
Sr1 P1 F1 Ba1 74.76(13) 2 . . 2_645 ?
Sr1 P1 F1 Sr1 -58.9(2) 2 . . . ?
Sr1 P1 F1 Sr1 -166.60(5) 2 . . 2_655 ?
Sr1 P1 F1 Sr1 107.7(2) 2_655 . . . ?
Sr1 P1 O1 Ba1 61.08(11) 2_655 . . 2_645 ?
Sr1 P1 O1 Ba1 -127.68(9) 2 . . 2_645 ?
Sr1 P1 O1 K1 -39.4(5) 2_655 . . 4_575 ?
Sr1 P1 O1 K1 131.9(5) 2 . . 4_575 ?
Sr1 P1 O2 Sr1 167.38(3) 2 . . 2_655 ?
Sr1 P1 O2 Sr1 -84.18(14) 2 . . 1_565 ?
Sr1 P1 O2 Sr1 108.43(16) 2_655 . . 1_565 ?
Sr1 P1 O3 K1 -144.3(2) 2 . . 3_666 ?
Sr1 P1 O3 K1 25.7(2) 2_655 . . 3_666 ?
Sr1 P1 O3 Sr1 169.98(4) 2_655 . . 2 ?
F1 P1 O1 Ba1 -1.07(14) . . . 2_645 ?
F1 P1 O1 K1 -101.5(5) . . . 4_575 ?
F1 P1 O2 Sr1 -5.10(15) . . . 2_655 ?
F1 P1 O2 Sr1 103.33(17) . . . 1_565 ?
F1 P1 O3 K1 92.69(17) . . . 3_666 ?
F1 P1 O3 Sr1 -123.00(14) . . . 2 ?
O1 P1 F1 Ba1 1.15(15) . . . 2_645 ?
O1 P1 F1 Sr1 119.79(12) . . . 2_655 ?
O1 P1 F1 Sr1 -132.53(19) . . . . ?
O1 P1 O2 Sr1 -120.61(12) . . . 2_655 ?
O1 P1 O2 Sr1 -12.18(19) . . . 1_565 ?
O1 P1 O3 K1 -148.02(14) . . . 3_666 ?
O1 P1 O3 Sr1 -3.71(17) . . . 2 ?
O2 P1 F1 Ba1 -113.81(12) . . . 2_645 ?
O2 P1 F1 Sr1 112.52(19) . . . . ?
O2 P1 F1 Sr1 4.84(14) . . . 2_655 ?
O2 P1 O1 Ba1 117.29(11) . . . 2_645 ?
O2 P1 O1 K1 16.8(5) . . . 4_575 ?
O2 P1 O3 K1 -32.66(19) . . . 3_666 ?
O2 P1 O3 Sr1 111.65(13) . . . 2 ?
O3 P1 F1 Ba1 121.59(13) . . . 2_645 ?
O3 P1 F1 Sr1 -12.1(2) . . . . ?
O3 P1 F1 Sr1 -119.77(12) . . . 2_655 ?
O3 P1 O1 Ba1 -124.98(12) . . . 2_645 ?
O3 P1 O1 K1 134.6(5) . . . 4_575 ?
O3 P1 O2 Sr1 -129.41(15) . . . 1_565 ?
O3 P1 O2 Sr1 122.16(12) . . . 2_655 ?

_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 1.436
_oxdiff_exptl_absorpt_empirical_full_min 0.816
