# Electronic Supplementary Material (ESI) for Chemical Communications.
# This journal is © The Royal Society of Chemistry 2020

####################################################################### 
# 
# 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. 
# 
#######################################################################

data_CsLiBePO
_database_code_depnum_ccdc_archive 'CCDC 1969307'
loop_
_audit_author_name
_audit_author_address
'Yi-Gang Chen'
;Shanxi Normal University
China
;
_audit_update_record             
;
2020-06-17 deposited with the CCDC.	2020-06-29 downloaded from the CCDC.
;
_audit_creation_date             2019-12-02
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'Be4 Cs4 Li O24 P7'
_chemical_formula_sum            'Be4 Cs4 Li O24 P7'
_chemical_formula_weight         1175.41
_chemical_absolute_configuration ?
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Be Be 0.0005 0.0002 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cs Cs -0.3680 2.1192 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'

_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           17
_space_group_name_H-M_alt        'P 2 2 21'
_space_group_name_Hall           'P 2c 2'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'x, -y, -z'
'-x, y, -z+1/2'

_cell_length_a                   13.0892(4)
_cell_length_b                   13.0889(4)
_cell_length_c                   13.2528(4)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     2270.51(12)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    31840
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      36.0580
_cell_measurement_theta_min      3.0020
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    6.974
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.51207
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    3.439
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2144
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0372
_diffrn_reflns_av_unetI/netI     0.0410
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.956
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            31840
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.926
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         28.675
_diffrn_reflns_theta_min         3.071
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.956
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed tube'
_reflns_Friedel_coverage         0.724
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.887
_reflns_number_gt                4839
_reflns_number_total             5448
_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 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         0.991
_refine_diff_density_min         -0.500
_refine_diff_density_rms         0.136
_refine_ls_abs_structure_details 
;
 Flack x determined using 1794 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.030(10)
_refine_ls_extinction_coef       0.00406(8)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   0.933
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     362
_refine_ls_number_reflns         5448
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0314
_refine_ls_R_factor_gt           0.0270
_refine_ls_restrained_S_all      0.933
_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)+(0.0132P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0520
_refine_ls_wR_factor_ref         0.0542
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     iterative
_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
Cs1 Cs -0.11675(4) -0.12761(4) 0.12127(4) 0.03412(13) Uani 1 1 d . . . . .
P4 P -0.34803(12) -0.12938(15) -0.08394(13) 0.0193(3) Uani 1 1 d . . . . .
P3 P -0.13135(13) -0.34902(13) 0.33588(14) 0.0198(4) Uani 1 1 d . . . . .
P2 P -0.16733(12) -0.13750(14) 0.40655(14) 0.0213(4) Uani 1 1 d . . . . .
P7 P -0.58110(12) -0.41077(12) -0.12298(16) 0.0189(3) Uani 1 1 d . . . . .
P5 P -0.13421(13) -0.16387(13) -0.15942(14) 0.0210(4) Uani 1 1 d . . . . .
O13 O -0.1565(3) -0.3706(4) 0.0331(4) 0.0298(11) Uani 1 1 d . . . . .
O14 O -0.2259(3) -0.1300(5) -0.0861(4) 0.0359(13) Uani 1 1 d . . . . .
Cs2 Cs -0.37915(3) -0.38051(4) 0.12365(4) 0.03078(12) Uani 1 1 d . . . . .
P6 P -0.15939(12) -0.37754(15) -0.08034(13) 0.0194(3) Uani 1 1 d . . . . .
O16 O -0.1056(3) -0.2736(3) -0.1201(5) 0.0363(13) Uani 1 1 d . . . . .
O21 O -0.3838(4) -0.0311(3) -0.1275(4) 0.0309(11) Uani 1 1 d . . . . .
O20 O -0.3865(3) -0.2151(3) -0.1487(4) 0.0273(11) Uani 1 1 d . . . . .
O10 O -0.0306(3) -0.3763(4) 0.3838(4) 0.0293(10) Uani 1 1 d . . . . .
O9 O -0.1422(3) -0.3783(4) 0.2275(4) 0.0289(11) Uani 1 1 d . . . . .
O4 O -0.1236(4) -0.0464(4) 0.3595(5) 0.0461(15) Uani 1 1 d . . . . .
O18 O -0.1690(4) -0.1705(4) -0.2643(4) 0.0323(12) Uani 1 1 d . . . . .
O2 O -0.2886(3) -0.1308(4) 0.4003(4) 0.0328(12) Uani 1 1 d . . . . .
O6 O -0.2182(3) -0.3838(4) 0.4014(4) 0.0260(11) Uani 1 1 d . . . . .
O5 O -0.1366(3) -0.2265(3) 0.3304(4) 0.0242(10) Uani 1 1 d . . . . .
O12 O -0.3678(4) -0.1451(4) 0.0266(4) 0.0333(12) Uani 1 1 d . . . . .
O15 O -0.0491(3) -0.0966(3) -0.1307(5) 0.0318(12) Uani 1 1 d . . . . .
O17 O -0.0889(3) -0.4576(3) -0.1223(4) 0.0255(10) Uani 1 1 d . . . . .
O19 O -0.2657(3) -0.3815(4) -0.1194(4) 0.0308(11) Uani 1 1 d . . . . .
O23 O -0.6344(3) -0.3666(4) -0.0312(4) 0.0279(11) Uani 1 1 d . . . . .
O11 O -0.6037(3) -0.4771(3) 0.1378(4) 0.0281(11) Uani 1 1 d . . . . .
O22 O -0.6216(3) -0.3497(3) -0.2111(4) 0.0259(11) Uani 1 1 d . . . . .
O24 O -0.4648(3) -0.4001(3) -0.1114(4) 0.0259(11) Uani 1 1 d . . . . .
P1 P -0.38001(14) -0.16915(13) 0.32892(14) 0.0203(4) Uani 1 1 d . . . . .
O7 O -0.3514(3) -0.1474(4) 0.2209(4) 0.0268(11) Uani 1 1 d . . . . .
O1 O -0.4673(3) -0.1046(3) 0.3667(4) 0.0316(12) Uani 1 1 d . . . . .
Be1 Be -0.4093(6) -0.0894(7) 0.1267(8) 0.0250(19) Uani 1 1 d . . . . .
Be2 Be -0.6563(6) -0.3791(8) 0.0865(7) 0.0229(19) Uani 1 1 d . . . . .
Be3 Be 0.0864(7) -0.4192(7) 0.3750(8) 0.0262(19) Uani 1 1 d . . . . .
Cs3 Cs -0.14098(3) -0.62389(4) 0.37396(4) 0.03008(12) Uani 1 1 d . . . . .
Cs4 Cs -0.37387(3) -0.12983(4) 0.62777(4) 0.03115(12) Uani 1 1 d . . . . .
O8 O -0.3907(4) -0.2810(4) 0.3474(4) 0.0311(12) Uani 1 1 d . . . . .
O3 O -0.1444(4) -0.1651(4) 0.5115(4) 0.0369(14) Uani 1 1 d . . . . .
Be4 Be -0.3773(6) -0.3390(7) -0.1685(7) 0.0218(18) Uani 1 1 d . . . . .
Li1 Li 0.0942(8) -0.0928(8) -0.1285(10) 0.022(2) 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
Cs1 O13 3.428(5) . ?
Cs1 O14 3.098(5) . ?
Cs1 O14 3.691(6) 3 ?
Cs1 O9 3.587(5) . ?
Cs1 O4 3.332(6) . ?
Cs1 O4 3.330(6) 4 ?
Cs1 O5 3.617(4) 4 ?
Cs1 O5 3.070(5) . ?
Cs1 O12 3.525(5) . ?
Cs1 O15 3.479(6) . ?
Cs1 O15 3.068(4) 3 ?
Cs1 O7 3.353(4) . ?
P4 O14 1.598(4) . ?
P4 O21 1.486(5) . ?
P4 O20 1.500(5) . ?
P4 O12 1.502(5) . ?
P4 Cs4 3.6862(16) 4_455 ?
P4 Cs4 3.8356(18) 1_554 ?
P3 O10 1.507(4) . ?
P3 O9 1.493(5) . ?
P3 O6 1.501(5) . ?
P3 O5 1.606(4) . ?
P3 Cs3 3.6351(18) . ?
P3 Cs3 3.8637(19) 3_546 ?
P2 Cs1 3.7389(17) 4 ?
P2 O4 1.462(6) . ?
P2 O2 1.591(4) . ?
P2 O5 1.593(5) . ?
P2 Cs4 3.9891(19) . ?
P2 O3 1.468(5) . ?
P7 Cs2 3.8014(17) 3_545 ?
P7 Cs2 4.222(2) . ?
P7 O23 1.516(5) . ?
P7 O11 1.510(5) 3_545 ?
P7 O22 1.511(5) . ?
P7 O24 1.536(4) . ?
P7 Cs3 3.6662(16) 2_444 ?
P7 Cs4 3.7246(17) 4_455 ?
P5 Cs1 3.8552(18) 3 ?
P5 O14 1.607(5) . ?
P5 O16 1.573(5) . ?
P5 O18 1.465(5) . ?
P5 O15 1.470(5) . ?
P5 Cs3 3.9762(19) 3_545 ?
P5 Cs4 4.2419(19) 1_554 ?
P5 Li1 3.007(13) 4_554 ?
O13 Cs2 3.155(4) . ?
O13 P6 1.507(5) . ?
O13 Be3 1.652(11) 4 ?
O14 Cs1 3.691(6) 3 ?
Cs2 O9 3.394(4) . ?
Cs2 O12 3.343(5) . ?
Cs2 O19 3.547(5) . ?
Cs2 O19 3.451(5) 3_545 ?
Cs2 O11 3.413(5) 4_455 ?
Cs2 O11 3.206(4) . ?
Cs2 O24 3.321(5) . ?
Cs2 O24 3.087(4) 3_545 ?
Cs2 O7 3.333(5) . ?
Cs2 O8 3.305(5) 4_455 ?
Cs2 O8 3.242(5) . ?
P6 O16 1.620(5) . ?
P6 O17 1.503(5) . ?
P6 O19 1.485(4) . ?
P6 Cs3 3.8989(18) 3_545 ?
P6 Cs3 3.9780(16) 2_544 ?
O16 Cs3 3.497(5) 2_544 ?
O16 Cs3 3.651(6) 3_545 ?
O21 Be1 1.613(9) 3 ?
O21 Cs4 3.493(5) 1_554 ?
O21 Cs4 3.425(5) 4_455 ?
O20 Cs4 3.341(4) 4_455 ?
O20 Cs4 3.170(5) 1_554 ?
O20 Be4 1.647(10) . ?
O10 Cs1 3.784(5) 4 ?
O10 Be3 1.635(9) . ?
O10 Cs3 3.521(5) 3_546 ?
O10 Cs3 3.550(5) . ?
O9 Be3 1.632(11) 4 ?
O9 Cs3 3.754(5) . ?
O4 Cs1 3.330(6) 4 ?
O4 Li1 1.868(11) 2 ?
O18 Cs3 3.081(5) 3_545 ?
O18 Cs4 3.086(5) 1_554 ?
O18 Li1 2.003(13) 4_554 ?
O2 P1 1.606(5) . ?
O2 Cs4 3.215(5) . ?
O2 Cs4 3.609(6) 3_556 ?
O6 Be2 1.651(9) 4_455 ?
O6 Cs3 3.146(5) 3_546 ?
O6 Cs3 3.321(5) . ?
O5 Cs1 3.617(4) 4 ?
O12 Be1 1.608(11) . ?
O15 Cs1 3.067(4) 3 ?
O15 Li1 1.877(11) . ?
O17 Be3 1.613(10) 2_544 ?
O17 Cs3 3.193(4) 2_544 ?
O17 Cs3 3.567(5) 3_545 ?
O19 Cs2 3.452(5) 3_545 ?
O19 Cs3 3.749(5) 3_545 ?
O19 Be4 1.693(9) . ?
O23 Be2 1.595(10) . ?
O23 Cs3 3.200(4) 2_444 ?
O23 Cs4 3.355(5) 4_455 ?
O11 P7 1.510(5) 3_545 ?
O11 Cs2 3.413(5) 4_455 ?
O11 Be2 1.606(10) . ?
O22 Cs3 3.324(5) 2_444 ?
O22 Cs4 3.084(5) 4_455 ?
O22 Be4 1.602(10) 4_454 ?
O24 Cs2 3.087(4) 3_545 ?
O24 Be4 1.588(10) . ?
P1 Cs2 4.2410(19) 4_455 ?
P1 O7 1.507(5) . ?
P1 O1 1.506(4) . ?
P1 Cs4 3.9561(18) 3_556 ?
P1 Cs4 3.9947(19) . ?
P1 O8 1.491(5) . ?
O7 Be1 1.646(11) . ?
O1 Be1 1.630(9) 4_455 ?
O1 Cs4 3.685(5) . ?
O1 Cs4 3.304(5) 3_556 ?
Be1 O21 1.613(9) 3 ?
Be1 O1 1.630(9) 4_455 ?
Be1 Cs4 4.036(9) 2_454 ?
Be2 Cs2 3.869(9) 4_455 ?
Be2 O6 1.651(9) 4_455 ?
Be2 Cs3 4.192(10) 4_455 ?
Be2 Cs3 3.870(9) 2_444 ?
Be2 O8 1.672(11) 4_455 ?
Be3 Cs1 3.838(9) 4 ?
Be3 O13 1.652(11) 4 ?
Be3 Cs2 3.865(9) 4 ?
Be3 O9 1.632(11) 4 ?
Be3 O17 1.613(10) 2_545 ?
Be3 Cs3 4.004(9) . ?
Cs3 O16 3.497(5) 2_545 ?
Cs3 O10 3.521(5) 3_546 ?
Cs3 O18 3.081(5) 3_545 ?
Cs3 O6 3.146(5) 3_546 ?
Cs3 O17 3.567(5) 3_545 ?
Cs3 O17 3.193(4) 2_545 ?
Cs3 O23 3.200(4) 2_445 ?
Cs3 O22 3.324(5) 2_445 ?
Cs3 O3 3.152(6) 3_546 ?
Cs4 O21 3.493(5) 1_556 ?
Cs4 O21 3.425(5) 4_455 ?
Cs4 O20 3.170(5) 1_556 ?
Cs4 O20 3.341(4) 4_455 ?
Cs4 O18 3.086(5) 1_556 ?
Cs4 O2 3.609(6) 3_556 ?
Cs4 O23 3.355(5) 4_455 ?
Cs4 O22 3.084(5) 4_455 ?
Cs4 O1 3.304(5) 3_556 ?
Cs4 O3 3.407(5) . ?
O8 Cs2 3.305(5) 4_455 ?
O8 Be2 1.672(11) 4_455 ?
O3 Cs3 3.152(6) 3_546 ?
O3 Li1 1.932(13) 4 ?
Be4 Cs2 3.719(9) 3_545 ?
Be4 O22 1.602(10) 4_454 ?
Be4 Cs3 4.149(10) 3_545 ?
Be4 Cs4 3.846(9) 1_554 ?
Li1 Cs1 4.405(12) 2_554 ?
Li1 Cs1 3.994(10) 3 ?
Li1 P5 3.006(13) 4_554 ?
Li1 O4 1.868(11) 2_554 ?
Li1 O18 2.003(13) 4_554 ?
Li1 Cs3 3.759(10) 2_544 ?
Li1 Cs4 3.692(10) 4 ?
Li1 O3 1.932(13) 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
O13 Cs1 O14 138.22(11) . 3 ?
O13 Cs1 O9 43.18(11) . . ?
O13 Cs1 O5 82.37(10) . 4 ?
O13 Cs1 O12 71.17(11) . . ?
O13 Cs1 O15 79.62(11) . . ?
O14 Cs1 O13 67.56(14) . . ?
O14 Cs1 O14 73.66(15) . 3 ?
O14 Cs1 O9 107.24(14) . . ?
O14 Cs1 O4 146.24(13) . . ?
O14 Cs1 O4 120.46(14) . 4 ?
O14 Cs1 O5 125.20(12) . 4 ?
O14 Cs1 O12 41.72(12) . . ?
O14 Cs1 O15 42.85(11) . . ?
O14 Cs1 O7 85.76(12) . . ?
O9 Cs1 O14 148.14(10) . 3 ?
O9 Cs1 O5 71.81(10) . 4 ?
O4 Cs1 O13 117.74(11) 4 . ?
O4 Cs1 O13 127.93(12) . . ?
O4 Cs1 O14 79.51(12) . 3 ?
O4 Cs1 O14 94.81(11) 4 3 ?
O4 Cs1 O9 110.46(11) 4 . ?
O4 Cs1 O9 85.26(12) . . ?
O4 Cs1 O4 81.43(15) 4 . ?
O4 Cs1 O5 88.34(12) . 4 ?
O4 Cs1 O5 40.07(10) 4 4 ?
O4 Cs1 O12 109.44(12) . . ?
O4 Cs1 O12 158.22(13) 4 . ?
O4 Cs1 O15 78.22(13) 4 . ?
O4 Cs1 O15 151.53(11) . . ?
O4 Cs1 O7 149.27(14) 4 . ?
O4 Cs1 O7 68.09(13) . . ?
O5 Cs1 O13 84.46(12) . . ?
O5 Cs1 O14 134.77(10) 4 3 ?
O5 Cs1 O14 117.80(11) . 3 ?
O5 Cs1 O14 139.25(13) . . ?
O5 Cs1 O9 41.56(11) . . ?
O5 Cs1 O4 98.36(13) . 4 ?
O5 Cs1 O4 43.70(12) . . ?
O5 Cs1 O5 76.51(13) . 4 ?
O5 Cs1 O12 102.41(12) . . ?
O5 Cs1 O15 159.62(11) . . ?
O5 Cs1 O7 62.25(11) . . ?
O12 Cs1 O14 69.72(11) . 3 ?
O12 Cs1 O9 89.66(11) . . ?
O12 Cs1 O5 153.45(11) . 4 ?
O15 Cs1 O13 160.95(14) 3 . ?
O15 Cs1 O14 82.57(10) . 3 ?
O15 Cs1 O14 100.31(15) 3 . ?
O15 Cs1 O14 40.82(10) 3 3 ?
O15 Cs1 O9 120.49(11) . . ?
O15 Cs1 O9 152.37(13) 3 . ?
O15 Cs1 O4 70.36(14) 3 . ?
O15 Cs1 O4 54.48(12) 3 4 ?
O15 Cs1 O5 88.77(10) . 4 ?
O15 Cs1 O5 113.02(14) 3 . ?
O15 Cs1 O5 94.05(10) 3 4 ?
O15 Cs1 O12 110.22(12) 3 . ?
O15 Cs1 O12 84.45(11) . . ?
O15 Cs1 O15 81.61(15) 3 . ?
O15 Cs1 O7 108.78(12) 3 . ?
O7 Cs1 O13 85.63(11) . . ?
O7 Cs1 O14 76.44(11) . 3 ?
O7 Cs1 O9 71.93(11) . . ?
O7 Cs1 O5 137.93(11) . 4 ?
O7 Cs1 O12 44.04(11) . . ?
O7 Cs1 O15 128.33(11) . . ?
O14 P4 Cs1 42.98(19) . . ?
O14 P4 Cs4 169.9(2) . 4_455 ?
O14 P4 Cs4 94.0(2) . 1_554 ?
O21 P4 Cs1 119.3(2) . . ?
O21 P4 O14 108.2(3) . . ?
O21 P4 O20 108.6(3) . . ?
O21 P4 O12 116.3(3) . . ?
O21 P4 Cs4 68.20(19) . 4_455 ?
O21 P4 Cs4 65.6(2) . 1_554 ?
O20 P4 Cs1 129.53(19) . . ?
O20 P4 O14 108.7(3) . . ?
O20 P4 O12 113.5(3) . . ?
O20 P4 Cs4 65.00(18) . 4_455 ?
O20 P4 Cs4 53.1(2) . 1_554 ?
O12 P4 Cs1 58.5(2) . . ?
O12 P4 O14 100.9(3) . . ?
O12 P4 Cs4 163.0(2) . 1_554 ?
O12 P4 Cs4 89.0(2) . 4_455 ?
Cs4 P4 Cs1 136.99(4) 1_554 . ?
Cs4 P4 Cs1 147.13(5) 4_455 . ?
Cs4 P4 Cs4 75.88(3) 4_455 1_554 ?
O10 P3 Cs1 115.0(2) . . ?
O10 P3 O5 107.0(3) . . ?
O10 P3 Cs3 65.6(2) . 3_546 ?
O10 P3 Cs3 74.76(19) . . ?
O9 P3 Cs1 61.0(2) . . ?
O9 P3 O10 115.3(3) . . ?
O9 P3 O6 114.0(3) . . ?
O9 P3 O5 102.1(3) . . ?
O9 P3 Cs3 82.9(2) . . ?
O9 P3 Cs3 158.5(2) . 3_546 ?
O6 P3 Cs1 131.03(19) . . ?
O6 P3 O10 110.3(3) . . ?
O6 P3 O5 107.2(3) . . ?
O6 P3 Cs3 51.09(18) . 3_546 ?
O6 P3 Cs3 66.0(2) . . ?
O5 P3 Cs1 42.16(18) . . ?
O5 P3 Cs3 173.03(19) . . ?
O5 P3 Cs3 97.78(19) . 3_546 ?
Cs3 P3 Cs1 143.55(5) . . ?
Cs3 P3 Cs1 139.76(5) 3_546 . ?
Cs3 P3 Cs3 76.69(4) . 3_546 ?
Cs1 P2 Cs1 74.35(4) 4 . ?
Cs1 P2 Cs4 147.09(5) . . ?
Cs1 P2 Cs4 138.21(5) 4 . ?
O4 P2 Cs1 62.6(2) . 4 ?
O4 P2 Cs1 59.0(2) . . ?
O4 P2 O2 108.9(3) . . ?
O4 P2 O5 103.1(3) . . ?
O4 P2 Cs4 123.9(2) . . ?
O4 P2 O3 121.7(3) . . ?
O2 P2 Cs1 169.9(2) . 4 ?
O2 P2 Cs1 96.83(19) . . ?
O2 P2 O5 105.0(3) . . ?
O2 P2 Cs4 50.29(18) . . ?
O5 P2 Cs1 73.25(17) . 4 ?
O5 P2 Cs1 50.02(18) . . ?
O5 P2 Cs4 130.93(18) . . ?
O3 P2 Cs1 154.9(2) . . ?
O3 P2 Cs1 84.2(2) . 4 ?
O3 P2 O2 105.5(3) . . ?
O3 P2 O5 111.6(3) . . ?
O3 P2 Cs4 56.5(2) . . ?
Cs2 P7 Cs2 68.52(3) 3_545 . ?
O23 P7 Cs2 68.39(19) . . ?
O23 P7 Cs2 126.6(2) . 3_545 ?
O23 P7 O24 110.0(3) . . ?
O23 P7 Cs3 60.33(18) . 2_444 ?
O23 P7 Cs4 64.2(2) . 4_455 ?
O11 P7 Cs2 55.79(18) 3_545 3_545 ?
O11 P7 Cs2 108.3(2) 3_545 . ?
O11 P7 O23 112.6(3) 3_545 . ?
O11 P7 O22 110.1(3) 3_545 . ?
O11 P7 O24 107.2(3) 3_545 . ?
O11 P7 Cs3 85.64(18) 3_545 2_444 ?
O11 P7 Cs4 157.8(2) 3_545 4_455 ?
O22 P7 Cs2 140.21(19) . . ?
O22 P7 Cs2 128.5(2) . 3_545 ?
O22 P7 O23 104.9(3) . . ?
O22 P7 O24 112.1(3) . . ?
O22 P7 Cs3 65.04(18) . 2_444 ?
O22 P7 Cs4 53.80(18) . 4_455 ?
O24 P7 Cs2 51.45(17) . 3_545 ?
O24 P7 Cs2 45.1(2) . . ?
O24 P7 Cs3 166.65(19) . 2_444 ?
O24 P7 Cs4 93.93(17) . 4_455 ?
Cs3 P7 Cs2 128.18(5) 2_444 . ?
Cs3 P7 Cs2 141.15(5) 2_444 3_545 ?
Cs3 P7 Cs4 73.78(3) 2_444 4_455 ?
Cs4 P7 Cs2 145.04(5) 4_455 3_545 ?
Cs4 P7 Cs2 91.13(4) 4_455 . ?
Cs1 P5 Cs1 75.02(4) . 3 ?
Cs1 P5 Cs3 141.86(5) 3 3_545 ?
Cs1 P5 Cs3 142.91(5) . 3_545 ?
Cs1 P5 Cs4 133.63(5) . 1_554 ?
Cs1 P5 Cs4 91.55(4) 3 1_554 ?
O14 P5 Cs1 72.1(2) . 3 ?
O14 P5 Cs1 53.99(18) . . ?
O14 P5 Cs3 127.5(2) . 3_545 ?
O14 P5 Cs4 79.65(18) . 1_554 ?
O14 P5 Li1 127.6(3) . 4_554 ?
O16 P5 Cs1 76.9(2) . . ?
O16 P5 Cs1 147.8(2) . 3 ?
O16 P5 O14 103.3(3) . . ?
O16 P5 Cs3 66.7(2) . 3_545 ?
O16 P5 Cs4 119.5(2) . 1_554 ?
O16 P5 Li1 123.4(3) . 4_554 ?
O18 P5 Cs1 164.9(2) . . ?
O18 P5 Cs1 101.6(2) . 3 ?
O18 P5 O14 111.0(3) . . ?
O18 P5 O16 109.5(3) . . ?
O18 P5 O15 121.1(3) . . ?
O18 P5 Cs3 43.4(2) . 3_545 ?
O18 P5 Cs4 31.3(2) . 1_554 ?
O18 P5 Li1 35.5(3) . 4_554 ?
O15 P5 Cs1 47.80(17) . 3 ?
O15 P5 Cs1 67.8(2) . . ?
O15 P5 O14 104.2(3) . . ?
O15 P5 O16 106.3(3) . . ?
O15 P5 Cs3 128.3(2) . 3_545 ?
O15 P5 Cs4 132.0(2) . 1_554 ?
O15 P5 Li1 85.7(3) . 4_554 ?
Cs3 P5 Cs4 65.26(3) 3_545 1_554 ?
Li1 P5 Cs1 78.8(2) 4_554 3 ?
Li1 P5 Cs1 151.1(2) 4_554 . ?
Li1 P5 Cs3 63.4(2) 4_554 3_545 ?
Li1 P5 Cs4 58.3(2) 4_554 1_554 ?
Cs2 O13 Cs1 92.80(13) . . ?
P6 O13 Cs1 113.6(3) . . ?
P6 O13 Cs2 110.7(2) . . ?
P6 O13 Be3 136.6(5) . 4 ?
Be3 O13 Cs1 91.3(4) 4 . ?
Be3 O13 Cs2 102.5(4) 4 . ?
Cs1 O14 Cs1 85.65(12) . 3 ?
P4 O14 Cs1 112.6(3) . 3 ?
P4 O14 Cs1 116.4(2) . . ?
P4 O14 P5 139.4(3) . . ?
P5 O14 Cs1 83.5(2) . 3 ?
P5 O14 Cs1 101.2(2) . . ?
O13 Cs2 O9 46.33(11) . . ?
O13 Cs2 O12 76.99(14) . . ?
O13 Cs2 O19 68.49(12) . 3_545 ?
O13 Cs2 O19 42.93(11) . . ?
O13 Cs2 O11 115.35(12) . 4_455 ?
O13 Cs2 O11 152.35(13) . . ?
O13 Cs2 O24 87.61(12) . . ?
O13 Cs2 O7 90.50(12) . . ?
O13 Cs2 O8 111.97(13) . . ?
O13 Cs2 O8 150.49(13) . 4_455 ?
O9 Cs2 O19 89.17(10) . . ?
O9 Cs2 O19 67.72(11) . 3_545 ?
O9 Cs2 O11 71.77(11) . 4_455 ?
O12 Cs2 O9 96.19(12) . . ?
O12 Cs2 O19 143.77(12) . 3_545 ?
O12 Cs2 O19 68.63(12) . . ?
O12 Cs2 O11 134.51(12) . 4_455 ?
O19 Cs2 O19 78.55(15) 3_545 . ?
O11 Cs2 O9 144.86(12) . . ?
O11 Cs2 O12 115.27(12) . . ?
O11 Cs2 O19 150.15(11) 4_455 . ?
O11 Cs2 O19 92.27(10) . 3_545 ?
O11 Cs2 O19 115.83(12) . . ?
O11 Cs2 O19 73.08(12) 4_455 3_545 ?
O11 Cs2 O11 74.89(14) . 4_455 ?
O11 Cs2 O24 73.44(12) . . ?
O11 Cs2 O7 116.01(11) . . ?
O11 Cs2 O8 93.58(13) . . ?
O11 Cs2 O8 46.58(11) . 4_455 ?
O24 Cs2 O13 110.73(13) 3_545 . ?
O24 Cs2 O9 111.16(12) 3_545 . ?
O24 Cs2 O9 133.61(11) . . ?
O24 Cs2 O12 148.61(13) 3_545 . ?
O24 Cs2 O12 74.04(12) . . ?
O24 Cs2 O19 93.45(12) . 3_545 ?
O24 Cs2 O19 44.70(10) . . ?
O24 Cs2 O19 46.83(10) 3_545 3_545 ?
O24 Cs2 O19 95.80(12) 3_545 . ?
O24 Cs2 O11 144.93(10) . 4_455 ?
O24 Cs2 O11 45.82(11) 3_545 . ?
O24 Cs2 O11 71.33(12) 3_545 4_455 ?
O24 Cs2 O24 75.91(14) 3_545 . ?
O24 Cs2 O7 155.74(12) 3_545 . ?
O24 Cs2 O7 118.05(11) . . ?
O24 Cs2 O8 92.39(11) 3_545 4_455 ?
O24 Cs2 O8 113.88(12) 3_545 . ?
O7 Cs2 O9 74.68(11) . . ?
O7 Cs2 O12 45.55(11) . . ?
O7 Cs2 O19 108.00(12) . . ?
O7 Cs2 O19 141.80(11) . 3_545 ?
O7 Cs2 O11 89.32(11) . 4_455 ?
O8 Cs2 O9 141.52(12) 4_455 . ?
O8 Cs2 O9 70.61(12) . . ?
O8 Cs2 O12 73.84(12) 4_455 . ?
O8 Cs2 O12 89.05(12) . . ?
O8 Cs2 O19 113.43(12) . 3_545 ?
O8 Cs2 O19 119.26(11) 4_455 . ?
O8 Cs2 O19 148.36(11) . . ?
O8 Cs2 O19 138.59(11) 4_455 3_545 ?
O8 Cs2 O11 88.78(11) 4_455 4_455 ?
O8 Cs2 O11 45.46(11) . 4_455 ?
O8 Cs2 O24 150.84(11) . . ?
O8 Cs2 O24 80.31(11) 4_455 . ?
O8 Cs2 O7 44.22(12) . . ?
O8 Cs2 O7 72.15(11) 4_455 . ?
O8 Cs2 O8 72.12(15) . 4_455 ?
O13 P6 Cs2 48.38(17) . . ?
O13 P6 O16 105.3(3) . . ?
O13 P6 Cs3 97.27(17) . 2_544 ?
O13 P6 Cs3 173.8(2) . 3_545 ?
Cs2 P6 Cs3 145.53(5) . 2_544 ?
O16 P6 Cs2 123.2(2) . . ?
O16 P6 Cs3 61.13(17) . 2_544 ?
O16 P6 Cs3 69.2(2) . 3_545 ?
O17 P6 O13 113.3(3) . . ?
O17 P6 Cs2 133.9(2) . . ?
O17 P6 O16 101.5(3) . . ?
O17 P6 Cs3 48.73(17) . 2_544 ?
O17 P6 Cs3 66.2(2) . 3_545 ?
O19 P6 O13 111.9(3) . . ?
O19 P6 Cs2 63.6(2) . . ?
O19 P6 O16 108.8(3) . . ?
O19 P6 O17 114.9(3) . . ?
O19 P6 Cs3 73.2(2) . 3_545 ?
O19 P6 Cs3 150.8(2) . 2_544 ?
Cs3 P6 Cs2 136.77(4) 3_545 . ?
Cs3 P6 Cs3 77.70(3) 3_545 2_544 ?
P5 O16 Cs1 78.9(2) . . ?
P5 O16 P6 140.5(3) . . ?
P5 O16 Cs3 124.2(2) . 2_544 ?
P5 O16 Cs3 90.0(2) . 3_545 ?
P6 O16 Cs1 97.7(3) . . ?
P6 O16 Cs3 94.94(19) . 2_544 ?
P6 O16 Cs3 86.4(2) . 3_545 ?
Cs3 O16 Cs1 166.84(14) 3_545 . ?
Cs3 O16 Cs1 104.58(14) 2_544 . ?
Cs3 O16 Cs3 87.44(12) 2_544 3_545 ?
P4 O21 Be1 155.4(5) . 3 ?
P4 O21 Cs4 88.0(2) . 4_455 ?
P4 O21 Cs4 91.7(2) . 1_554 ?
Be1 O21 Cs4 112.1(5) 3 1_554 ?
Be1 O21 Cs4 100.2(4) 3 4_455 ?
Cs4 O21 Cs4 83.93(11) 4_455 1_554 ?
P4 O20 Cs4 104.7(2) . 1_554 ?
P4 O20 Cs4 91.00(19) . 4_455 ?
P4 O20 Be4 143.4(5) . . ?
Cs4 O20 Cs4 90.51(12) 1_554 4_455 ?
Be4 O20 Cs4 101.2(4) . 1_554 ?
Be4 O20 Cs4 114.3(4) . 4_455 ?
P3 O10 Cs1 103.6(2) . 4 ?
P3 O10 Be3 150.6(5) . . ?
P3 O10 Cs3 81.07(19) . . ?
P3 O10 Cs3 91.4(2) . 3_546 ?
Be3 O10 Cs1 79.5(4) . 4 ?
Be3 O10 Cs3 93.7(4) . . ?
Be3 O10 Cs3 116.7(5) . 3_546 ?
Cs3 O10 Cs1 102.98(12) 3_546 4 ?
Cs3 O10 Cs1 172.70(13) . 4 ?
Cs3 O10 Cs3 82.36(10) 3_546 . ?
Cs1 O9 Cs3 170.35(15) . . ?
P3 O9 Cs1 97.7(2) . . ?
P3 O9 Cs2 118.6(2) . . ?
P3 O9 Be3 147.4(4) . 4 ?
P3 O9 Cs3 73.9(2) . . ?
Cs2 O9 Cs1 86.17(11) . . ?
Cs2 O9 Cs3 101.90(12) . . ?
Be3 O9 Cs1 86.1(4) 4 . ?
Be3 O9 Cs2 93.9(4) 4 . ?
Be3 O9 Cs3 98.5(4) 4 . ?
Cs1 O4 Cs1 86.87(13) 4 . ?
P2 O4 Cs1 98.9(3) . . ?
P2 O4 Cs1 94.4(3) . 4 ?
P2 O4 Li1 147.0(5) . 2 ?
Li1 O4 Cs1 96.3(4) 2 4 ?
Li1 O4 Cs1 112.7(5) 2 . ?
P5 O18 Cs3 117.5(3) . 3_545 ?
P5 O18 Cs4 134.4(3) . 1_554 ?
P5 O18 Li1 119.4(5) . 4_554 ?
Cs3 O18 Cs4 92.01(14) 3_545 1_554 ?
Li1 O18 Cs3 92.9(4) 4_554 3_545 ?
Li1 O18 Cs4 90.5(4) 4_554 1_554 ?
P2 O2 P1 139.2(3) . . ?
P2 O2 Cs4 111.5(3) . 3_556 ?
P2 O2 Cs4 107.3(2) . . ?
P1 O2 Cs4 90.2(2) . 3_556 ?
P1 O2 Cs4 107.1(2) . . ?
Cs4 O2 Cs4 89.16(12) . 3_556 ?
P3 O6 Be2 142.9(5) . 4_455 ?
P3 O6 Cs3 107.1(2) . 3_546 ?
P3 O6 Cs3 89.6(2) . . ?
Be2 O6 Cs3 103.1(4) 4_455 3_546 ?
Be2 O6 Cs3 110.4(4) 4_455 . ?
Cs3 O6 Cs3 92.06(12) 3_546 . ?
Cs1 O5 Cs1 86.06(10) . 4 ?
P3 O5 Cs1 117.3(2) . . ?
P3 O5 Cs1 108.1(2) . 4 ?
P2 O5 Cs1 81.80(18) . 4 ?
P2 O5 Cs1 106.5(2) . . ?
P2 O5 P3 135.4(3) . . ?
P4 O12 Cs1 100.2(2) . . ?
P4 O12 Cs2 120.6(3) . . ?
P4 O12 Be1 143.3(5) . . ?
Cs2 O12 Cs1 87.94(12) . . ?
Be1 O12 Cs1 89.5(4) . . ?
Be1 O12 Cs2 94.9(4) . . ?
Cs1 O15 Cs1 89.94(13) 3 . ?
P5 O15 Cs1 111.4(2) . 3 ?
P5 O15 Cs1 89.2(2) . . ?
P5 O15 Li1 141.0(5) . . ?
Li1 O15 Cs1 105.2(4) . 3 ?
Li1 O15 Cs1 104.0(4) . . ?
P6 O17 Be3 135.9(5) . 2_544 ?
P6 O17 Cs3 91.2(2) . 3_545 ?
P6 O17 Cs3 110.5(2) . 2_544 ?
Be3 O17 Cs3 108.3(4) 2_544 2_544 ?
Be3 O17 Cs3 106.4(5) 2_544 3_545 ?
Cs3 O17 Cs3 93.76(12) 2_544 3_545 ?
Cs2 O19 Cs2 80.68(11) 3_545 . ?
Cs2 O19 Cs3 100.92(13) 3_545 3_545 ?
Cs2 O19 Cs3 178.34(16) . 3_545 ?
P6 O19 Cs2 94.4(2) . . ?
P6 O19 Cs2 116.1(3) . 3_545 ?
P6 O19 Cs3 84.5(2) . 3_545 ?
P6 O19 Be4 158.5(5) . . ?
Be4 O19 Cs2 89.2(4) . . ?
Be4 O19 Cs2 85.3(3) . 3_545 ?
Be4 O19 Cs3 91.3(4) . 3_545 ?
P7 O23 Be2 145.9(5) . . ?
P7 O23 Cs3 95.4(2) . 2_444 ?
P7 O23 Cs4 91.8(2) . 4_455 ?
Be2 O23 Cs3 102.4(3) . 2_444 ?
Be2 O23 Cs4 118.3(4) . 4_455 ?
Cs3 O23 Cs4 85.17(11) 2_444 4_455 ?
P7 O11 Cs2 119.6(3) 3_545 4_455 ?
P7 O11 Cs2 101.3(2) 3_545 . ?
P7 O11 Be2 143.6(5) 3_545 . ?
Cs2 O11 Cs2 88.17(12) . 4_455 ?
Be2 O11 Cs2 93.9(4) . 4_455 ?
Be2 O11 Cs2 93.0(4) . . ?
P7 O22 Cs3 90.6(2) . 2_444 ?
P7 O22 Cs4 102.9(2) . 4_455 ?
P7 O22 Be4 145.0(5) . 4_454 ?
Cs4 O22 Cs3 87.56(11) 4_455 2_444 ?
Be4 O22 Cs3 109.8(4) 4_454 2_444 ?
Be4 O22 Cs4 106.0(4) 4_454 4_455 ?
P7 O24 Cs2 105.6(2) . 3_545 ?
P7 O24 Cs2 115.8(2) . . ?
P7 O24 Be4 135.5(4) . . ?
Cs2 O24 Cs2 89.90(12) 3_545 . ?
Be4 O24 Cs2 100.4(4) . 3_545 ?
Be4 O24 Cs2 99.5(4) . . ?
Cs2 P1 Cs2 68.96(3) . 4_455 ?
Cs2 P1 Cs4 141.90(5) . . ?
Cs2 P1 Cs4 143.80(5) . 3_556 ?
O2 P1 Cs2 129.31(19) . . ?
O2 P1 Cs2 132.1(2) . 4_455 ?
O2 P1 Cs4 50.26(18) . . ?
O2 P1 Cs4 65.8(2) . 3_556 ?
O7 P1 Cs2 116.7(2) . 4_455 ?
O7 P1 Cs2 57.9(2) . . ?
O7 P1 O2 108.4(3) . . ?
O7 P1 Cs4 86.9(2) . 3_556 ?
O7 P1 Cs4 155.8(2) . . ?
O1 P1 Cs2 129.4(2) . . ?
O1 P1 Cs2 75.69(18) . 4_455 ?
O1 P1 O2 101.2(3) . . ?
O1 P1 O7 113.4(3) . . ?
O1 P1 Cs4 54.02(18) . 3_556 ?
O1 P1 Cs4 67.3(2) . . ?
Cs4 P1 Cs2 129.71(5) 3_556 4_455 ?
Cs4 P1 Cs2 87.25(4) . 4_455 ?
Cs4 P1 Cs4 74.23(3) 3_556 . ?
O8 P1 Cs2 54.2(2) . . ?
O8 P1 Cs2 42.74(19) . 4_455 ?
O8 P1 O2 106.2(3) . . ?
O8 P1 O7 111.4(3) . . ?
O8 P1 O1 115.2(3) . . ?
O8 P1 Cs4 88.0(2) . . ?
O8 P1 Cs4 161.7(2) . 3_556 ?
Cs2 O7 Cs1 91.03(12) . . ?
P1 O7 Cs1 128.0(2) . . ?
P1 O7 Cs2 99.6(2) . . ?
P1 O7 Be1 133.9(4) . . ?
Be1 O7 Cs1 95.0(4) . . ?
Be1 O7 Cs2 94.5(4) . . ?
P1 O1 Be1 146.9(5) . 4_455 ?
P1 O1 Cs4 104.3(2) . 3_556 ?
P1 O1 Cs4 90.6(2) . . ?
Be1 O1 Cs4 106.8(5) 4_455 . ?
Be1 O1 Cs4 104.6(4) 4_455 3_556 ?
Cs4 O1 Cs4 86.53(11) 3_556 . ?
Cs1 Be1 Cs4 142.1(2) . 2_454 ?
Cs2 Be1 Cs1 76.64(17) . . ?
Cs2 Be1 Cs4 141.2(2) . 2_454 ?
O21 Be1 Cs1 85.5(4) 3 . ?
O21 Be1 Cs2 162.1(5) 3 . ?
O21 Be1 O7 110.5(6) 3 . ?
O21 Be1 O1 108.9(6) 3 4_455 ?
O21 Be1 Cs4 56.6(3) 3 2_454 ?
O12 Be1 Cs1 65.9(3) . . ?
O12 Be1 Cs2 60.4(3) . . ?
O12 Be1 O21 112.3(6) . 3 ?
O12 Be1 O7 105.2(6) . . ?
O12 Be1 O1 108.9(6) . 4_455 ?
O12 Be1 Cs4 124.2(5) . 2_454 ?
O7 Be1 Cs1 59.9(3) . . ?
O7 Be1 Cs2 60.2(3) . . ?
O7 Be1 Cs4 130.5(5) . 2_454 ?
O1 Be1 Cs1 165.4(5) 4_455 . ?
O1 Be1 Cs2 88.9(4) 4_455 . ?
O1 Be1 O7 111.1(6) 4_455 . ?
O1 Be1 Cs4 52.4(3) 4_455 2_454 ?
Cs2 Be2 Cs2 75.38(16) . 4_455 ?
Cs2 Be2 Cs3 141.0(3) . 2_444 ?
Cs2 Be2 Cs3 143.6(2) 4_455 2_444 ?
Cs2 Be2 Cs3 87.04(18) 4_455 4_455 ?
Cs2 Be2 Cs3 127.3(3) . 4_455 ?
O6 Be2 Cs2 91.3(4) 4_455 4_455 ?
O6 Be2 Cs2 166.5(5) 4_455 . ?
O6 Be2 Cs3 52.3(3) 4_455 2_444 ?
O6 Be2 Cs3 48.0(3) 4_455 4_455 ?
O6 Be2 O8 110.1(6) 4_455 4_455 ?
O23 Be2 Cs2 87.4(4) . . ?
O23 Be2 Cs2 161.8(5) . 4_455 ?
O23 Be2 O6 106.1(5) . 4_455 ?
O23 Be2 O11 114.8(6) . . ?
O23 Be2 Cs3 108.3(5) . 4_455 ?
O23 Be2 Cs3 53.8(3) . 2_444 ?
O23 Be2 O8 111.6(6) . 4_455 ?
O11 Be2 Cs2 61.0(3) . . ?
O11 Be2 Cs2 61.6(3) . 4_455 ?
O11 Be2 O6 110.8(6) . 4_455 ?
O11 Be2 Cs3 66.9(3) . 4_455 ?
O11 Be2 Cs3 127.6(5) . 2_444 ?
O11 Be2 O8 103.6(5) . 4_455 ?
Cs3 Be2 Cs3 70.42(15) 2_444 4_455 ?
O8 Be2 Cs2 55.9(3) 4_455 4_455 ?
O8 Be2 Cs2 64.5(3) 4_455 . ?
O8 Be2 Cs3 128.7(5) 4_455 2_444 ?
O8 Be2 Cs3 139.0(4) 4_455 4_455 ?
Cs1 Be3 Cs2 76.53(16) 4 4 ?
Cs1 Be3 Cs3 137.9(2) 4 . ?
O13 Be3 Cs1 63.2(3) 4 4 ?
O13 Be3 Cs2 52.8(3) 4 4 ?
O13 Be3 Cs3 132.3(5) 4 . ?
Cs2 Be3 Cs3 145.5(3) 4 . ?
O10 Be3 Cs1 75.8(4) . 4 ?
O10 Be3 O13 109.6(6) . 4 ?
O10 Be3 Cs2 152.0(5) . 4 ?
O10 Be3 Cs3 62.2(3) . . ?
O9 Be3 Cs1 68.8(4) 4 4 ?
O9 Be3 O13 103.8(5) 4 4 ?
O9 Be3 Cs2 61.2(3) 4 4 ?
O9 Be3 O10 111.4(6) 4 . ?
O9 Be3 Cs3 123.3(5) 4 . ?
O17 Be3 Cs1 172.6(5) 2_545 4 ?
O17 Be3 O13 110.9(6) 2_545 4 ?
O17 Be3 Cs2 96.4(4) 2_545 4 ?
O17 Be3 O10 111.1(6) 2_545 . ?
O17 Be3 O9 109.7(7) 2_545 4 ?
O17 Be3 Cs3 49.2(3) 2_545 . ?
O16 Cs3 P3 110.54(8) 2_545 . ?
O16 Cs3 O10 88.49(10) 2_545 . ?
O16 Cs3 O10 66.48(12) 2_545 3_546 ?
O16 Cs3 O17 87.67(12) 2_545 3_545 ?
O10 Cs3 P3 24.17(7) . . ?
O10 Cs3 P3 96.41(8) 3_546 . ?
O10 Cs3 O10 78.40(13) 3_546 . ?
O10 Cs3 O17 71.55(11) . 3_545 ?
O10 Cs3 O17 140.71(10) 3_546 3_545 ?
O18 Cs3 P3 143.44(10) 3_545 . ?
O18 Cs3 O16 77.59(12) 3_545 2_545 ?
O18 Cs3 O10 118.67(12) 3_545 3_546 ?
O18 Cs3 O10 149.66(12) 3_545 . ?
O18 Cs3 O6 115.87(13) 3_545 3_546 ?
O18 Cs3 O6 147.36(12) 3_545 . ?
O18 Cs3 O17 114.28(13) 3_545 2_545 ?
O18 Cs3 O17 80.96(12) 3_545 3_545 ?
O18 Cs3 O23 92.42(13) 3_545 2_445 ?
O18 Cs3 O22 68.78(12) 3_545 2_445 ?
O18 Cs3 O3 57.32(13) 3_545 3_546 ?
O6 Cs3 P3 24.40(8) . . ?
O6 Cs3 P3 96.37(10) 3_546 . ?
O6 Cs3 O16 106.73(13) 3_546 2_545 ?
O6 Cs3 O16 129.91(10) . 2_545 ?
O6 Cs3 O10 41.95(10) . . ?
O6 Cs3 O10 43.02(10) 3_546 3_546 ?
O6 Cs3 O10 91.40(11) . 3_546 ?
O6 Cs3 O10 93.84(12) 3_546 . ?
O6 Cs3 O6 76.60(14) 3_546 . ?
O6 Cs3 O17 82.97(10) . 3_545 ?
O6 Cs3 O17 159.49(12) 3_546 3_545 ?
O6 Cs3 O17 106.12(13) 3_546 2_545 ?
O6 Cs3 O23 48.26(11) 3_546 2_445 ?
O6 Cs3 O22 91.36(11) 3_546 2_445 ?
O6 Cs3 O22 81.42(11) . 2_445 ?
O6 Cs3 O3 64.38(13) 3_546 3_546 ?
O17 Cs3 P3 68.83(8) 2_545 . ?
O17 Cs3 P3 64.38(8) 3_545 . ?
O17 Cs3 O16 42.08(10) 2_545 2_545 ?
O17 Cs3 O10 46.44(10) 2_545 . ?
O17 Cs3 O10 66.35(12) 2_545 3_546 ?
O17 Cs3 O6 88.23(11) 2_545 . ?
O17 Cs3 O17 74.61(14) 2_545 3_545 ?
O17 Cs3 O23 150.79(13) 2_545 2_445 ?
O17 Cs3 O22 157.08(12) 2_545 2_445 ?
O23 Cs3 P3 97.17(10) 2_445 . ?
O23 Cs3 O16 145.55(13) 2_445 2_545 ?
O23 Cs3 O10 91.09(11) 2_445 3_546 ?
O23 Cs3 O10 113.27(12) 2_445 . ?
O23 Cs3 O6 73.38(12) 2_445 . ?
O23 Cs3 O17 123.66(11) 2_445 3_545 ?
O23 Cs3 O22 43.12(11) 2_445 2_445 ?
O22 Cs3 P3 95.05(8) 2_445 . ?
O22 Cs3 O16 146.19(11) 2_445 2_545 ?
O22 Cs3 O10 133.88(11) 2_445 3_546 ?
O22 Cs3 O10 119.19(11) 2_445 . ?
O22 Cs3 O17 83.83(11) 2_445 3_545 ?
O3 Cs3 P3 159.17(10) 3_546 . ?
O3 Cs3 O16 70.50(12) 3_546 2_545 ?
O3 Cs3 O10 141.99(13) 3_546 . ?
O3 Cs3 O10 64.36(12) 3_546 3_546 ?
O3 Cs3 O6 140.54(12) 3_546 . ?
O3 Cs3 O17 107.38(12) 3_546 2_545 ?
O3 Cs3 O17 135.65(12) 3_546 3_545 ?
O3 Cs3 O23 76.34(13) 3_546 2_445 ?
O3 Cs3 O22 93.39(12) 3_546 2_445 ?
O21 Cs4 O21 80.02(13) 4_455 1_556 ?
O21 Cs4 O2 75.97(11) 1_556 3_556 ?
O21 Cs4 O2 85.98(10) 4_455 3_556 ?
O21 Cs4 O1 145.72(10) 1_556 . ?
O21 Cs4 O1 70.01(11) 4_455 . ?
O20 Cs4 O21 94.91(12) 1_556 4_455 ?
O20 Cs4 O21 42.33(10) 1_556 1_556 ?
O20 Cs4 O21 41.98(10) 4_455 4_455 ?
O20 Cs4 O21 90.65(12) 4_455 1_556 ?
O20 Cs4 O20 75.86(14) 1_556 4_455 ?
O20 Cs4 O2 153.24(12) 1_556 . ?
O20 Cs4 O2 116.45(11) 1_556 3_556 ?
O20 Cs4 O2 127.94(11) 4_455 3_556 ?
O20 Cs4 O23 91.87(12) 1_556 4_455 ?
O20 Cs4 O23 75.72(11) 4_455 4_455 ?
O20 Cs4 O1 106.68(12) 1_556 3_556 ?
O20 Cs4 O1 78.26(11) 4_455 . ?
O20 Cs4 O1 153.11(11) 1_556 . ?
O20 Cs4 O3 145.08(12) 4_455 . ?
O20 Cs4 O3 114.89(12) 1_556 . ?
O18 Cs4 O21 150.49(13) 1_556 4_455 ?
O18 Cs4 O21 70.47(12) 1_556 1_556 ?
O18 Cs4 O20 63.33(12) 1_556 1_556 ?
O18 Cs4 O20 136.04(12) 1_556 4_455 ?
O18 Cs4 O2 97.60(12) 1_556 . ?
O18 Cs4 O2 86.67(12) 1_556 3_556 ?
O18 Cs4 O23 89.40(12) 1_556 4_455 ?
O18 Cs4 O1 137.67(12) 1_556 . ?
O18 Cs4 O1 118.12(12) 1_556 3_556 ?
O18 Cs4 O3 54.57(12) 1_556 . ?
O2 Cs4 O21 108.81(12) . 4_455 ?
O2 Cs4 O21 152.25(12) . 1_556 ?
O2 Cs4 O20 113.75(12) . 4_455 ?
O2 Cs4 O2 78.44(14) . 3_556 ?
O2 Cs4 O23 68.13(13) . 4_455 ?
O2 Cs4 O1 85.48(10) 3_556 . ?
O2 Cs4 O1 98.82(13) . 3_556 ?
O2 Cs4 O1 40.10(10) . . ?
O2 Cs4 O3 43.04(11) . . ?
O23 Cs4 O21 134.18(11) 4_455 1_556 ?
O23 Cs4 O21 112.22(11) 4_455 4_455 ?
O23 Cs4 O2 145.49(11) 4_455 3_556 ?
O23 Cs4 O1 74.66(11) 4_455 . ?
O23 Cs4 O3 70.97(12) 4_455 . ?
O22 Cs4 O21 109.55(11) 4_455 4_455 ?
O22 Cs4 O21 90.69(12) 4_455 1_556 ?
O22 Cs4 O20 68.91(12) 4_455 4_455 ?
O22 Cs4 O20 48.36(12) 4_455 1_556 ?
O22 Cs4 O18 71.93(12) 4_455 1_556 ?
O22 Cs4 O2 157.72(11) 4_455 3_556 ?
O22 Cs4 O2 109.80(13) 4_455 . ?
O22 Cs4 O23 43.51(11) 4_455 4_455 ?
O22 Cs4 O1 148.41(12) 4_455 3_556 ?
O22 Cs4 O1 114.43(11) 4_455 . ?
O22 Cs4 O3 93.01(13) 4_455 . ?
O1 Cs4 O21 67.79(12) 3_556 1_556 ?
O1 Cs4 O21 46.13(10) 3_556 4_455 ?
O1 Cs4 O20 87.77(11) 3_556 4_455 ?
O1 Cs4 O2 40.43(10) 3_556 3_556 ?
O1 Cs4 O23 151.47(12) 3_556 4_455 ?
O1 Cs4 O1 79.34(13) 3_556 . ?
O1 Cs4 O3 117.52(12) 3_556 . ?
O3 Cs4 O21 120.19(11) . 1_556 ?
O3 Cs4 O21 150.12(13) . 4_455 ?
O3 Cs4 O2 78.97(12) . 3_556 ?
O3 Cs4 O1 83.10(11) . . ?
Cs2 O8 Cs2 89.44(12) . 4_455 ?
P1 O8 Cs2 119.4(2) . 4_455 ?
P1 O8 Cs2 103.9(2) . . ?
P1 O8 Be2 143.7(5) . 4_455 ?
Be2 O8 Cs2 98.8(4) 4_455 . ?
Be2 O8 Cs2 88.4(3) 4_455 4_455 ?
P2 O3 Cs3 132.4(3) . 3_546 ?
P2 O3 Cs4 102.4(2) . . ?
P2 O3 Li1 135.2(5) . 4 ?
Cs3 O3 Cs4 85.03(13) 3_546 . ?
Li1 O3 Cs3 92.2(4) 4 3_546 ?
Li1 O3 Cs4 82.5(4) 4 . ?
Cs2 Be4 Cs2 72.82(17) 3_545 . ?
Cs2 Be4 Cs3 89.67(19) 3_545 3_545 ?
Cs2 Be4 Cs3 129.7(2) . 3_545 ?
Cs2 Be4 Cs4 144.6(3) 3_545 1_554 ?
O20 Be4 Cs2 161.1(5) . 3_545 ?
O20 Be4 Cs2 88.8(4) . . ?
O20 Be4 O19 109.0(5) . . ?
O20 Be4 Cs3 105.9(4) . 3_545 ?
O20 Be4 Cs4 53.9(3) . 1_554 ?
O19 Be4 Cs2 67.7(3) . 3_545 ?
O19 Be4 Cs2 65.1(4) . . ?
O19 Be4 Cs3 64.6(4) . 3_545 ?
O19 Be4 Cs4 119.6(4) . 1_554 ?
O22 Be4 Cs2 167.0(5) 4_454 . ?
O22 Be4 Cs2 94.2(4) 4_454 3_545 ?
O22 Be4 O20 104.1(6) 4_454 . ?
O22 Be4 O19 111.2(6) 4_454 . ?
O22 Be4 Cs3 48.9(3) 4_454 3_545 ?
O22 Be4 Cs4 50.4(3) 4_454 1_554 ?
O24 Be4 Cs2 56.9(3) . . ?
O24 Be4 Cs2 54.7(3) . 3_545 ?
O24 Be4 O20 111.5(6) . . ?
O24 Be4 O19 105.9(6) . . ?
O24 Be4 O22 115.0(6) . 4_454 ?
O24 Be4 Cs3 142.3(5) . 3_545 ?
O24 Be4 Cs4 134.5(4) . 1_554 ?
Cs4 Be4 Cs2 142.6(2) 1_554 . ?
Cs4 Be4 Cs3 67.29(16) 1_554 3_545 ?
Cs1 Li1 Cs1 133.3(2) . 2_554 ?
Cs1 Li1 Cs1 65.89(16) 3 2_554 ?
Cs1 Li1 Cs1 67.49(17) 3 . ?
P5 Li1 Cs1 59.2(2) 4_554 2_554 ?
P5 Li1 Cs1 111.5(3) 4_554 3 ?
P5 Li1 Cs1 142.4(3) 4_554 . ?
P5 Li1 Cs3 71.0(2) 4_554 2_544 ?
P5 Li1 Cs4 77.8(2) 4_554 4 ?
O4 Li1 Cs1 44.3(3) 2_554 2_554 ?
O4 Li1 Cs1 56.0(3) 2_554 3 ?
O4 Li1 Cs1 107.4(5) 2_554 . ?
O4 Li1 P5 100.7(5) 2_554 4_554 ?
O4 Li1 O18 109.5(6) 2_554 4_554 ?
O4 Li1 O15 103.3(5) 2_554 . ?
O4 Li1 Cs3 158.3(5) 2_554 2_544 ?
O4 Li1 Cs4 85.7(4) 2_554 4 ?
O4 Li1 O3 118.4(7) 2_554 4 ?
O18 Li1 Cs1 136.2(5) 4_554 3 ?
O18 Li1 Cs1 76.5(4) 4_554 2_554 ?
O18 Li1 Cs1 143.1(4) 4_554 . ?
O18 Li1 P5 25.1(2) 4_554 4_554 ?
O18 Li1 Cs3 54.9(3) 4_554 2_544 ?
O18 Li1 Cs4 56.7(3) 4_554 4 ?
O15 Li1 Cs1 47.8(3) . 3 ?
O15 Li1 Cs1 94.2(4) . 2_554 ?
O15 Li1 Cs1 51.1(4) . . ?
O15 Li1 P5 98.7(5) . 4_554 ?
O15 Li1 O18 117.6(7) . 4_554 ?
O15 Li1 Cs3 97.8(4) . 2_544 ?
O15 Li1 Cs4 170.9(5) . 4 ?
O15 Li1 O3 109.8(6) . 4 ?
Cs3 Li1 Cs1 89.6(2) 2_544 . ?
Cs3 Li1 Cs1 129.9(3) 2_544 2_554 ?
Cs3 Li1 Cs1 145.6(3) 2_544 3 ?
Cs4 Li1 Cs1 91.2(2) 4 2_554 ?
Cs4 Li1 Cs1 128.0(3) 4 . ?
Cs4 Li1 Cs1 141.3(3) 4 3 ?
Cs4 Li1 Cs3 73.08(19) 4 2_544 ?
O3 Li1 Cs1 63.4(4) 4 . ?
O3 Li1 Cs1 154.5(5) 4 2_554 ?
O3 Li1 Cs1 124.7(5) 4 3 ?
O3 Li1 P5 122.6(5) 4 4_554 ?
O3 Li1 O18 98.9(5) 4 4_554 ?
O3 Li1 Cs3 56.9(3) 4 2_544 ?
O3 Li1 Cs4 66.2(3) 4 4 ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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. 
# 
#######################################################################

data_RbLiPO
_database_code_depnum_ccdc_archive 'CCDC 1969311'
loop_
_audit_author_name
_audit_author_address
'Yi-Gang Chen'
;Shanxi Normal University
China
;
_audit_update_record             
;
2020-06-17 deposited with the CCDC.	2020-06-29 downloaded from the CCDC.
;
_audit_creation_date             2019-12-02
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.03(Li32 O192 P64 Rb32)'
_chemical_formula_sum            'Li O6 P2 Rb'
_chemical_formula_weight         250.35
_chemical_absolute_configuration ?
_chemical_melting_point          ?
_chemical_oxdiff_formula         'Li Rb P O '
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Li Li -0.0003 0.0001 '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'
Rb Rb -0.9393 2.9676 '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           43
_space_group_name_H-M_alt        'F d d 2'
_space_group_name_Hall           'F 2 -2d'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'-x+1/4, y+1/4, z+1/4'
'x+1/4, -y+1/4, z+1/4'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'-x+1/4, y+3/4, z+3/4'
'x+1/4, -y+3/4, z+3/4'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'-x+3/4, y+1/4, z+3/4'
'x+3/4, -y+1/4, z+3/4'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'-x+3/4, y+3/4, z+1/4'
'x+3/4, -y+3/4, z+1/4'

_cell_length_a                   19.0884(6)
_cell_length_b                   18.5701(6)
_cell_length_c                   13.0448(4)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     4624.1(2)
_cell_formula_units_Z            32
_cell_measurement_reflns_used    6316
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      29.1950
_cell_measurement_theta_min      3.7100
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    9.078
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.50243
_exptl_absorpt_correction_type   multi-scan
_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   ?
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.877
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             3776
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.13
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0559
_diffrn_reflns_av_unetI/netI     0.0320
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.950
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            17747
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.911
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         29.265
_diffrn_reflns_theta_min         3.061
_diffrn_ambient_temperature      293(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.0251
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.950
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω     25.00  70.00   1.00   11.87    --   15.68  57.00   0.00   45
  2  ω     -4.00  80.00   1.00   11.87    --   15.68  77.00 -90.00   84
  3  ω    -19.00  22.00   1.00   11.87    --   15.68 100.00  83.00   41
  4  ω    -56.00  45.00   1.00   11.87    --   15.68 -19.00 150.00  101
  5  ω    -24.00  55.00   1.00   11.87    --   15.68 -99.00 120.00   79
  6  ω    -68.00 -35.00   1.00   11.87    --  -17.25-178.00-150.00   33
  7  ω    -86.00   2.00   1.00   11.87    --  -17.25 -37.00  60.00   88
  8  ω    -86.00   2.00   1.00   11.87    --  -17.25 -37.00 150.00   88
  9  ω    -66.00   5.00   1.00   11.87    --  -17.25 116.00 -24.93   71
 10  ω    -74.00  -1.00   1.00   11.87    --  -17.25 130.00-172.99   73
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0302142000
_diffrn_orient_matrix_UB_12      0.0205655000
_diffrn_orient_matrix_UB_13      0.0119790000
_diffrn_orient_matrix_UB_21      -0.0184227000
_diffrn_orient_matrix_UB_22      -0.0320465000
_diffrn_orient_matrix_UB_23      0.0122049000
_diffrn_orient_matrix_UB_31      0.0113539000
_diffrn_orient_matrix_UB_32      0.0028281000
_diffrn_orient_matrix_UB_33      0.0516246000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.842
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.869
_reflns_number_gt                2682
_reflns_number_total             2875
_reflns_odcompleteness_completeness 99.77
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.41 (Rigaku OD, 2015)'
_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    'ShelXD (Sheldrick, 2008)'
_refine_diff_density_max         0.742
_refine_diff_density_min         -0.600
_refine_diff_density_rms         0.125
_refine_ls_abs_structure_details 
;
 Flack x determined using 1118 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.011(4)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.069
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     181
_refine_ls_number_reflns         2875
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0389
_refine_ls_R_factor_gt           0.0352
_refine_ls_restrained_S_all      1.069
_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)+(0.0516P)²+2.5257P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0829
_refine_ls_wR_factor_ref         0.0852
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   none
_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
Rb1 Rb 0.37848(3) 0.25256(4) 0.02770(6) 0.03473(19) Uani 1 1 d . . . . .
Rb2 Rb 0.48179(5) 0.12803(4) -0.23552(6) 0.0405(2) Uani 1 1 d . . . . .
P3 P 0.25270(9) 0.08154(8) 0.02840(15) 0.0227(3) Uani 1 1 d . . . . .
P1 P 0.59484(9) 0.26253(9) 0.03780(13) 0.0223(3) Uani 1 1 d . . . . .
P4 P 0.36358(9) 0.22912(10) 0.31846(14) 0.0238(3) Uani 1 1 d . . . . .
O6 O 0.4706(3) 0.1086(3) -0.0141(4) 0.0308(11) Uani 1 1 d . . . . .
O8 O 0.4909(2) 0.1607(3) 0.1567(3) 0.0278(10) Uani 1 1 d . . . . .
P2 P 0.52695(9) 0.11981(8) 0.06298(12) 0.0202(3) Uani 1 1 d . . . . .
O10 O 0.5814(2) 0.1786(2) 0.0182(4) 0.0360(12) Uani 1 1 d . . . . .
O11 O 0.6409(3) 0.2816(3) -0.0599(4) 0.0353(12) Uani 1 1 d . . . . .
O7 O 0.5273(2) 0.3010(3) 0.0338(5) 0.0353(11) Uani 1 1 d . . . . .
O12 O 0.6434(3) 0.2727(3) 0.1236(4) 0.0430(14) Uani 1 1 d . . . . .
O9 O 0.5691(3) 0.0576(3) 0.0985(3) 0.0314(10) Uani 1 1 d . . . . .
O4 O 0.1963(2) 0.0183(3) 0.0470(4) 0.0291(10) Uani 1 1 d . . . . .
O3 O 0.2314(3) 0.1486(3) 0.0811(4) 0.0305(11) Uani 1 1 d . . . . .
O5 O 0.3213(3) 0.0486(3) 0.0504(4) 0.0399(13) Uani 1 1 d . . . . .
O1 O 0.3320(3) 0.1644(3) 0.2719(5) 0.0441(13) Uani 1 1 d . . . . .
O2 O 0.3373(3) 0.3019(3) 0.2924(6) 0.0548(17) Uani 1 1 d . . . . .
Li2 Li 0.2622(6) 0.3523(6) 0.2302(9) 0.028(2) Uani 1 1 d . . . . .
Li1 Li 0.5903(6) -0.0217(6) 0.0030(8) 0.026(2) 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
Rb1 P4 3.828(2) . ?
Rb1 O6 3.246(5) . ?
Rb1 O8 3.217(5) . ?
Rb1 P2 3.7841(18) . ?
Rb1 O7 2.981(5) . ?
Rb1 O9 2.827(5) 12_454 ?
Rb1 O3 2.873(5) 14 ?
Rb1 O3 3.477(5) . ?
Rb1 O5 3.231(5) 11_554 ?
Rb1 O1 3.100(6) 11_554 ?
Rb1 Li2 3.764(13) 8_554 ?
Rb1 Li1 3.675(11) 12_454 ?
Rb2 O6 2.918(5) . ?
Rb2 O10 3.057(5) 12_454 ?
Rb2 O11 3.170(5) 7_644 ?
Rb2 O11 3.569(6) 12_454 ?
Rb2 O7 3.290(6) 6_654 ?
Rb2 O12 3.565(7) 12_454 ?
Rb2 O12 3.395(6) 7_644 ?
Rb2 O12 3.534(7) 6_654 ?
Rb2 O9 3.503(5) 12_454 ?
Rb2 O4 2.974(5) 11_554 ?
Rb2 O5 3.358(6) 11_554 ?
Rb2 O2 3.483(7) 15_544 ?
P3 Rb1 3.9700(17) 14 ?
P3 Rb2 3.7952(18) 15_545 ?
P3 O8 1.610(5) 12_454 ?
P3 O4 1.612(5) . ?
P3 O3 1.480(5) . ?
P3 O5 1.474(5) . ?
P3 Li2 2.919(13) 14 ?
P1 Rb2 3.8747(19) 6_655 ?
P1 Rb2 3.7067(18) 4 ?
P1 Rb2 3.9552(19) 3_655 ?
P1 O10 1.601(5) . ?
P1 O11 1.588(5) . ?
P1 O7 1.475(5) . ?
P1 O12 1.466(5) . ?
P1 Li2 3.057(11) 8_554 ?
P4 Rb2 4.031(2) 6_655 ?
P4 O11 1.601(5) 6_655 ?
P4 O4 1.604(5) 4 ?
P4 O1 1.475(5) . ?
P4 O2 1.481(6) . ?
P4 Li2 3.063(12) 14 ?
O6 P2 1.487(5) . ?
O6 Li1 2.002(13) 2_655 ?
O8 P3 1.610(5) 4 ?
O8 P2 1.595(5) . ?
P2 Rb2 3.9612(18) 4 ?
P2 O10 1.616(5) . ?
P2 O9 1.483(5) . ?
P2 Li1 2.990(12) 2_655 ?
P2 Li1 2.996(11) . ?
O10 Rb2 3.057(5) 4 ?
O11 Rb2 3.171(5) 3_655 ?
O11 Rb2 3.569(6) 4 ?
O11 P4 1.601(5) 6_654 ?
O7 Rb2 3.290(6) 6_655 ?
O7 Li2 1.947(12) 8_554 ?
O12 Rb2 3.395(6) 3_655 ?
O12 Rb2 3.534(7) 6_655 ?
O12 Rb2 3.564(7) 4 ?
O12 Li1 1.903(12) 3_655 ?
O9 Rb1 2.827(5) 4 ?
O9 Rb2 3.503(5) 4 ?
O9 Li1 1.970(12) . ?
O4 Rb2 2.974(5) 15_545 ?
O4 P4 1.604(5) 12_454 ?
O3 Rb1 2.873(5) 14 ?
O3 Li2 1.949(14) 14 ?
O5 Rb1 3.231(5) 15_545 ?
O5 Rb2 3.358(6) 15_545 ?
O5 Li1 1.866(13) 2_655 ?
O1 Rb1 3.100(6) 15_545 ?
O1 Li2 1.905(13) 14 ?
O2 Rb2 3.483(7) 11 ?
O2 Li2 1.894(14) . ?
Li2 Rb1 3.764(13) 16_455 ?
Li2 Rb1 4.242(11) 14 ?
Li2 Rb2 3.740(12) 11 ?
Li2 P3 2.919(13) 14 ?
Li2 P1 3.057(11) 16_455 ?
Li2 P4 3.063(12) 14 ?
Li2 O7 1.947(12) 16_455 ?
Li2 O3 1.949(14) 14 ?
Li2 O1 1.905(13) 14 ?
Li1 Rb1 4.341(11) 2_655 ?
Li1 Rb1 3.675(11) 4 ?
Li1 Rb2 3.799(12) 4 ?
Li1 Rb2 3.933(12) 2_655 ?
Li1 O6 2.002(13) 2_655 ?
Li1 P2 2.990(12) 2_655 ?
Li1 O12 1.903(12) 7_644 ?
Li1 O5 1.866(13) 2_655 ?
Li1 Li1 3.54(2) 2_655 ?

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
O6 Rb1 P4 96.50(9) . . ?
O6 Rb1 P2 22.82(9) . . ?
O6 Rb1 O3 90.80(12) . . ?
O6 Rb1 Li2 101.2(2) . 8_554 ?
O6 Rb1 Li1 91.3(2) . 12_454 ?
O8 Rb1 P4 58.07(8) . . ?
O8 Rb1 O6 44.74(12) . . ?
O8 Rb1 P2 24.66(8) . . ?
O8 Rb1 O3 98.01(12) . . ?
O8 Rb1 O5 114.98(13) . 11_554 ?
O8 Rb1 Li2 90.8(2) . 8_554 ?
O8 Rb1 Li1 133.9(2) . 12_454 ?
P2 Rb1 P4 82.02(4) . . ?
O7 Rb1 P4 94.52(12) . . ?
O7 Rb1 O6 74.74(13) . . ?
O7 Rb1 O8 60.68(14) . . ?
O7 Rb1 P2 58.65(9) . . ?
O7 Rb1 O3 158.68(13) . . ?
O7 Rb1 O5 70.24(14) . 11_554 ?
O7 Rb1 O1 58.40(13) . 11_554 ?
O7 Rb1 Li2 30.9(2) . 8_554 ?
O7 Rb1 Li1 100.7(2) . 12_454 ?
O9 Rb1 P4 138.12(10) 12_454 . ?
O9 Rb1 O6 75.69(13) 12_454 . ?
O9 Rb1 O8 119.36(14) 12_454 . ?
O9 Rb1 P2 98.24(11) 12_454 . ?
O9 Rb1 O7 121.53(15) 12_454 . ?
O9 Rb1 O3 99.22(15) 12_454 14 ?
O9 Rb1 O3 67.87(13) 12_454 . ?
O9 Rb1 O5 57.62(14) 12_454 11_554 ?
O9 Rb1 O1 117.41(15) 12_454 11_554 ?
O9 Rb1 Li2 114.7(2) 12_454 8_554 ?
O9 Rb1 Li1 32.0(2) 12_454 12_454 ?
O3 Rb1 P4 71.23(9) . . ?
O3 Rb1 P4 77.17(11) 14 . ?
O3 Rb1 O6 164.23(13) 14 . ?
O3 Rb1 O8 134.35(13) 14 . ?
O3 Rb1 P2 102.63(9) . . ?
O3 Rb1 P2 158.97(11) 14 . ?
O3 Rb1 O7 119.78(14) 14 . ?
O3 Rb1 O3 73.52(15) 14 . ?
O3 Rb1 O5 105.69(15) 14 11_554 ?
O3 Rb1 O1 64.18(13) 14 11_554 ?
O3 Rb1 Li2 94.5(2) 14 8_554 ?
O3 Rb1 Li2 168.0(2) . 8_554 ?
O3 Rb1 Li1 95.1(2) . 12_454 ?
O3 Rb1 Li1 91.7(2) 14 12_454 ?
O5 Rb1 P4 164.00(10) 11_554 . ?
O5 Rb1 O6 84.43(14) 11_554 . ?
O5 Rb1 P2 93.54(11) 11_554 . ?
O5 Rb1 O3 124.76(12) 11_554 . ?
O5 Rb1 Li2 57.2(2) 11_554 8_554 ?
O5 Rb1 Li1 30.5(2) 11_554 12_454 ?
O1 Rb1 P4 98.76(11) 11_554 . ?
O1 Rb1 O6 131.50(13) 11_554 . ?
O1 Rb1 O8 111.38(14) 11_554 . ?
O1 Rb1 P2 116.89(10) 11_554 . ?
O1 Rb1 O3 137.69(12) 11_554 . ?
O1 Rb1 O5 69.46(16) 11_554 11_554 ?
O1 Rb1 Li2 30.3(2) 11_554 8_554 ?
O1 Rb1 Li1 86.0(2) 11_554 12_454 ?
Li2 Rb1 P4 107.15(19) 8_554 . ?
Li2 Rb1 P2 88.76(18) 8_554 . ?
Li1 Rb1 P4 164.27(18) 12_454 . ?
Li1 Rb1 P2 109.28(18) 12_454 . ?
Li1 Rb1 Li2 84.6(3) 12_454 8_554 ?
O6 Rb2 O10 82.71(15) . 12_454 ?
O6 Rb2 O11 97.51(13) . 12_454 ?
O6 Rb2 O11 106.81(14) . 7_644 ?
O6 Rb2 O7 161.97(13) . 6_654 ?
O6 Rb2 O12 121.97(13) . 6_654 ?
O6 Rb2 O12 58.19(13) . 12_454 ?
O6 Rb2 O12 64.22(14) . 7_644 ?
O6 Rb2 O9 70.59(12) . 12_454 ?
O6 Rb2 O4 90.05(14) . 11_554 ?
O6 Rb2 O5 87.50(14) . 11_554 ?
O6 Rb2 O2 138.17(13) . 15_544 ?
O10 Rb2 O11 122.03(14) 12_454 7_644 ?
O10 Rb2 O11 42.48(12) 12_454 12_454 ?
O10 Rb2 O7 95.88(13) 12_454 6_654 ?
O10 Rb2 O12 43.91(13) 12_454 12_454 ?
O10 Rb2 O12 117.00(14) 12_454 7_644 ?
O10 Rb2 O12 63.41(13) 12_454 6_654 ?
O10 Rb2 O9 43.97(12) 12_454 12_454 ?
O10 Rb2 O5 92.20(12) 12_454 11_554 ?
O10 Rb2 O2 61.19(14) 12_454 15_544 ?
O11 Rb2 O11 79.64(14) 7_644 12_454 ?
O11 Rb2 O7 89.24(13) 7_644 6_654 ?
O11 Rb2 O12 42.72(12) 7_644 7_644 ?
O11 Rb2 O12 92.38(15) 7_644 12_454 ?
O11 Rb2 O12 130.84(13) 7_644 6_654 ?
O11 Rb2 O9 165.43(14) 7_644 12_454 ?
O11 Rb2 O5 143.78(14) 7_644 11_554 ?
O11 Rb2 O2 78.83(14) 7_644 15_544 ?
O7 Rb2 O11 93.34(12) 6_654 12_454 ?
O7 Rb2 O12 130.66(13) 6_654 7_644 ?
O7 Rb2 O12 43.93(12) 6_654 6_654 ?
O7 Rb2 O12 130.92(12) 6_654 12_454 ?
O7 Rb2 O9 95.89(11) 6_654 12_454 ?
O7 Rb2 O5 74.57(12) 6_654 11_554 ?
O7 Rb2 O2 51.82(12) 6_654 15_544 ?
O12 Rb2 O11 88.65(14) 7_644 12_454 ?
O12 Rb2 O11 39.33(11) 12_454 12_454 ?
O12 Rb2 O11 87.89(13) 6_654 12_454 ?
O12 Rb2 O12 107.29(5) 6_654 12_454 ?
O12 Rb2 O12 173.30(15) 7_644 6_654 ?
O12 Rb2 O12 73.26(17) 7_644 12_454 ?
O12 Rb2 O9 133.41(12) 7_644 12_454 ?
O12 Rb2 O2 112.36(15) 7_644 15_544 ?
O9 Rb2 O11 86.44(11) 12_454 12_454 ?
O9 Rb2 O12 52.05(11) 12_454 6_654 ?
O9 Rb2 O12 73.96(12) 12_454 12_454 ?
O4 Rb2 O10 137.05(14) 11_554 12_454 ?
O4 Rb2 O11 172.03(13) 11_554 12_454 ?
O4 Rb2 O11 100.63(15) 11_554 7_644 ?
O4 Rb2 O7 78.70(12) 11_554 6_654 ?
O4 Rb2 O12 96.95(15) 11_554 7_644 ?
O4 Rb2 O12 148.09(13) 11_554 12_454 ?
O4 Rb2 O12 85.96(13) 11_554 6_654 ?
O4 Rb2 O9 93.75(12) 11_554 12_454 ?
O4 Rb2 O5 45.07(13) 11_554 11_554 ?
O4 Rb2 O2 130.46(13) 11_554 15_544 ?
O5 Rb2 O11 132.41(11) 11_554 12_454 ?
O5 Rb2 O12 134.16(15) 11_554 7_644 ?
O5 Rb2 O12 51.41(13) 11_554 6_654 ?
O5 Rb2 O12 122.81(13) 11_554 12_454 ?
O5 Rb2 O9 50.70(12) 11_554 12_454 ?
O5 Rb2 O2 112.63(14) 11_554 15_544 ?
O2 Rb2 O11 41.63(13) 15_544 12_454 ?
O2 Rb2 O12 61.54(14) 15_544 6_654 ?
O2 Rb2 O12 80.46(13) 15_544 12_454 ?
O2 Rb2 O9 93.64(13) 15_544 12_454 ?
Rb1 P3 Rb1 76.19(3) 14 . ?
Rb2 P3 Rb1 138.35(5) 15_545 . ?
Rb2 P3 Rb1 145.27(5) 15_545 14 ?
O8 P3 Rb1 90.60(18) 12_454 . ?
O8 P3 Rb1 80.8(2) 12_454 14 ?
O8 P3 Rb2 93.0(2) 12_454 15_545 ?
O8 P3 O4 96.9(2) 12_454 . ?
O8 P3 Li2 146.9(3) 12_454 14 ?
O4 P3 Rb1 169.92(19) . . ?
O4 P3 Rb1 98.32(18) . 14 ?
O4 P3 Rb2 48.20(17) . 15_545 ?
O4 P3 Li2 96.1(3) . 14 ?
O3 P3 Rb1 34.4(2) . 14 ?
O3 P3 Rb1 59.7(2) . . ?
O3 P3 Rb2 151.9(2) . 15_545 ?
O3 P3 O8 110.2(3) . 12_454 ?
O3 P3 O4 111.1(3) . . ?
O3 P3 Li2 36.8(3) . 14 ?
O5 P3 Rb1 152.0(3) . 14 ?
O5 P3 Rb1 78.2(2) . . ?
O5 P3 Rb2 61.7(2) . 15_545 ?
O5 P3 O8 110.7(3) . 12_454 ?
O5 P3 O4 105.2(3) . . ?
O5 P3 O3 120.2(3) . . ?
O5 P3 Li2 94.9(3) . 14 ?
Li2 P3 Rb1 67.3(3) 14 14 ?
Li2 P3 Rb1 74.1(2) 14 . ?
Li2 P3 Rb2 118.0(2) 14 15_545 ?
Rb2 P1 Rb2 134.29(5) 4 6_655 ?
Rb2 P1 Rb2 95.17(4) 6_655 3_655 ?
Rb2 P1 Rb2 77.61(4) 4 3_655 ?
O10 P1 Rb2 130.54(18) . 3_655 ?
O10 P1 Rb2 124.9(2) . 6_655 ?
O10 P1 Rb2 54.12(18) . 4 ?
O10 P1 Li2 132.7(3) . 8_554 ?
O11 P1 Rb2 134.8(2) . 6_655 ?
O11 P1 Rb2 72.6(2) . 4 ?
O11 P1 Rb2 49.77(19) . 3_655 ?
O11 P1 O10 100.2(3) . . ?
O11 P1 Li2 84.6(3) . 8_554 ?
O7 P1 Rb2 162.7(2) . 4 ?
O7 P1 Rb2 56.2(2) . 6_655 ?
O7 P1 Rb2 117.8(2) . 3_655 ?
O7 P1 O10 109.0(3) . . ?
O7 P1 O11 110.3(3) . . ?
O7 P1 Li2 31.0(3) . 8_554 ?
O12 P1 Rb2 73.0(3) . 4 ?
O12 P1 Rb2 57.3(2) . 3_655 ?
O12 P1 Rb2 65.7(3) . 6_655 ?
O12 P1 O10 110.4(4) . . ?
O12 P1 O11 103.5(3) . . ?
O12 P1 O7 121.2(4) . . ?
O12 P1 Li2 114.1(4) . 8_554 ?
Li2 P1 Rb2 157.2(2) 8_554 4 ?
Li2 P1 Rb2 88.1(2) 8_554 3_655 ?
Li2 P1 Rb2 64.0(2) 8_554 6_655 ?
Rb1 P4 Rb2 72.40(4) . 6_655 ?
O11 P4 Rb1 178.7(2) 6_655 . ?
O11 P4 Rb2 107.11(19) 6_655 6_655 ?
O11 P4 O4 103.3(3) 6_655 4 ?
O11 P4 Li2 105.6(3) 6_655 14 ?
O4 P4 Rb1 75.55(19) 4 . ?
O4 P4 Rb2 39.55(18) 4 6_655 ?
O4 P4 Li2 136.1(3) 4 14 ?
O1 P4 Rb1 73.5(3) . . ?
O1 P4 Rb2 139.8(3) . 6_655 ?
O1 P4 O11 106.5(3) . 6_655 ?
O1 P4 O4 110.8(3) . 4 ?
O1 P4 O2 120.7(4) . . ?
O1 P4 Li2 28.7(3) . 14 ?
O2 P4 Rb1 72.2(3) . . ?
O2 P4 Rb2 66.9(3) . 6_655 ?
O2 P4 O11 108.8(4) . 6_655 ?
O2 P4 O4 105.4(3) . 4 ?
O2 P4 Li2 95.6(4) . 14 ?
Li2 P4 Rb1 75.1(2) 14 . ?
Li2 P4 Rb2 146.5(2) 14 6_655 ?
Rb2 O6 Rb1 95.98(15) . . ?
P2 O6 Rb1 99.4(2) . . ?
P2 O6 Rb2 126.8(3) . . ?
P2 O6 Li1 117.2(4) . 2_655 ?
Li1 O6 Rb1 109.3(4) 2_655 . ?
Li1 O6 Rb2 104.6(4) 2_655 . ?
P3 O8 Rb1 124.2(2) 4 . ?
P2 O8 Rb1 98.0(2) . . ?
P2 O8 P3 137.6(3) . 4 ?
Rb1 P2 Rb2 72.23(4) . . ?
Rb1 P2 Rb2 135.50(5) . 4 ?
Rb2 P2 Rb2 93.27(4) 4 . ?
O6 P2 Rb1 57.8(2) . . ?
O6 P2 Rb2 35.8(2) . . ?
O6 P2 Rb2 127.4(2) . 4 ?
O6 P2 O8 105.9(3) . . ?
O6 P2 O10 108.4(3) . . ?
O6 P2 Li1 89.6(3) . . ?
O6 P2 Li1 36.5(3) . 2_655 ?
O8 P2 Rb1 57.33(17) . . ?
O8 P2 Rb2 122.90(19) . 4 ?
O8 P2 Rb2 129.53(18) . . ?
O8 P2 O10 103.5(3) . . ?
O8 P2 Li1 99.7(3) . 2_655 ?
O8 P2 Li1 142.3(3) . . ?
O10 P2 Rb1 89.89(19) . . ?
O10 P2 Rb2 76.1(2) . . ?
O10 P2 Rb2 45.61(18) . 4 ?
O10 P2 Li1 142.9(3) . 2_655 ?
O10 P2 Li1 103.8(3) . . ?
O9 P2 Rb1 162.3(2) . . ?
O9 P2 Rb2 116.87(19) . . ?
O9 P2 Rb2 61.4(2) . 4 ?
O9 P2 O6 119.7(3) . . ?
O9 P2 O8 111.4(3) . . ?
O9 P2 O10 106.8(3) . . ?
O9 P2 Li1 34.8(3) . . ?
O9 P2 Li1 90.7(3) . 2_655 ?
Li1 P2 Rb1 78.7(2) 2_655 . ?
Li1 P2 Rb1 147.3(2) . . ?
Li1 P2 Rb2 134.7(2) 2_655 4 ?
Li1 P2 Rb2 66.8(2) 2_655 . ?
Li1 P2 Rb2 64.5(2) . 4 ?
Li1 P2 Rb2 82.3(2) . . ?
Li1 P2 Li1 72.5(4) 2_655 . ?
P1 O10 Rb2 100.8(2) . 4 ?
P1 O10 P2 134.6(3) . . ?
P2 O10 Rb2 112.2(2) . 4 ?
Rb2 O11 Rb2 90.77(13) 3_655 4 ?
P1 O11 Rb2 82.3(2) . 4 ?
P1 O11 Rb2 107.7(2) . 3_655 ?
P1 O11 P4 137.5(3) . 6_654 ?
P4 O11 Rb2 114.5(2) 6_654 3_655 ?
P4 O11 Rb2 101.1(3) 6_654 4 ?
Rb1 O7 Rb2 95.44(14) . 6_655 ?
P1 O7 Rb1 133.4(3) . . ?
P1 O7 Rb2 102.0(3) . 6_655 ?
P1 O7 Li2 126.0(5) . 8_554 ?
Li2 O7 Rb1 97.4(4) 8_554 . ?
Li2 O7 Rb2 87.2(4) 8_554 6_655 ?
Rb2 O12 Rb2 159.62(19) 6_655 4 ?
Rb2 O12 Rb2 87.30(16) 3_655 4 ?
Rb2 O12 Rb2 113.07(18) 3_655 6_655 ?
P1 O12 Rb2 92.1(3) . 6_655 ?
P1 O12 Rb2 101.4(3) . 3_655 ?
P1 O12 Rb2 83.9(3) . 4 ?
P1 O12 Li1 136.5(5) . 3_655 ?
Li1 O12 Rb2 120.4(4) 3_655 3_655 ?
Li1 O12 Rb2 86.4(4) 3_655 4 ?
Li1 O12 Rb2 82.9(4) 3_655 6_655 ?
Rb1 O9 Rb2 92.21(14) 4 4 ?
P2 O9 Rb1 141.6(3) . 4 ?
P2 O9 Rb2 96.7(2) . 4 ?
P2 O9 Li1 119.7(4) . . ?
Li1 O9 Rb1 98.4(4) . 4 ?
Li1 O9 Rb2 82.9(4) . 4 ?
P3 O4 Rb2 108.0(2) . 15_545 ?
P4 O4 Rb2 120.4(2) 12_454 15_545 ?
P4 O4 P3 131.4(3) 12_454 . ?
Rb1 O3 Rb1 100.74(14) 14 . ?
P3 O3 Rb1 128.7(3) . 14 ?
P3 O3 Rb1 98.8(2) . . ?
P3 O3 Li2 116.1(5) . 14 ?
Li2 O3 Rb1 107.1(4) 14 14 ?
Li2 O3 Rb1 98.9(4) 14 . ?
Rb1 O5 Rb2 88.18(15) 15_545 15_545 ?
P3 O5 Rb1 123.5(3) . 15_545 ?
P3 O5 Rb2 95.5(3) . 15_545 ?
P3 O5 Li1 148.3(5) . 2_655 ?
Li1 O5 Rb1 88.0(4) 2_655 15_545 ?
Li1 O5 Rb2 88.5(4) 2_655 15_545 ?
P4 O1 Rb1 132.9(3) . 15_545 ?
P4 O1 Li2 129.5(5) . 14 ?
Li2 O1 Rb1 94.5(4) 14 15_545 ?
P4 O2 Rb2 107.9(3) . 11 ?
P4 O2 Li2 143.7(5) . . ?
Li2 O2 Rb2 82.5(4) . 11 ?
Rb1 Li2 Rb1 90.1(3) 16_455 14 ?
Rb1 Li2 Rb1 146.5(4) 16_455 . ?
Rb1 Li2 Rb1 73.8(2) . 14 ?
Rb2 Li2 Rb1 135.4(3) 11 . ?
Rb2 Li2 Rb1 76.5(2) 11 16_455 ?
Rb2 Li2 Rb1 134.1(3) 11 14 ?
P3 Li2 Rb1 64.5(2) 14 14 ?
P3 Li2 Rb1 69.3(3) 14 . ?
P3 Li2 Rb1 77.3(3) 14 16_455 ?
P3 Li2 Rb2 147.5(4) 14 11 ?
P3 Li2 P1 85.8(3) 14 16_455 ?
P3 Li2 P4 118.0(4) 14 14 ?
P1 Li2 Rb1 73.8(3) 16_455 16_455 ?
P1 Li2 Rb1 105.2(3) 16_455 . ?
P1 Li2 Rb1 148.9(4) 16_455 14 ?
P1 Li2 Rb2 68.7(2) 16_455 11 ?
P1 Li2 P4 135.8(4) 16_455 14 ?
P4 Li2 Rb1 117.7(3) 14 . ?
P4 Li2 Rb1 60.70(19) 14 14 ?
P4 Li2 Rb1 76.1(3) 14 16_455 ?
P4 Li2 Rb2 73.4(3) 14 11 ?
O7 Li2 Rb1 126.5(5) 16_455 . ?
O7 Li2 Rb1 137.7(5) 16_455 14 ?
O7 Li2 Rb1 51.8(3) 16_455 16_455 ?
O7 Li2 Rb2 61.5(4) 16_455 11 ?
O7 Li2 P3 87.1(5) 16_455 14 ?
O7 Li2 P1 23.0(2) 16_455 16_455 ?
O7 Li2 P4 115.9(5) 16_455 14 ?
O7 Li2 O3 110.9(6) 16_455 14 ?
O3 Li2 Rb1 44.5(3) 14 . ?
O3 Li2 Rb1 54.1(3) 14 14 ?
O3 Li2 Rb1 102.3(5) 14 16_455 ?
O3 Li2 Rb2 171.4(5) 14 11 ?
O3 Li2 P3 27.1(2) 14 14 ?
O3 Li2 P1 102.8(5) 14 16_455 ?
O3 Li2 P4 114.8(5) 14 14 ?
O1 Li2 Rb1 130.6(5) 14 . ?
O1 Li2 Rb1 55.2(4) 14 16_455 ?
O1 Li2 Rb1 60.3(4) 14 14 ?
O1 Li2 Rb2 76.5(4) 14 11 ?
O1 Li2 P3 103.5(5) 14 14 ?
O1 Li2 P1 123.4(6) 14 16_455 ?
O1 Li2 P4 21.8(2) 14 14 ?
O1 Li2 O7 100.8(6) 14 16_455 ?
O1 Li2 O3 110.0(6) 14 14 ?
O2 Li2 Rb1 142.8(5) . 16_455 ?
O2 Li2 Rb1 121.2(5) . 14 ?
O2 Li2 Rb1 68.1(4) . . ?
O2 Li2 Rb2 67.4(4) . 11 ?
O2 Li2 P3 131.9(6) . 14 ?
O2 Li2 P1 84.9(4) . 16_455 ?
O2 Li2 P4 100.8(5) . 14 ?
O2 Li2 O7 101.0(6) . 16_455 ?
O2 Li2 O3 112.1(7) . 14 ?
O2 Li2 O1 120.7(7) . 14 ?
Rb1 Li1 Rb1 89.7(2) 4 2_655 ?
Rb1 Li1 Rb2 75.7(2) 4 4 ?
Rb1 Li1 Rb2 152.8(3) 4 2_655 ?
Rb2 Li1 Rb1 67.10(18) 2_655 2_655 ?
Rb2 Li1 Rb1 126.4(3) 4 2_655 ?
Rb2 Li1 Rb2 129.2(3) 4 2_655 ?
O6 Li1 Rb1 44.9(3) 2_655 2_655 ?
O6 Li1 Rb1 107.6(4) 2_655 4 ?
O6 Li1 Rb2 45.9(3) 2_655 2_655 ?
O6 Li1 Rb2 169.6(5) 2_655 4 ?
O6 Li1 P2 26.2(2) 2_655 2_655 ?
O6 Li1 P2 120.1(5) 2_655 . ?
O6 Li1 Li1 67.5(4) 2_655 2_655 ?
P2 Li1 Rb1 87.2(2) 2_655 4 ?
P2 Li1 Rb1 75.0(2) . 4 ?
P2 Li1 Rb1 154.4(3) . 2_655 ?
P2 Li1 Rb1 58.75(19) 2_655 2_655 ?
P2 Li1 Rb2 68.9(2) 2_655 2_655 ?
P2 Li1 Rb2 70.2(2) . 4 ?
P2 Li1 Rb2 161.7(4) 2_655 4 ?
P2 Li1 Rb2 120.4(3) . 2_655 ?
P2 Li1 P2 99.5(3) 2_655 . ?
P2 Li1 Li1 53.8(3) 2_655 2_655 ?
P2 Li1 Li1 53.7(3) . 2_655 ?
O12 Li1 Rb1 142.2(6) 7_644 4 ?
O12 Li1 Rb1 118.1(5) 7_644 2_655 ?
O12 Li1 Rb2 67.4(4) 7_644 4 ?
O12 Li1 Rb2 64.7(4) 7_644 2_655 ?
O12 Li1 O6 110.2(6) 7_644 2_655 ?
O12 Li1 P2 85.3(4) 7_644 . ?
O12 Li1 P2 128.2(6) 7_644 2_655 ?
O12 Li1 O9 105.7(6) 7_644 . ?
O12 Li1 Li1 93.5(4) 7_644 2_655 ?
O9 Li1 Rb1 49.6(3) . 4 ?
O9 Li1 Rb1 135.9(4) . 2_655 ?
O9 Li1 Rb2 143.5(5) . 2_655 ?
O9 Li1 Rb2 66.2(4) . 4 ?
O9 Li1 O6 123.6(6) . 2_655 ?
O9 Li1 P2 97.8(4) . 2_655 ?
O9 Li1 P2 25.5(2) . . ?
O9 Li1 Li1 68.3(4) . 2_655 ?
O5 Li1 Rb1 65.6(4) 2_655 2_655 ?
O5 Li1 Rb1 61.5(3) 2_655 4 ?
O5 Li1 Rb2 62.1(4) 2_655 4 ?
O5 Li1 Rb2 116.4(5) 2_655 2_655 ?
O5 Li1 O6 110.2(6) 2_655 2_655 ?
O5 Li1 P2 115.3(5) 2_655 2_655 ?
O5 Li1 P2 120.9(6) 2_655 . ?
O5 Li1 O12 105.2(6) 2_655 7_644 ?
O5 Li1 O9 100.1(6) 2_655 . ?
O5 Li1 Li1 160.3(4) 2_655 2_655 ?
Li1 Li1 Rb1 111.0(5) 2_655 2_655 ?
Li1 Li1 Rb1 99.87(18) 2_655 4 ?
Li1 Li1 Rb2 122.2(5) 2_655 4 ?
Li1 Li1 Rb2 76.9(3) 2_655 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 2.087
_oxdiff_exptl_absorpt_empirical_full_min 0.757
####################################################################### 
# 
# 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. 
# 
#######################################################################

data_CsLiPO
_database_code_depnum_ccdc_archive 'CCDC 1969310'
loop_
_audit_author_name
_audit_author_address
'Yi-Gang Chen'
;Shanxi Normal University
China
;
_audit_update_record             
;
2020-06-17 deposited with the CCDC.	2020-06-29 downloaded from the CCDC.
;
_audit_creation_date             2019-12-02
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.03(Cs32 Li32 O192 P64)'
_chemical_formula_sum            'Cs Li O6 P2'
_chemical_formula_weight         297.79
_chemical_absolute_configuration ?
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Cs Cs -0.3680 2.1192 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'

_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           43
_space_group_name_H-M_alt        'F d d 2'
_space_group_name_Hall           'F 2 -2d'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'-x+1/4, y+1/4, z+1/4'
'x+1/4, -y+1/4, z+1/4'
'x, y+1/2, z+1/2'
'-x, -y+1/2, z+1/2'
'-x+1/4, y+3/4, z+3/4'
'x+1/4, -y+3/4, z+3/4'
'x+1/2, y, z+1/2'
'-x+1/2, -y, z+1/2'
'-x+3/4, y+1/4, z+3/4'
'x+3/4, -y+1/4, z+3/4'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z'
'-x+3/4, y+3/4, z+1/4'
'x+3/4, -y+3/4, z+1/4'

_cell_length_a                   19.0193(4)
_cell_length_b                   19.3975(4)
_cell_length_c                   13.1986(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     4869.32(18)
_cell_formula_units_Z            32
_cell_measurement_reflns_used    21136
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      37.0580
_cell_measurement_theta_min      2.5020
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    6.570
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.51207
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    3.250
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             4352
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.15
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0490
_diffrn_reflns_av_unetI/netI     0.0245
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.968
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_h_min       -27
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -27
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            21136
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.937
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         30.828
_diffrn_reflns_theta_min         3.000
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.968
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed tube'
_reflns_Friedel_coverage         0.863
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.903
_reflns_number_gt                3540
_reflns_number_total             3589
_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 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         1.860
_refine_diff_density_min         -1.223
_refine_diff_density_rms         0.194
_refine_ls_abs_structure_details 
;
 Flack x determined using 1563 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.007(8)
_refine_ls_extinction_coef       0.00037(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.161
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     182
_refine_ls_number_reflns         3589
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0330
_refine_ls_R_factor_gt           0.0324
_refine_ls_restrained_S_all      1.161
_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)+(0.0307P)²+81.0456P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0769
_refine_ls_wR_factor_ref         0.0772
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     direct
_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
Cs2 Cs -0.24869(3) -0.62198(2) -1.50233(4) 0.02539(13) Uani 1 1 d . . . . .
Cs1 Cs -0.37439(3) -0.51697(3) -1.77038(5) 0.03013(15) Uani 1 1 d . . . . .
P3 P -0.41983(9) -0.74697(10) -1.50698(17) 0.0162(3) Uani 1 1 d . . . . .
P1 P -0.24070(10) -0.40797(9) -1.50201(17) 0.0163(3) Uani 1 1 d . . . . .
P2 P -0.36923(10) -0.72371(11) -1.72188(14) 0.0153(3) Uani 1 1 d . . . . .
P4 P -0.27091(11) -0.63638(10) -1.21841(16) 0.0163(4) Uani 1 1 d . . . . .
O12 O -0.3132(3) -0.6755(3) -1.6908(5) 0.0266(13) Uani 1 1 d . . . . .
O1 O -0.1971(3) -0.4704(3) -1.5022(6) 0.0281(12) Uani 1 1 d . . . . .
O2 O -0.2238(4) -0.3607(3) -1.5980(5) 0.0241(12) Uani 1 1 d . . . . .
O10 O -0.4299(3) -0.6797(3) -1.7787(5) 0.0284(13) Uani 1 1 d . . . . .
O9 O -0.4102(4) -0.7554(3) -1.6269(5) 0.0254(12) Uani 1 1 d . . . . .
O11 O -0.3508(4) -0.7822(3) -1.7892(5) 0.0283(13) Uani 1 1 d . . . . .
O8 O -0.4789(3) -0.8055(3) -1.4923(5) 0.0221(11) Uani 1 1 d . . . . .
O7 O -0.3537(3) -0.7658(3) -1.4531(4) 0.0227(12) Uani 1 1 d . . . . .
O6 O -0.4556(4) -0.6813(3) -1.4830(5) 0.0289(14) Uani 1 1 d . . . . .
O4 O -0.2005(4) -0.6614(3) -1.2507(6) 0.0342(15) Uani 1 1 d . . . . .
O5 O -0.3350(3) -0.6708(3) -1.2579(6) 0.0300(13) Uani 1 1 d . . . . .
Li1 Li -0.4810(8) -0.5947(8) -1.5308(12) 0.024(3) Uani 1 1 d . . . . .
O3 O -0.2385(4) -0.3597(4) -1.4163(6) 0.0341(15) Uani 1 1 d . . . . .
Li2 Li -0.1482(8) -0.7361(8) -1.3063(11) 0.022(3) 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
Cs2 O12 2.963(6) . ?
Cs2 O1 3.100(6) . ?
Cs2 O9 3.295(6) 3_455 ?
Cs2 O11 3.386(7) 3_455 ?
Cs2 O8 3.690(6) 3_455 ?
Cs2 O7 2.992(6) 14_435 ?
Cs2 O7 3.491(6) . ?
Cs2 O6 3.318(7) 8_534 ?
Cs2 O4 3.529(8) . ?
Cs2 O5 3.223(7) 8_534 ?
Cs2 O5 3.742(8) . ?
Cs2 Li1 3.747(17) 8_534 ?
Cs1 O12 3.452(7) . ?
Cs1 O1 3.357(8) 10_444 ?
Cs1 O2 3.562(7) 7_444 ?
Cs1 O2 3.280(6) 12_444 ?
Cs1 O10 3.331(7) . ?
Cs1 O11 3.102(6) 3_455 ?
Cs1 O8 3.126(6) 8_534 ?
Cs1 O6 3.399(7) 8_534 ?
Cs1 O4 3.643(8) 16_434 ?
Cs1 O5 3.729(7) 3_454 ?
Cs1 O3 3.453(9) 7_444 ?
Cs1 O3 3.554(8) 12_444 ?
P3 Cs2 4.0912(19) 14_435 ?
P3 Cs1 3.9041(19) 16_435 ?
P3 O9 1.601(7) . ?
P3 O8 1.609(6) . ?
P3 O7 1.491(6) . ?
P3 O6 1.479(6) . ?
P3 Li2 2.967(16) 14_435 ?
P1 Cs1 4.0580(19) 4_545 ?
P1 Cs1 3.7581(19) 3_455 ?
P1 Cs1 4.032(2) 10_445 ?
P1 O1 1.468(6) . ?
P1 O2 1.596(6) . ?
P1 O10 1.606(6) 3_455 ?
P1 O3 1.469(7) . ?
P2 Cs2 3.840(2) 7_444 ?
P2 Cs1 4.030(2) 7_444 ?
P2 O12 1.475(6) . ?
P2 O10 1.619(6) . ?
P2 O9 1.599(6) . ?
P2 O11 1.483(7) . ?
P2 Li1 3.047(14) 8_534 ?
P4 Cs1 4.149(2) 7_445 ?
P4 Cs1 4.118(2) 10_445 ?
P4 O2 1.593(6) 10_445 ?
P4 O8 1.599(6) 3_455 ?
P4 O4 1.487(7) . ?
P4 O5 1.483(6) . ?
O12 Li1 2.004(17) 8_534 ?
O1 Cs1 3.357(8) 10_445 ?
O1 Li2 1.972(15) 11_454 ?
O2 Cs1 3.562(7) 3_455 ?
O2 Cs1 3.280(6) 4_545 ?
O2 P4 1.593(6) 10_444 ?
O10 Cs1 3.756(7) 7_444 ?
O10 P1 1.606(6) 7_444 ?
O9 Cs2 3.295(6) 7_444 ?
O11 Cs2 3.386(7) 7_444 ?
O11 Cs1 3.102(6) 7_444 ?
O11 Li1 1.974(18) 7_444 ?
O8 Cs2 3.690(6) 7_444 ?
O8 Cs1 3.126(6) 16_435 ?
O8 P4 1.600(6) 7_444 ?
O7 Cs2 2.992(6) 14_435 ?
O7 Li2 1.939(16) 14_435 ?
O6 Cs2 3.318(7) 16_435 ?
O6 Cs1 3.399(7) 16_435 ?
O6 Li1 1.857(16) . ?
O4 Cs1 3.750(7) 10_445 ?
O4 Cs1 3.643(8) 8_535 ?
O4 Li2 1.903(17) . ?
O5 Cs2 3.223(6) 16_435 ?
O5 Cs1 3.729(7) 7_445 ?
O5 Li2 1.943(17) 14_435 ?
Li1 Cs2 3.747(17) 16_435 ?
Li1 Cs1 3.829(17) 16_435 ?
Li1 P2 3.047(14) 16_435 ?
Li1 O12 2.004(17) 16_435 ?
Li1 O11 1.974(18) 3_455 ?
Li1 O3 1.903(16) 7_444 ?
O3 Cs1 3.554(8) 4_545 ?
O3 Cs1 3.748(9) 10_445 ?
O3 Cs1 3.453(9) 3_455 ?
O3 Li1 1.903(16) 3_455 ?
Li2 Cs2 4.257(14) 14_435 ?
Li2 Cs2 3.908(15) 15_445 ?
Li2 Cs1 3.801(14) 8_535 ?
Li2 P3 2.967(16) 14_435 ?
Li2 O1 1.972(15) 15_445 ?
Li2 O7 1.939(16) 14_435 ?
Li2 O5 1.943(17) 14_435 ?

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
O12 Cs2 O1 117.67(19) . . ?
O12 Cs2 O9 116.41(17) . 3_455 ?
O12 Cs2 O11 73.09(17) . 3_455 ?
O12 Cs2 O8 148.81(15) . 3_455 ?
O12 Cs2 O7 101.34(18) . 14_435 ?
O12 Cs2 O7 68.84(15) . . ?
O12 Cs2 O6 56.00(16) . 8_534 ?
O12 Cs2 O4 145.29(17) . . ?
O12 Cs2 O5 116.98(15) . . ?
O12 Cs2 O5 118.14(18) . 8_534 ?
O12 Cs2 Li1 32.1(2) . 8_534 ?
O1 Cs2 O9 61.00(17) . 3_455 ?
O1 Cs2 O11 77.31(15) . 3_455 ?
O1 Cs2 O8 72.83(17) . 3_455 ?
O1 Cs2 O7 159.86(16) . . ?
O1 Cs2 O6 68.10(18) . 8_534 ?
O1 Cs2 O4 97.03(19) . . ?
O1 Cs2 O5 56.63(15) . 8_534 ?
O1 Cs2 O5 112.23(16) . . ?
O1 Cs2 Li1 97.8(3) . 8_534 ?
O9 Cs2 O11 43.51(15) 3_455 3_455 ?
O9 Cs2 O8 39.85(14) 3_455 3_455 ?
O9 Cs2 O7 98.87(16) 3_455 . ?
O9 Cs2 O6 112.16(15) 3_455 8_534 ?
O9 Cs2 O4 79.19(15) 3_455 . ?
O9 Cs2 O5 60.65(14) 3_455 . ?
O9 Cs2 Li1 131.2(3) 3_455 8_534 ?
O11 Cs2 O8 81.74(13) 3_455 3_455 ?
O11 Cs2 O7 87.36(15) 3_455 . ?
O11 Cs2 O4 117.79(15) 3_455 . ?
O11 Cs2 O5 83.29(15) 3_455 . ?
O11 Cs2 Li1 91.4(3) 3_455 8_534 ?
O8 Cs2 O5 40.16(13) 3_455 . ?
O8 Cs2 Li1 169.3(2) 3_455 8_534 ?
O7 Cs2 O1 118.95(17) 14_435 . ?
O7 Cs2 O9 137.09(15) 14_435 3_455 ?
O7 Cs2 O11 162.83(16) 14_435 3_455 ?
O7 Cs2 O8 92.29(13) . 3_455 ?
O7 Cs2 O8 97.33(14) 14_435 3_455 ?
O7 Cs2 O7 75.53(17) 14_435 . ?
O7 Cs2 O6 105.38(16) 14_435 8_534 ?
O7 Cs2 O4 57.93(15) 14_435 . ?
O7 Cs2 O4 78.50(15) . . ?
O7 Cs2 O5 85.06(14) 14_435 . ?
O7 Cs2 O5 64.14(15) 14_435 8_534 ?
O7 Cs2 O5 52.17(13) . . ?
O7 Cs2 Li1 95.5(2) . 8_534 ?
O7 Cs2 Li1 91.7(3) 14_435 8_534 ?
O6 Cs2 O11 85.23(16) 8_534 3_455 ?
O6 Cs2 O8 140.64(13) 8_534 3_455 ?
O6 Cs2 O7 124.10(14) 8_534 . ?
O6 Cs2 O4 150.09(16) 8_534 . ?
O6 Cs2 O5 168.07(15) 8_534 . ?
O6 Cs2 Li1 29.7(2) 8_534 8_534 ?
O4 Cs2 O8 39.70(13) . 3_455 ?
O4 Cs2 O5 41.21(15) . . ?
O4 Cs2 Li1 149.6(3) . 8_534 ?
O5 Cs2 O9 110.04(17) 8_534 3_455 ?
O5 Cs2 O11 132.95(15) 8_534 3_455 ?
O5 Cs2 O8 92.46(16) 8_534 3_455 ?
O5 Cs2 O7 139.67(14) 8_534 . ?
O5 Cs2 O6 70.16(18) 8_534 8_534 ?
O5 Cs2 O4 79.98(17) 8_534 . ?
O5 Cs2 O5 120.6(2) 8_534 . ?
O5 Cs2 Li1 147.3(2) . 8_534 ?
O5 Cs2 Li1 86.3(2) 8_534 8_534 ?
O12 Cs1 O2 84.58(14) . 7_444 ?
O12 Cs1 O4 92.73(15) . 16_434 ?
O12 Cs1 O5 140.47(14) . 3_454 ?
O12 Cs1 O3 134.76(15) . 12_444 ?
O12 Cs1 O3 70.70(16) . 7_444 ?
O1 Cs1 O12 94.34(14) 10_444 . ?
O1 Cs1 O2 91.65(15) 10_444 7_444 ?
O1 Cs1 O6 74.24(15) 10_444 8_534 ?
O1 Cs1 O4 51.12(14) 10_444 16_434 ?
O1 Cs1 O5 49.78(13) 10_444 3_454 ?
O1 Cs1 O3 129.08(16) 10_444 7_444 ?
O1 Cs1 O3 130.54(15) 10_444 12_444 ?
O2 Cs1 O12 164.15(16) 12_444 . ?
O2 Cs1 O1 90.22(15) 12_444 10_444 ?
O2 Cs1 O2 80.12(17) 12_444 7_444 ?
O2 Cs1 O10 121.50(16) 12_444 . ?
O2 Cs1 O6 144.37(16) 12_444 8_534 ?
O2 Cs1 O4 40.82(14) 7_444 16_434 ?
O2 Cs1 O4 78.37(16) 12_444 16_434 ?
O2 Cs1 O5 81.12(14) 7_444 3_454 ?
O2 Cs1 O5 40.55(14) 12_444 3_454 ?
O2 Cs1 O3 94.70(18) 12_444 7_444 ?
O2 Cs1 O3 41.13(15) 12_444 12_444 ?
O10 Cs1 O12 43.30(14) . . ?
O10 Cs1 O1 91.68(15) . 10_444 ?
O10 Cs1 O2 41.38(14) . 7_444 ?
O10 Cs1 O6 91.39(14) . 8_534 ?
O10 Cs1 O4 59.00(15) . 16_434 ?
O10 Cs1 O5 112.38(15) . 3_454 ?
O10 Cs1 O3 43.94(16) . 7_444 ?
O10 Cs1 O3 118.31(17) . 12_444 ?
O11 Cs1 O12 70.55(17) 3_455 . ?
O11 Cs1 O1 162.04(17) 3_455 10_444 ?
O11 Cs1 O2 106.95(17) 3_455 12_444 ?
O11 Cs1 O2 96.36(16) 3_455 7_444 ?
O11 Cs1 O10 83.89(17) 3_455 . ?
O11 Cs1 O8 93.51(16) 3_455 8_534 ?
O11 Cs1 O6 88.44(18) 3_455 8_534 ?
O11 Cs1 O4 136.40(15) 3_455 16_434 ?
O11 Cs1 O5 147.48(16) 3_455 3_454 ?
O11 Cs1 O3 56.22(16) 3_455 7_444 ?
O11 Cs1 O3 65.98(18) 3_455 12_444 ?
O8 Cs1 O12 93.82(14) 8_534 . ?
O8 Cs1 O1 77.43(15) 8_534 10_444 ?
O8 Cs1 O2 101.99(17) 8_534 12_444 ?
O8 Cs1 O2 168.83(15) 8_534 7_444 ?
O8 Cs1 O10 135.32(15) 8_534 . ?
O8 Cs1 O6 43.93(14) 8_534 8_534 ?
O8 Cs1 O4 128.47(15) 8_534 16_434 ?
O8 Cs1 O5 93.32(15) 8_534 3_454 ?
O8 Cs1 O3 148.85(16) 8_534 7_444 ?
O8 Cs1 O3 100.59(17) 8_534 12_444 ?
O6 Cs1 O12 51.29(14) 8_534 . ?
O6 Cs1 O2 131.01(14) 8_534 7_444 ?
O6 Cs1 O4 112.55(16) 8_534 16_434 ?
O6 Cs1 O5 117.74(15) 8_534 3_454 ?
O6 Cs1 O3 120.12(17) 8_534 7_444 ?
O6 Cs1 O3 136.44(18) 8_534 12_444 ?
O4 Cs1 O5 53.62(14) 16_434 3_454 ?
O3 Cs1 O2 40.22(15) 7_444 7_444 ?
O3 Cs1 O2 88.24(17) 12_444 7_444 ?
O3 Cs1 O4 110.11(18) 12_444 16_434 ?
O3 Cs1 O4 80.40(15) 7_444 16_434 ?
O3 Cs1 O5 81.52(15) 12_444 3_454 ?
O3 Cs1 O5 116.00(16) 7_444 3_454 ?
O3 Cs1 O3 75.2(2) 7_444 12_444 ?
Cs2 P3 Cs2 75.09(3) . 14_435 ?
Cs1 P3 Cs2 139.33(5) 16_435 . ?
Cs1 P3 Cs2 145.53(5) 16_435 14_435 ?
O9 P3 Cs2 82.1(3) . 14_435 ?
O9 P3 Cs2 89.1(2) . . ?
O9 P3 Cs1 94.4(3) . 16_435 ?
O9 P3 O8 97.3(3) . . ?
O9 P3 Li2 145.2(4) . 14_435 ?
O8 P3 Cs2 96.1(2) . 14_435 ?
O8 P3 Cs2 168.4(2) . . ?
O8 P3 Cs1 50.1(2) . 16_435 ?
O8 P3 Li2 96.8(4) . 14_435 ?
O7 P3 Cs2 34.9(2) . 14_435 ?
O7 P3 Cs2 57.4(2) . . ?
O7 P3 Cs1 151.6(3) . 16_435 ?
O7 P3 O9 110.5(4) . . ?
O7 P3 O8 111.1(3) . . ?
O7 P3 Li2 34.8(4) . 14_435 ?
O6 P3 Cs2 81.5(3) . . ?
O6 P3 Cs2 153.2(3) . 14_435 ?
O6 P3 Cs1 59.4(3) . 16_435 ?
O6 P3 O9 110.6(4) . . ?
O6 P3 O8 105.1(4) . . ?
O6 P3 O7 119.8(4) . . ?
O6 P3 Li2 96.1(4) . 14_435 ?
Li2 P3 Cs2 64.9(3) 14_435 14_435 ?
Li2 P3 Cs2 72.7(3) 14_435 . ?
Li2 P3 Cs1 118.9(3) 14_435 16_435 ?
Cs1 P1 Cs2 148.82(5) 4_545 . ?
Cs1 P1 Cs2 134.61(5) 3_455 . ?
Cs1 P1 Cs2 70.11(3) 10_445 . ?
Cs1 P1 Cs1 92.94(4) 10_445 4_545 ?
Cs1 P1 Cs1 133.03(6) 3_455 10_445 ?
Cs1 P1 Cs1 76.10(4) 3_455 4_545 ?
O1 P1 Cs2 36.5(2) . . ?
O1 P1 Cs1 52.9(3) . 10_445 ?
O1 P1 Cs1 170.5(3) . 3_455 ?
O1 P1 Cs1 112.4(2) . 4_545 ?
O1 P1 O2 111.0(4) . . ?
O1 P1 O10 108.3(4) . 3_455 ?
O1 P1 O3 120.7(5) . . ?
O2 P1 Cs2 125.5(2) . . ?
O2 P1 Cs1 50.4(2) . 4_545 ?
O2 P1 Cs1 134.4(3) . 10_445 ?
O2 P1 Cs1 70.6(3) . 3_455 ?
O2 P1 O10 99.5(4) . 3_455 ?
O10 P1 Cs2 72.7(2) 3_455 . ?
O10 P1 Cs1 136.0(2) 3_455 4_545 ?
O10 P1 Cs1 62.3(2) 3_455 3_455 ?
O10 P1 Cs1 125.5(2) 3_455 10_445 ?
O3 P1 Cs2 129.7(3) . . ?
O3 P1 Cs1 66.7(3) . 3_455 ?
O3 P1 Cs1 68.4(4) . 10_445 ?
O3 P1 Cs1 59.8(3) . 4_545 ?
O3 P1 O2 103.8(4) . . ?
O3 P1 O10 111.3(4) . 3_455 ?
Cs2 P2 Cs2 141.57(5) 7_444 . ?
Cs2 P2 Cs1 135.00(5) 7_444 . ?
Cs2 P2 Cs1 73.86(4) 7_444 7_444 ?
Cs1 P2 Cs2 142.26(5) 7_444 . ?
Cs1 P2 Cs2 69.95(3) . . ?
Cs1 P2 Cs1 92.91(4) 7_444 . ?
O12 P2 Cs2 27.6(2) . . ?
O12 P2 Cs2 167.4(3) . 7_444 ?
O12 P2 Cs1 115.2(3) . 7_444 ?
O12 P2 Cs1 55.6(3) . . ?
O12 P2 O10 108.0(4) . . ?
O12 P2 O9 112.2(4) . . ?
O12 P2 O11 118.7(4) . . ?
O12 P2 Li1 34.1(4) . 8_534 ?
O10 P2 Cs2 83.1(2) . 7_444 ?
O10 P2 Cs2 117.5(3) . . ?
O10 P2 Cs1 68.6(3) . 7_444 ?
O10 P2 Cs1 52.4(3) . . ?
O10 P2 Li1 105.5(4) . 8_534 ?
O9 P2 Cs2 58.4(2) . 7_444 ?
O9 P2 Cs2 84.6(2) . . ?
O9 P2 Cs1 132.2(2) . 7_444 ?
O9 P2 Cs1 119.4(3) . . ?
O9 P2 O10 102.6(3) . . ?
O9 P2 Li1 142.0(4) . 8_534 ?
O11 P2 Cs2 61.2(3) . 7_444 ?
O11 P2 Cs2 130.2(3) . . ?
O11 P2 Cs1 42.5(3) . 7_444 ?
O11 P2 Cs1 131.8(3) . . ?
O11 P2 O10 107.1(4) . . ?
O11 P2 O9 106.9(4) . . ?
O11 P2 Li1 88.7(5) . 8_534 ?
Li1 P2 Cs2 149.8(4) 8_534 7_444 ?
Li1 P2 Cs2 59.9(3) 8_534 . ?
Li1 P2 Cs1 82.4(3) 8_534 7_444 ?
Li1 P2 Cs1 63.3(3) 8_534 . ?
Cs2 P4 Cs1 72.93(4) . 10_445 ?
Cs2 P4 Cs1 136.31(6) . 7_445 ?
Cs1 P4 Cs1 150.24(6) 10_445 7_445 ?
O2 P4 Cs2 176.4(2) 10_445 . ?
O2 P4 Cs1 47.2(2) 10_445 7_445 ?
O2 P4 Cs1 103.5(2) 10_445 10_445 ?
O2 P4 O8 103.4(3) 10_445 3_455 ?
O8 P4 Cs2 74.5(2) 3_455 . ?
O8 P4 Cs1 136.2(2) 3_455 7_445 ?
O8 P4 Cs1 42.3(2) 3_455 10_445 ?
O4 P4 Cs2 68.8(3) . . ?
O4 P4 Cs1 114.5(3) . 7_445 ?
O4 P4 Cs1 65.4(3) . 10_445 ?
O4 P4 O2 109.3(4) . 10_445 ?
O4 P4 O8 105.4(4) . 3_455 ?
O5 P4 Cs2 77.1(3) . . ?
O5 P4 Cs1 144.9(3) . 10_445 ?
O5 P4 Cs1 63.4(3) . 7_445 ?
O5 P4 O2 106.4(4) . 10_445 ?
O5 P4 O8 111.7(3) . 3_455 ?
O5 P4 O4 119.5(4) . . ?
Cs2 O12 Cs1 94.74(18) . . ?
P2 O12 Cs2 139.0(3) . . ?
P2 O12 Cs1 103.7(3) . . ?
P2 O12 Li1 121.6(6) . 8_534 ?
Li1 O12 Cs2 96.0(5) 8_534 . ?
Li1 O12 Cs1 84.7(5) 8_534 . ?
Cs2 O1 Cs1 93.42(17) . 10_445 ?
P1 O1 Cs2 127.1(3) . . ?
P1 O1 Cs1 106.7(4) . 10_445 ?
P1 O1 Li2 130.3(6) . 11_454 ?
Li2 O1 Cs2 98.3(5) 11_454 . ?
Li2 O1 Cs1 86.9(5) 11_454 10_445 ?
Cs1 O2 Cs1 89.54(15) 4_545 3_455 ?
P1 O2 Cs1 107.5(3) . 4_545 ?
P1 O2 Cs1 84.4(3) . 3_455 ?
P4 O2 Cs1 112.0(3) 10_444 4_545 ?
P4 O2 Cs1 104.7(3) 10_444 3_455 ?
P4 O2 P1 139.4(4) 10_444 . ?
Cs1 O10 Cs1 111.57(16) . 7_444 ?
P1 O10 Cs1 92.4(3) 7_444 . ?
P1 O10 Cs1 124.3(3) 7_444 7_444 ?
P1 O10 P2 135.0(4) 7_444 . ?
P2 O10 Cs1 87.7(3) . 7_444 ?
P2 O10 Cs1 104.9(3) . . ?
P3 O9 Cs2 120.4(3) . 7_444 ?
P2 O9 Cs2 97.2(3) . 7_444 ?
P2 O9 P3 142.3(4) . . ?
Cs1 O11 Cs2 93.54(19) 7_444 7_444 ?
P2 O11 Cs2 96.2(3) . 7_444 ?
P2 O11 Cs1 118.7(3) . 7_444 ?
P2 O11 Li1 128.5(6) . 7_444 ?
Li1 O11 Cs2 110.0(5) 7_444 7_444 ?
Li1 O11 Cs1 103.5(5) 7_444 7_444 ?
Cs1 O8 Cs2 86.83(14) 16_435 7_444 ?
P3 O8 Cs2 102.5(3) . 7_444 ?
P3 O8 Cs1 106.6(3) . 16_435 ?
P4 O8 Cs2 80.9(2) 7_444 7_444 ?
P4 O8 Cs1 117.5(3) 7_444 16_435 ?
P4 O8 P3 135.8(4) 7_444 . ?
Cs2 O7 Cs2 99.73(17) 14_435 . ?
P3 O7 Cs2 101.5(3) . . ?
P3 O7 Cs2 128.6(3) . 14_435 ?
P3 O7 Li2 119.2(6) . 14_435 ?
Li2 O7 Cs2 102.6(5) 14_435 14_435 ?
Li2 O7 Cs2 99.3(5) 14_435 . ?
Cs2 O6 Cs1 89.54(16) 16_435 16_435 ?
P3 O6 Cs2 125.3(3) . 16_435 ?
P3 O6 Cs1 98.6(3) . 16_435 ?
P3 O6 Li1 145.7(7) . . ?
Li1 O6 Cs2 88.1(5) . 16_435 ?
Li1 O6 Cs1 88.4(5) . 16_435 ?
Cs2 O4 Cs1 166.2(2) . 8_535 ?
Cs2 O4 Cs1 80.44(15) . 10_445 ?
Cs1 O4 Cs1 105.01(19) 8_535 10_445 ?
P4 O4 Cs2 88.0(3) . . ?
P4 O4 Cs1 93.5(3) . 10_445 ?
P4 O4 Cs1 104.0(4) . 8_535 ?
P4 O4 Li2 146.0(7) . . ?
Li2 O4 Cs2 86.4(5) . . ?
Li2 O4 Cs1 118.5(6) . 10_445 ?
Li2 O4 Cs1 79.9(5) . 8_535 ?
Cs2 O5 Cs2 112.21(19) 16_435 . ?
Cs2 O5 Cs1 84.80(16) 16_435 7_445 ?
Cs1 O5 Cs2 160.47(19) 7_445 . ?
P4 O5 Cs2 132.0(3) . 16_435 ?
P4 O5 Cs2 80.1(3) . . ?
P4 O5 Cs1 95.8(3) . 7_445 ?
P4 O5 Li2 132.0(6) . 14_435 ?
Li2 O5 Cs2 95.0(5) 14_435 16_435 ?
Li2 O5 Cs2 91.4(5) 14_435 . ?
Li2 O5 Cs1 77.1(5) 14_435 7_445 ?
Cs2 Li1 Cs2 89.2(3) 16_435 . ?
Cs2 Li1 Cs1 77.3(4) 16_435 16_435 ?
Cs2 Li1 Cs1 151.1(4) 16_435 . ?
Cs1 Li1 Cs2 67.3(3) . . ?
Cs1 Li1 Cs2 128.2(4) 16_435 . ?
Cs1 Li1 Cs1 130.2(4) 16_435 . ?
P2 Li1 Cs2 75.3(3) 16_435 16_435 ?
P2 Li1 Cs2 152.1(4) 16_435 . ?
P2 Li1 Cs1 118.0(5) 16_435 . ?
P2 Li1 Cs1 71.4(3) 16_435 16_435 ?
O12 Li1 Cs2 51.8(4) 16_435 16_435 ?
O12 Li1 Cs2 138.3(6) 16_435 . ?
O12 Li1 Cs1 63.9(5) 16_435 16_435 ?
O12 Li1 Cs1 141.4(6) 16_435 . ?
O12 Li1 P2 24.4(3) 16_435 16_435 ?
O11 Li1 Cs2 45.4(4) 3_455 . ?
O11 Li1 Cs2 103.4(5) 3_455 16_435 ?
O11 Li1 Cs1 173.3(6) 3_455 16_435 ?
O11 Li1 Cs1 48.2(4) 3_455 . ?
O11 Li1 P2 115.2(6) 3_455 16_435 ?
O11 Li1 O12 121.9(7) 3_455 16_435 ?
O6 Li1 Cs2 62.2(5) . 16_435 ?
O6 Li1 Cs2 66.9(5) . . ?
O6 Li1 Cs1 62.6(5) . 16_435 ?
O6 Li1 Cs1 118.2(6) . . ?
O6 Li1 P2 122.1(8) . 16_435 ?
O6 Li1 O12 100.3(9) . 16_435 ?
O6 Li1 O11 111.7(7) . 3_455 ?
O6 Li1 O3 105.1(7) . 7_444 ?
O3 Li1 Cs2 150.3(8) 7_444 16_435 ?
O3 Li1 Cs2 111.3(6) 7_444 . ?
O3 Li1 Cs1 73.1(5) 7_444 16_435 ?
O3 Li1 Cs1 58.4(5) 7_444 . ?
O3 Li1 P2 92.4(5) 7_444 16_435 ?
O3 Li1 O12 110.4(7) 7_444 16_435 ?
O3 Li1 O11 106.4(9) 7_444 3_455 ?
Cs1 O3 Cs1 86.99(19) 3_455 4_545 ?
Cs1 O3 Cs1 106.9(2) 4_545 10_445 ?
Cs1 O3 Cs1 165.9(2) 3_455 10_445 ?
P1 O3 Cs1 90.3(4) . 10_445 ?
P1 O3 Cs1 90.2(4) . 3_455 ?
P1 O3 Cs1 99.3(3) . 4_545 ?
P1 O3 Li1 144.3(7) . 3_455 ?
Li1 O3 Cs1 116.4(5) 3_455 4_545 ?
Li1 O3 Cs1 93.7(6) 3_455 3_455 ?
Li1 O3 Cs1 77.8(6) 3_455 10_445 ?
Cs2 Li2 Cs2 90.2(3) 15_445 14_435 ?
Cs2 Li2 Cs2 148.6(4) . 15_445 ?
Cs2 Li2 Cs2 74.8(2) . 14_435 ?
Cs1 Li2 Cs2 75.2(3) 8_535 15_445 ?
Cs1 Li2 Cs2 135.0(4) 8_535 . ?
Cs1 Li2 Cs2 131.9(4) 8_535 14_435 ?
P3 Li2 Cs2 77.0(3) 14_435 15_445 ?
P3 Li2 Cs2 65.6(3) 14_435 14_435 ?
P3 Li2 Cs2 71.6(3) 14_435 . ?
P3 Li2 Cs1 146.7(5) 14_435 8_535 ?
O1 Li2 Cs2 138.0(7) 15_445 14_435 ?
O1 Li2 Cs2 51.7(4) 15_445 15_445 ?
O1 Li2 Cs2 127.1(7) 15_445 . ?
O1 Li2 Cs1 61.9(4) 15_445 8_535 ?
O1 Li2 P3 86.5(6) 15_445 14_435 ?
O7 Li2 Cs2 48.4(4) 14_435 . ?
O7 Li2 Cs2 100.4(6) 14_435 15_445 ?
O7 Li2 Cs2 54.0(4) 14_435 14_435 ?
O7 Li2 Cs1 171.8(7) 14_435 8_535 ?
O7 Li2 P3 26.0(3) 14_435 14_435 ?
O7 Li2 O1 110.0(9) 14_435 15_445 ?
O7 Li2 O5 110.4(8) 14_435 14_435 ?
O4 Li2 Cs2 64.4(5) . . ?
O4 Li2 Cs2 144.7(6) . 15_445 ?
O4 Li2 Cs2 119.1(6) . 14_435 ?
O4 Li2 Cs1 70.6(5) . 8_535 ?
O4 Li2 P3 131.0(7) . 14_435 ?
O4 Li2 O1 102.9(7) . 15_445 ?
O4 Li2 O7 112.4(8) . 14_435 ?
O4 Li2 O5 119.7(9) . 14_435 ?
O5 Li2 Cs2 61.5(4) 14_435 14_435 ?
O5 Li2 Cs2 55.3(4) 14_435 15_445 ?
O5 Li2 Cs2 131.7(6) 14_435 . ?
O5 Li2 Cs1 73.0(5) 14_435 8_535 ?
O5 Li2 P3 105.2(6) 14_435 14_435 ?
O5 Li2 O1 100.1(7) 14_435 15_445 ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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. 
# 
#######################################################################

data_RbLiBePO
_database_code_depnum_ccdc_archive 'CCDC 1969309'
loop_
_audit_author_name
_audit_author_address
'Yi-Gang Chen'
;Shanxi Normal University
China
;
_audit_update_record             
;
2020-06-17 deposited with the CCDC.	2020-06-29 downloaded from the CCDC.
;
_audit_creation_date             2019-12-02
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'Be4 Li O24 P7 Rb4'
_chemical_formula_sum            'Be4 Li O24 P7 Rb4'
_chemical_formula_weight         985.65
_chemical_absolute_configuration ?
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Be Be 0.0005 0.0002 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Li Li -0.0003 0.0001 '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'
Rb Rb -0.9393 2.9676 '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           17
_space_group_name_H-M_alt        'P 2 2 21'
_space_group_name_Hall           'P 2c 2'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'x, -y, -z'
'-x, y, -z+1/2'

_cell_length_a                   12.8805(4)
_cell_length_b                   12.9118(4)
_cell_length_c                   12.9447(4)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     2152.84(12)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    33431
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      37.0580
_cell_measurement_theta_min      2.5020
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    9.674
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.51207
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    3.041
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1856
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.16
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0402
_diffrn_reflns_av_unetI/netI     0.0323
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.955
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            33431
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.929
_diffrn_reflns_theta_full        25.500
_diffrn_reflns_theta_max         29.428
_diffrn_reflns_theta_min         3.147
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed tube'
_reflns_Friedel_coverage         0.732
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.896
_reflns_number_gt                4922
_reflns_number_total             5550
_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 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         0.624
_refine_diff_density_min         -0.503
_refine_diff_density_rms         0.124
_refine_ls_abs_structure_details 
;
 Flack x determined using 1872 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   -0.006(3)
_refine_ls_extinction_coef       0.00530(16)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     362
_refine_ls_number_reflns         5550
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0362
_refine_ls_R_factor_gt           0.0266
_refine_ls_restrained_S_all      1.049
_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)+(0.0216P)²+0.9059P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0500
_refine_ls_wR_factor_ref         0.0524
_refine_special_details          ?
_olex2_refinement_description    
;
;
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     direct
_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
Rb2 Rb 0.61766(3) 0.14398(3) 0.11777(4) 0.02003(11) Uani 1 1 d . . . . .
Rb4 Rb 0.13173(4) 0.11972(4) -0.13398(3) 0.02376(11) Uani 1 1 d . . . . .
Rb1 Rb 0.87295(4) 0.36138(4) 0.11739(4) 0.02441(11) Uani 1 1 d . . . . .
P3 P 0.35166(7) 0.12430(8) 0.09338(8) 0.0071(2) Uani 1 1 d . . . . .
P4 P 0.12770(8) 0.35890(8) -0.33307(8) 0.0070(2) Uani 1 1 d . . . . .
P5 P 0.15879(7) 0.13967(8) -0.41053(8) 0.0078(2) Uani 1 1 d . . . . .
P7 P 0.59490(7) 0.41538(8) 0.12779(9) 0.0082(2) Uani 1 1 d . . . . .
P2 P 0.13504(8) 0.16362(8) 0.14940(9) 0.0125(2) Uani 1 1 d . . . . .
O9 O 0.1252(2) 0.3560(2) -0.0192(2) 0.0225(7) Uani 1 1 d . . . . .
O24 O 0.22820(19) 0.1334(2) 0.0716(2) 0.0130(6) Uani 1 1 d . . . . .
Rb3 Rb 0.37415(4) 0.39209(4) -0.13676(4) 0.02547(12) Uani 1 1 d . . . . .
P1 P 0.17591(8) 0.37847(9) 0.08285(8) 0.0102(2) Uani 1 1 d . . . . .
O14 O 0.1413(2) 0.2868(2) 0.1604(2) 0.0157(6) Uani 1 1 d . . . . .
O18 O 0.3720(2) 0.0183(2) 0.1373(2) 0.0175(6) Uani 1 1 d . . . . .
O22 O 0.3787(2) 0.2071(2) 0.1709(2) 0.0110(6) Uani 1 1 d . . . . .
O1 O 0.03853(19) 0.4242(2) -0.3718(2) 0.0136(6) Uani 1 1 d . . . . .
O3 O 0.1267(2) 0.3382(2) -0.2187(2) 0.0187(7) Uani 1 1 d . . . . .
O6 O 0.0819(2) 0.0645(2) -0.3727(3) 0.0214(7) Uani 1 1 d . . . . .
O17 O 0.1568(3) 0.1224(2) 0.2534(3) 0.0273(8) Uani 1 1 d . . . . .
O7 O 0.2564(2) 0.1291(2) -0.3356(2) 0.0174(7) Uani 1 1 d . . . . .
O5 O 0.1911(2) 0.1394(3) -0.5198(2) 0.0258(8) Uani 1 1 d . . . . .
O2 O 0.2274(2) 0.4027(3) -0.3704(3) 0.0278(8) Uani 1 1 d . . . . .
O4 O 0.1103(3) 0.2495(2) -0.3863(3) 0.0363(10) Uani 1 1 d . . . . .
O15 O 0.4005(2) 0.1421(2) -0.0106(2) 0.0161(6) Uani 1 1 d . . . . .
O16 O 0.0402(2) 0.1360(3) 0.0928(3) 0.0296(8) Uani 1 1 d . . . . .
O23 O 0.1355(3) 0.4729(2) 0.1371(3) 0.0266(8) Uani 1 1 d . . . . .
O13 O 0.2924(2) 0.3741(2) 0.0763(2) 0.0136(6) Uani 1 1 d . . . . .
O20 O 0.6672(2) 0.3795(2) 0.0411(2) 0.0130(6) Uani 1 1 d . . . . .
O12 O 0.5813(2) 0.4668(2) -0.1279(2) 0.0125(6) Uani 1 1 d . . . . .
O21 O 0.6459(2) 0.3811(2) 0.2287(2) 0.0197(7) Uani 1 1 d . . . . .
O19 O 0.4893(2) 0.3662(2) 0.1124(2) 0.0238(7) Uani 1 1 d . . . . .
P6 P 0.37520(8) 0.16661(8) -0.32354(8) 0.0068(2) Uani 1 1 d . . . . .
O11 O 0.3865(2) 0.1740(2) -0.2073(2) 0.0107(6) Uani 1 1 d . . . . .
O10 O 0.44233(19) 0.0830(2) -0.3719(2) 0.0111(6) Uani 1 1 d . . . . .
O8 O 0.3862(2) 0.2690(2) -0.3762(2) 0.0183(7) Uani 1 1 d . . . . .
Be3 Be 0.4290(4) 0.0927(4) -0.1203(4) 0.0083(10) Uani 1 1 d . . . . .
Be4 Be 0.6573(4) 0.3801(4) -0.0824(4) 0.0084(10) Uani 1 1 d . . . . .
Be2 Be 0.6170(4) 0.3348(4) 0.3387(4) 0.0103(10) Uani 1 1 d . . . . .
Li1 Li 0.0935(5) -0.0814(5) -0.3773(6) 0.0144(15) Uani 1 1 d . . . . .
Be1 Be -0.0864(4) 0.4123(4) -0.3760(5) 0.0122(11) 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
Rb2 P3 3.4501(10) . ?
Rb2 P7 3.5188(11) . ?
Rb2 O22 2.855(3) 4_655 ?
Rb2 O22 3.258(3) . ?
Rb2 O17 3.361(3) 4_655 ?
Rb2 O5 2.772(3) 4_654 ?
Rb2 O15 3.253(3) . ?
Rb2 O20 3.262(3) . ?
Rb2 O21 3.401(3) . ?
Rb2 O19 3.312(3) . ?
Rb2 O10 3.034(3) 2_655 ?
Rb2 O10 3.368(3) 4_654 ?
Rb4 O9 3.394(3) . ?
Rb4 O24 2.942(3) . ?
Rb4 O18 3.571(3) 3 ?
Rb4 O3 3.027(3) . ?
Rb4 O6 2.844(3) 4_554 ?
Rb4 O6 3.236(4) . ?
Rb4 O17 3.503(3) 3 ?
Rb4 O7 3.067(3) . ?
Rb4 O4 3.548(4) 4_554 ?
Rb4 O16 3.171(3) . ?
Rb4 O16 3.546(4) 3 ?
Rb4 O11 3.487(3) . ?
Rb1 O14 3.039(3) 4_655 ?
Rb1 O14 3.631(3) 1_655 ?
Rb1 O1 2.998(3) 2_665 ?
Rb1 O1 3.473(3) 4_654 ?
Rb1 O17 3.530(3) 4_655 ?
Rb1 O5 3.239(4) 4_654 ?
Rb1 O2 3.313(3) 2_665 ?
Rb1 O2 3.489(4) 4_654 ?
Rb1 O4 3.329(4) 4_654 ?
Rb1 O23 3.491(3) 4_655 ?
Rb1 O20 2.838(3) . ?
Rb1 O21 3.270(3) . ?
P3 Rb2 3.7685(11) 4_655 ?
P3 O24 1.619(3) . ?
P3 O18 1.506(3) . ?
P3 O22 1.506(3) . ?
P3 O15 1.503(3) . ?
P4 Rb1 3.6683(11) 2_664 ?
P4 Rb1 3.6806(11) 4_654 ?
P4 O1 1.511(3) . ?
P4 O3 1.504(3) . ?
P4 O2 1.484(3) . ?
P4 O4 1.588(3) . ?
P5 Rb2 3.9357(11) 4_654 ?
P5 Rb4 3.7949(11) 4_554 ?
P5 Rb1 3.9411(12) 4_654 ?
P5 O6 1.471(3) . ?
P5 O7 1.593(3) . ?
P5 O5 1.474(3) . ?
P5 O4 1.581(3) . ?
P5 Li1 2.969(8) 3_554 ?
P5 Li1 3.007(7) . ?
P7 Rb3 3.7787(11) 3_565 ?
P7 Rb3 3.9533(12) 2_665 ?
P7 O20 1.530(3) . ?
P7 O12 1.532(3) 3_565 ?
P7 O21 1.527(3) . ?
P7 O19 1.515(3) . ?
P2 Rb4 3.6641(12) 3 ?
P2 Rb1 3.9552(12) 4_655 ?
P2 O24 1.614(3) . ?
P2 O14 1.598(3) . ?
P2 O17 1.474(3) . ?
P2 O16 1.468(3) . ?
O9 Rb3 3.580(3) . ?
O9 P1 1.502(3) . ?
O9 Be1 1.618(6) 4_554 ?
O24 Rb4 3.588(3) 3 ?
Rb3 O3 3.430(3) . ?
Rb3 O23 3.534(3) 3_565 ?
Rb3 O13 2.961(3) . ?
Rb3 O13 3.292(3) 3_565 ?
Rb3 O12 2.839(3) . ?
Rb3 O12 3.246(3) 4_654 ?
Rb3 O21 3.417(3) 2_664 ?
Rb3 O19 3.470(3) 3_565 ?
Rb3 O11 2.964(3) . ?
Rb3 O8 3.476(3) 4_654 ?
Rb3 O8 3.486(3) . ?
Rb3 Be2 3.543(5) 2_664 ?
P1 Rb1 3.9372(12) 4_655 ?
P1 Rb1 3.9340(11) 1_455 ?
P1 Rb3 3.9728(12) 3_565 ?
P1 O14 1.615(3) . ?
P1 O23 1.500(3) . ?
P1 O13 1.504(3) . ?
O14 Rb1 3.631(3) 1_455 ?
O14 Rb1 3.039(3) 4_655 ?
O18 Rb2 3.564(3) 4_655 ?
O18 Rb4 3.571(3) 3 ?
O18 Be3 1.625(5) 3 ?
O22 Rb2 2.855(3) 4_655 ?
O22 Be2 1.655(6) 4_655 ?
O1 Rb1 3.473(3) 4_654 ?
O1 Rb1 2.998(3) 2_664 ?
O1 Be1 1.617(6) . ?
O3 Be1 1.639(6) 4_554 ?
O6 Rb4 2.844(3) 4_554 ?
O6 Li1 1.891(8) . ?
O17 Rb2 3.361(3) 4_655 ?
O17 Rb4 3.503(3) 3 ?
O17 Rb1 3.530(3) 4_655 ?
O17 Li1 1.876(8) 3 ?
O7 P6 1.613(3) . ?
O5 Rb2 2.771(3) 4_654 ?
O5 Rb1 3.239(4) 4_654 ?
O5 Li1 1.979(8) 3_554 ?
O2 Rb1 3.489(4) 4_654 ?
O2 Rb1 3.313(3) 2_664 ?
O2 Be4 1.633(6) 4_654 ?
O4 Rb4 3.548(4) 4_554 ?
O4 Rb1 3.329(4) 4_654 ?
O15 Be3 1.600(6) . ?
O16 Rb4 3.546(4) 3 ?
O16 Rb1 3.635(3) 1_455 ?
O16 Li1 1.901(7) 2 ?
O23 Rb1 3.491(3) 4_655 ?
O23 Rb3 3.534(3) 3_565 ?
O23 Be1 1.621(6) 2_565 ?
O13 Rb3 3.292(3) 3_565 ?
O13 Be2 1.683(6) 4_655 ?
O20 Be4 1.603(6) . ?
O12 P7 1.531(3) 3_565 ?
O12 Rb3 3.246(3) 4_654 ?
O12 Be4 1.600(6) . ?
O21 Rb3 3.417(3) 2_665 ?
O21 Be2 1.589(6) . ?
O19 Rb3 3.470(3) 3_565 ?
O19 Be2 1.561(6) 4_655 ?
P6 Rb2 3.8210(11) 4_654 ?
P6 O11 1.515(3) . ?
P6 O10 1.518(3) . ?
P6 O8 1.494(3) . ?
O11 Be3 1.634(6) . ?
O10 Rb2 3.368(3) 4_654 ?
O10 Rb2 3.034(3) 2_654 ?
O10 Be3 1.665(5) 4_654 ?
O8 Rb2 3.520(3) 4_654 ?
O8 Rb3 3.476(3) 4_654 ?
O8 Be4 1.631(6) 4_654 ?
Be3 Rb2 3.905(5) 3 ?
Be3 O18 1.626(5) 3 ?
Be3 O10 1.665(5) 4_654 ?
Be4 Rb3 3.662(5) 4_654 ?
Be4 O2 1.633(6) 4_654 ?
Be4 O8 1.631(6) 4_654 ?
Be2 Rb2 3.940(5) 4_655 ?
Be2 Rb3 3.543(5) 2_665 ?
Be2 Rb3 3.930(5) 4_655 ?
Be2 O22 1.655(6) 4_655 ?
Be2 O13 1.683(6) 4_655 ?
Be2 O19 1.561(6) 4_655 ?
Li1 Rb2 3.808(7) 2_654 ?
Li1 Rb4 4.439(7) 2_554 ?
Li1 Rb4 3.896(7) 4_554 ?
Li1 Rb1 3.641(7) 2_654 ?
Li1 P5 2.969(8) 3_554 ?
Li1 O17 1.876(8) 3 ?
Li1 O5 1.979(8) 3_554 ?
Li1 O16 1.901(7) 2_554 ?
Be1 Rb4 3.824(6) 4_554 ?
Be1 Rb1 4.014(6) 2_664 ?
Be1 O9 1.618(6) 4_554 ?
Be1 Rb3 3.719(5) 4_554 ?
Be1 O3 1.639(6) 4_554 ?
Be1 O23 1.621(6) 2_564 ?

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
P3 Rb2 P7 89.65(2) . . ?
O22 Rb2 P3 25.75(5) . . ?
O22 Rb2 P3 97.19(6) 4_655 . ?
O22 Rb2 P7 70.40(5) . . ?
O22 Rb2 P7 71.46(6) 4_655 . ?
O22 Rb2 O22 75.05(8) 4_655 . ?
O22 Rb2 O17 62.21(8) 4_655 4_655 ?
O22 Rb2 O17 137.10(7) . 4_655 ?
O22 Rb2 O15 120.37(8) 4_655 . ?
O22 Rb2 O20 90.92(7) . . ?
O22 Rb2 O20 91.28(7) 4_655 . ?
O22 Rb2 O21 48.46(7) 4_655 . ?
O22 Rb2 O21 77.69(7) . . ?
O22 Rb2 O19 77.36(8) 4_655 . ?
O22 Rb2 O19 46.85(7) . . ?
O22 Rb2 O10 167.40(7) 4_655 4_654 ?
O22 Rb2 O10 103.75(8) 4_655 2_655 ?
O22 Rb2 O10 92.35(6) . 4_654 ?
O17 Rb2 P3 153.84(6) 4_655 . ?
O17 Rb2 P7 97.82(6) 4_655 . ?
O17 Rb2 O21 76.86(7) 4_655 . ?
O17 Rb2 O10 130.38(7) 4_655 4_654 ?
O5 Rb2 P3 147.06(7) 4_654 . ?
O5 Rb2 P7 96.45(8) 4_654 . ?
O5 Rb2 O22 160.37(8) 4_654 . ?
O5 Rb2 O22 115.46(9) 4_654 4_655 ?
O5 Rb2 O17 57.12(8) 4_654 4_655 ?
O5 Rb2 O15 122.03(8) 4_654 . ?
O5 Rb2 O20 72.95(9) 4_654 . ?
O5 Rb2 O21 96.75(9) 4_654 . ?
O5 Rb2 O19 116.93(9) 4_654 . ?
O5 Rb2 O10 76.50(8) 4_654 4_654 ?
O5 Rb2 O10 103.05(9) 4_654 2_655 ?
O15 Rb2 P3 25.70(5) . . ?
O15 Rb2 P7 87.39(6) . . ?
O15 Rb2 O22 45.34(7) . . ?
O15 Rb2 O17 174.77(7) . 4_655 ?
O15 Rb2 O20 91.13(7) . . ?
O15 Rb2 O21 108.30(7) . . ?
O15 Rb2 O19 64.31(7) . . ?
O15 Rb2 O10 47.05(7) . 4_654 ?
O20 Rb2 P3 103.60(5) . . ?
O20 Rb2 P7 25.73(5) . . ?
O20 Rb2 O17 93.39(7) . 4_655 ?
O20 Rb2 O21 42.97(7) . . ?
O20 Rb2 O19 44.26(7) . . ?
O20 Rb2 O10 88.58(7) . 4_654 ?
O21 Rb2 P3 102.18(5) . . ?
O21 Rb2 P7 25.43(5) . . ?
O19 Rb2 P3 64.28(5) . . ?
O19 Rb2 P7 25.39(5) . . ?
O19 Rb2 O17 120.90(8) . 4_655 ?
O19 Rb2 O21 44.14(7) . . ?
O19 Rb2 O10 93.91(7) . 4_654 ?
O10 Rb2 P3 71.34(5) 2_655 . ?
O10 Rb2 P3 70.64(5) 4_654 . ?
O10 Rb2 P7 104.38(5) 4_654 . ?
O10 Rb2 P7 159.91(5) 2_655 . ?
O10 Rb2 O22 89.52(7) 2_655 . ?
O10 Rb2 O17 96.80(7) 2_655 4_655 ?
O10 Rb2 O15 78.25(7) 2_655 . ?
O10 Rb2 O20 164.53(7) 2_655 . ?
O10 Rb2 O21 151.44(8) 2_655 . ?
O10 Rb2 O21 129.33(7) 4_654 . ?
O10 Rb2 O19 135.28(7) 2_655 . ?
O10 Rb2 O10 75.96(8) 2_655 4_654 ?
O9 Rb4 O18 118.37(7) . 3 ?
O9 Rb4 O17 176.11(7) . 3 ?
O9 Rb4 O4 61.40(7) . 4_554 ?
O9 Rb4 O16 139.72(7) . 3 ?
O9 Rb4 O11 87.81(7) . . ?
O24 Rb4 O9 63.94(8) . . ?
O24 Rb4 O18 71.03(7) . 3 ?
O24 Rb4 O3 106.31(8) . . ?
O24 Rb4 O6 163.90(7) . . ?
O24 Rb4 O17 114.43(8) . 3 ?
O24 Rb4 O7 123.11(7) . . ?
O24 Rb4 O4 106.00(8) . 4_554 ?
O24 Rb4 O16 93.46(8) . 3 ?
O24 Rb4 O16 46.80(7) . . ?
O24 Rb4 O11 80.60(7) . . ?
O3 Rb4 O9 47.19(7) . . ?
O3 Rb4 O18 118.62(7) . 3 ?
O3 Rb4 O6 81.68(8) . . ?
O3 Rb4 O17 132.37(8) . 3 ?
O3 Rb4 O7 70.48(8) . . ?
O3 Rb4 O4 64.41(7) . 4_554 ?
O3 Rb4 O16 105.42(8) . . ?
O3 Rb4 O16 156.20(8) . 3 ?
O3 Rb4 O11 74.59(8) . . ?
O6 Rb4 O9 127.67(7) . . ?
O6 Rb4 O9 100.84(8) 4_554 . ?
O6 Rb4 O24 113.33(9) 4_554 . ?
O6 Rb4 O18 135.53(7) 4_554 3 ?
O6 Rb4 O18 92.89(7) . 3 ?
O6 Rb4 O3 102.95(9) 4_554 . ?
O6 Rb4 O6 77.40(10) 4_554 . ?
O6 Rb4 O17 53.14(7) . 3 ?
O6 Rb4 O17 83.04(8) 4_554 3 ?
O6 Rb4 O7 122.85(9) 4_554 . ?
O6 Rb4 O4 42.81(8) 4_554 4_554 ?
O6 Rb4 O4 90.03(8) . 4_554 ?
O6 Rb4 O16 55.97(8) 4_554 3 ?
O6 Rb4 O16 82.66(8) . 3 ?
O6 Rb4 O16 68.21(9) 4_554 . ?
O6 Rb4 O11 165.75(8) 4_554 . ?
O6 Rb4 O11 88.35(7) . . ?
O17 Rb4 O18 57.95(7) 3 3 ?
O17 Rb4 O4 122.36(8) 3 4_554 ?
O17 Rb4 O16 42.77(8) 3 3 ?
O7 Rb4 O9 110.47(8) . . ?
O7 Rb4 O18 63.63(7) . 3 ?
O7 Rb4 O6 45.56(7) . . ?
O7 Rb4 O17 67.14(8) . 3 ?
O7 Rb4 O4 120.27(8) . 4_554 ?
O7 Rb4 O16 168.54(8) . . ?
O7 Rb4 O16 109.80(8) . 3 ?
O7 Rb4 O11 42.93(7) . . ?
O4 Rb4 O18 176.08(8) 4_554 3 ?
O16 Rb4 O9 61.70(8) . . ?
O16 Rb4 O18 79.93(6) 3 3 ?
O16 Rb4 O18 111.49(8) . 3 ?
O16 Rb4 O6 145.61(7) . . ?
O16 Rb4 O17 120.14(8) . 3 ?
O16 Rb4 O4 64.77(8) . 4_554 ?
O16 Rb4 O4 97.86(7) 3 4_554 ?
O16 Rb4 O16 78.41(10) . 3 ?
O16 Rb4 O11 126.04(7) . . ?
O11 Rb4 O18 44.07(6) . 3 ?
O11 Rb4 O17 88.42(7) . 3 ?
O11 Rb4 O4 138.75(7) . 4_554 ?
O11 Rb4 O16 122.73(7) . 3 ?
O14 Rb1 O14 80.11(8) 4_655 1_655 ?
O14 Rb1 O1 163.77(7) 4_655 4_654 ?
O14 Rb1 O17 42.94(7) 4_655 4_655 ?
O14 Rb1 O5 94.20(8) 4_655 4_654 ?
O14 Rb1 O2 153.30(7) 4_655 4_654 ?
O14 Rb1 O2 102.88(8) 4_655 2_665 ?
O14 Rb1 O4 135.80(8) 4_655 4_654 ?
O14 Rb1 O23 42.87(7) 4_655 4_655 ?
O14 Rb1 O21 63.49(7) 4_655 . ?
O1 Rb1 O14 82.86(7) 2_665 1_655 ?
O1 Rb1 O14 105.77(8) 2_665 4_655 ?
O1 Rb1 O14 83.67(6) 4_654 1_655 ?
O1 Rb1 O1 72.66(9) 2_665 4_654 ?
O1 Rb1 O17 132.33(7) 4_654 4_655 ?
O1 Rb1 O17 145.74(8) 2_665 4_655 ?
O1 Rb1 O5 158.80(8) 2_665 4_654 ?
O1 Rb1 O2 45.31(7) 2_665 2_665 ?
O1 Rb1 O2 92.42(8) 2_665 4_654 ?
O1 Rb1 O2 41.18(6) 4_654 4_654 ?
O1 Rb1 O4 114.70(8) 2_665 4_654 ?
O1 Rb1 O23 138.35(7) 4_654 4_655 ?
O1 Rb1 O23 65.70(7) 2_665 4_655 ?
O1 Rb1 O21 104.35(7) 2_665 . ?
O17 Rb1 O14 78.40(7) 4_655 1_655 ?
O5 Rb1 O14 93.87(7) 4_654 1_655 ?
O5 Rb1 O1 86.17(7) 4_654 4_654 ?
O5 Rb1 O17 51.96(7) 4_654 4_655 ?
O5 Rb1 O2 137.14(7) 4_654 2_665 ?
O5 Rb1 O2 71.56(8) 4_654 4_654 ?
O5 Rb1 O4 44.11(7) 4_654 4_654 ?
O5 Rb1 O23 135.41(7) 4_654 4_655 ?
O5 Rb1 O21 90.75(8) 4_654 . ?
O2 Rb1 O14 122.25(7) 4_654 1_655 ?
O2 Rb1 O14 127.43(7) 2_665 1_655 ?
O2 Rb1 O1 87.53(8) 2_665 4_654 ?
O2 Rb1 O17 121.84(7) 4_654 4_655 ?
O2 Rb1 O17 137.62(8) 2_665 4_655 ?
O2 Rb1 O2 76.03(9) 2_665 4_654 ?
O2 Rb1 O4 117.85(8) 2_665 4_654 ?
O2 Rb1 O23 64.23(8) 2_665 4_655 ?
O2 Rb1 O23 139.43(8) 4_654 4_655 ?
O4 Rb1 O14 87.76(7) 4_654 1_655 ?
O4 Rb1 O1 42.06(7) 4_654 4_654 ?
O4 Rb1 O17 93.07(7) 4_654 4_655 ?
O4 Rb1 O2 42.87(8) 4_654 4_654 ?
O4 Rb1 O23 177.60(8) 4_654 4_655 ?
O23 Rb1 O14 89.97(7) 4_655 1_655 ?
O23 Rb1 O17 85.74(7) 4_655 4_655 ?
O20 Rb1 O14 107.41(8) . 4_655 ?
O20 Rb1 O14 164.62(7) . 1_655 ?
O20 Rb1 O1 107.17(8) . 2_665 ?
O20 Rb1 O1 88.21(7) . 4_654 ?
O20 Rb1 O17 97.79(8) . 4_655 ?
O20 Rb1 O5 72.51(8) . 4_654 ?
O20 Rb1 O2 47.37(7) . 4_654 ?
O20 Rb1 O2 64.94(8) . 2_665 ?
O20 Rb1 O4 77.51(8) . 4_654 ?
O20 Rb1 O23 104.70(8) . 4_655 ?
O20 Rb1 O21 46.51(7) . . ?
O21 Rb1 O14 143.56(6) . 1_655 ?
O21 Rb1 O1 132.74(7) . 4_654 ?
O21 Rb1 O17 76.24(7) . 4_655 ?
O21 Rb1 O2 93.47(7) . 4_654 ?
O21 Rb1 O2 63.81(8) . 2_665 ?
O21 Rb1 O4 119.19(8) . 4_654 ?
O21 Rb1 O23 62.54(7) . 4_655 ?
Rb2 P3 Rb2 78.47(2) . 4_655 ?
O24 P3 Rb2 105.71(11) . 4_655 ?
O24 P3 Rb2 170.35(12) . . ?
O18 P3 Rb2 70.63(12) . 4_655 ?
O18 P3 Rb2 81.95(12) . . ?
O18 P3 O24 107.59(17) . . ?
O18 P3 O22 110.70(17) . . ?
O22 P3 Rb2 69.97(11) . . ?
O22 P3 Rb2 42.88(10) . 4_655 ?
O22 P3 O24 106.94(16) . . ?
O15 P3 Rb2 146.51(12) . 4_655 ?
O15 P3 Rb2 69.81(11) . . ?
O15 P3 O24 104.14(16) . . ?
O15 P3 O18 113.88(17) . . ?
O15 P3 O22 113.00(16) . . ?
Rb1 P4 Rb4 130.34(3) 4_654 . ?
Rb1 P4 Rb4 150.22(3) 2_664 . ?
Rb1 P4 Rb1 79.43(2) 2_664 4_654 ?
O1 P4 Rb4 130.63(12) . . ?
O1 P4 Rb1 70.19(12) . 4_654 ?
O1 P4 Rb1 52.46(11) . 2_664 ?
O1 P4 O4 104.16(17) . . ?
O3 P4 Rb4 39.93(11) . . ?
O3 P4 Rb1 170.24(12) . 4_654 ?
O3 P4 Rb1 110.31(12) . 2_664 ?
O3 P4 O1 114.82(17) . . ?
O3 P4 O4 105.53(19) . . ?
O2 P4 Rb4 119.36(13) . . ?
O2 P4 Rb1 70.89(15) . 4_654 ?
O2 P4 Rb1 64.52(13) . 2_664 ?
O2 P4 O1 109.68(17) . . ?
O2 P4 O3 113.3(2) . . ?
O2 P4 O4 108.7(2) . . ?
O4 P4 Rb4 66.23(14) . . ?
O4 P4 Rb1 64.75(15) . 4_654 ?
O4 P4 Rb1 143.11(14) . 2_664 ?
Rb2 P5 Rb1 66.578(19) 4_654 4_654 ?
Rb4 P5 Rb2 145.68(3) 4_554 4_654 ?
Rb4 P5 Rb2 138.45(3) . 4_654 ?
Rb4 P5 Rb4 75.47(2) . 4_554 ?
Rb4 P5 Rb1 92.88(2) 4_554 4_654 ?
Rb4 P5 Rb1 135.75(3) . 4_654 ?
O6 P5 Rb2 136.79(14) . 4_654 ?
O6 P5 Rb4 63.73(14) . . ?
O6 P5 Rb4 40.59(11) . 4_554 ?
O6 P5 Rb1 129.48(13) . 4_654 ?
O6 P5 O7 105.81(17) . . ?
O6 P5 O5 120.5(2) . . ?
O6 P5 O4 105.06(19) . . ?
O6 P5 Li1 87.1(2) . 3_554 ?
O6 P5 Li1 30.38(18) . . ?
O7 P5 Rb2 80.73(11) . 4_654 ?
O7 P5 Rb4 132.82(12) . 4_554 ?
O7 P5 Rb4 57.72(11) . . ?
O7 P5 Rb1 123.87(12) . 4_654 ?
O7 P5 Li1 139.89(18) . 3_554 ?
O7 P5 Li1 93.01(18) . . ?
O5 P5 Rb2 30.65(11) . 4_654 ?
O5 P5 Rb4 115.07(12) . 4_554 ?
O5 P5 Rb4 168.38(13) . . ?
O5 P5 Rb1 51.63(15) . 4_654 ?
O5 P5 O7 111.17(16) . . ?
O5 P5 O4 107.7(2) . . ?
O5 P5 Li1 36.09(17) . 3_554 ?
O5 P5 Li1 102.3(2) . . ?
O4 P5 Rb2 114.31(15) . 4_654 ?
O4 P5 Rb4 80.15(15) . . ?
O4 P5 Rb4 68.96(13) . 4_554 ?
O4 P5 Rb1 56.10(15) . 4_654 ?
O4 P5 O7 105.53(18) . . ?
O4 P5 Li1 135.4(2) . . ?
O4 P5 Li1 107.37(19) . 3_554 ?
Li1 P5 Rb2 65.19(13) 3_554 4_654 ?
Li1 P5 Rb2 108.40(14) . 4_654 ?
Li1 P5 Rb4 68.78(13) . 4_554 ?
Li1 P5 Rb4 150.79(14) 3_554 . ?
Li1 P5 Rb4 76.30(15) . . ?
Li1 P5 Rb4 81.02(13) 3_554 4_554 ?
Li1 P5 Rb1 61.71(14) 3_554 4_654 ?
Li1 P5 Rb1 139.27(15) . 4_654 ?
Li1 P5 Li1 79.2(2) 3_554 . ?
Rb2 P7 Rb1 74.14(2) . . ?
Rb2 P7 Rb3 130.26(3) . 2_665 ?
Rb2 P7 Rb3 135.97(3) . 3_565 ?
Rb1 P7 Rb3 149.87(3) . 3_565 ?
Rb1 P7 Rb3 92.84(2) . 2_665 ?
Rb3 P7 Rb3 68.81(2) 3_565 2_665 ?
O20 P7 Rb2 67.72(11) . . ?
O20 P7 Rb1 47.01(10) . . ?
O20 P7 Rb3 133.98(11) . 2_665 ?
O20 P7 Rb3 132.82(12) . 3_565 ?
O20 P7 O12 111.81(17) . 3_565 ?
O12 P7 Rb2 177.28(13) 3_565 . ?
O12 P7 Rb1 107.60(11) 3_565 . ?
O12 P7 Rb3 52.11(12) 3_565 2_665 ?
O12 P7 Rb3 42.27(10) 3_565 3_565 ?
O21 P7 Rb2 72.97(12) . . ?
O21 P7 Rb1 63.55(12) . . ?
O21 P7 Rb3 58.64(12) . 2_665 ?
O21 P7 Rb3 119.19(13) . 3_565 ?
O21 P7 O20 106.14(16) . . ?
O21 P7 O12 109.63(17) . 3_565 ?
O19 P7 Rb2 69.65(12) . . ?
O19 P7 Rb1 142.76(13) . . ?
O19 P7 Rb3 117.10(13) . 2_665 ?
O19 P7 Rb3 66.68(12) . 3_565 ?
O19 P7 O20 108.88(17) . . ?
O19 P7 O12 108.29(17) . 3_565 ?
O19 P7 O21 112.13(18) . . ?
Rb4 P2 Rb4 78.09(3) 3 . ?
Rb4 P2 Rb1 133.30(3) 3 4_655 ?
Rb4 P2 Rb1 148.49(3) . 4_655 ?
O24 P2 Rb4 74.53(11) . 3 ?
O24 P2 Rb4 49.85(10) . . ?
O24 P2 Rb1 130.65(11) . 4_655 ?
O14 P2 Rb4 177.01(12) . 3 ?
O14 P2 Rb4 103.92(11) . . ?
O14 P2 Rb1 44.85(10) . 4_655 ?
O14 P2 O24 104.98(16) . . ?
O17 P2 Rb4 72.06(14) . 3 ?
O17 P2 Rb4 148.15(14) . . ?
O17 P2 Rb1 62.67(14) . 4_655 ?
O17 P2 O24 109.92(18) . . ?
O17 P2 O14 105.53(18) . . ?
O16 P2 Rb4 57.33(14) . . ?
O16 P2 Rb4 73.77(15) . 3 ?
O16 P2 Rb1 121.07(14) . 4_655 ?
O16 P2 O24 104.38(17) . . ?
O16 P2 O14 109.16(19) . . ?
O16 P2 O17 121.8(2) . . ?
Rb4 O9 Rb3 84.76(7) . . ?
P1 O9 Rb4 123.20(15) . . ?
P1 O9 Rb3 87.66(13) . . ?
P1 O9 Be1 141.7(3) . 4_554 ?
Be1 O9 Rb4 92.5(2) 4_554 . ?
Be1 O9 Rb3 82.1(2) 4_554 . ?
Rb4 O24 Rb4 90.15(7) . 3 ?
P3 O24 Rb4 103.59(13) . 3 ?
P3 O24 Rb4 124.59(14) . . ?
P2 O24 Rb4 79.77(11) . 3 ?
P2 O24 Rb4 105.35(12) . . ?
P2 O24 P3 129.71(19) . . ?
O3 Rb3 O23 44.89(7) . 3_565 ?
O3 Rb3 O19 127.42(7) . 3_565 ?
O3 Rb3 O8 70.98(7) . . ?
O3 Rb3 O8 138.34(7) . 4_654 ?
O3 Rb3 Be2 101.78(10) . 2_664 ?
O23 Rb3 Be2 62.41(10) 3_565 2_664 ?
O13 Rb3 O3 87.85(7) 3_565 . ?
O13 Rb3 O3 86.65(7) . . ?
O13 Rb3 O23 43.08(7) 3_565 3_565 ?
O13 Rb3 O23 74.37(7) . 3_565 ?
O13 Rb3 O13 74.74(9) . 3_565 ?
O13 Rb3 O12 163.76(7) . 4_654 ?
O13 Rb3 O21 46.46(7) 3_565 2_664 ?
O13 Rb3 O21 121.01(8) . 2_664 ?
O13 Rb3 O19 97.94(8) . 3_565 ?
O13 Rb3 O19 44.78(7) 3_565 3_565 ?
O13 Rb3 O11 103.37(8) . . ?
O13 Rb3 O8 103.60(7) . 4_654 ?
O13 Rb3 O8 133.79(6) 3_565 4_654 ?
O13 Rb3 O8 130.08(7) 3_565 . ?
O13 Rb3 O8 143.89(7) . . ?
O13 Rb3 Be2 99.98(10) . 2_664 ?
O13 Rb3 Be2 28.20(9) 3_565 2_664 ?
O12 Rb3 O3 86.25(7) 4_654 . ?
O12 Rb3 O3 162.63(8) . . ?
O12 Rb3 O23 90.35(7) 4_654 3_565 ?
O12 Rb3 O23 130.52(7) . 3_565 ?
O12 Rb3 O13 88.82(7) . 3_565 ?
O12 Rb3 O13 90.42(7) 4_654 3_565 ?
O12 Rb3 O13 108.87(8) . . ?
O12 Rb3 O12 76.73(9) . 4_654 ?
O12 Rb3 O21 43.98(6) 4_654 2_664 ?
O12 Rb3 O21 78.47(7) . 2_664 ?
O12 Rb3 O19 44.70(7) . 3_565 ?
O12 Rb3 O19 75.06(7) 4_654 3_565 ?
O12 Rb3 O11 106.54(8) . . ?
O12 Rb3 O8 47.08(7) . 4_654 ?
O12 Rb3 O8 98.55(8) . . ?
O12 Rb3 O8 45.05(7) 4_654 . ?
O12 Rb3 O8 91.37(7) 4_654 4_654 ?
O12 Rb3 Be2 68.60(10) . 2_664 ?
O12 Rb3 Be2 67.31(10) 4_654 2_664 ?
O21 Rb3 O3 86.92(7) 2_664 . ?
O21 Rb3 O23 60.72(7) 2_664 3_565 ?
O21 Rb3 O19 46.18(7) 2_664 3_565 ?
O21 Rb3 O8 118.91(7) 2_664 4_654 ?
O21 Rb3 O8 86.62(6) 2_664 . ?
O21 Rb3 Be2 26.31(10) 2_664 2_664 ?
O19 Rb3 O23 85.88(6) 3_565 3_565 ?
O19 Rb3 O8 91.57(6) 3_565 4_654 ?
O19 Rb3 O8 118.14(7) 3_565 . ?
O19 Rb3 Be2 25.70(10) 3_565 2_664 ?
O11 Rb3 O3 76.23(7) . . ?
O11 Rb3 O23 121.00(7) . 3_565 ?
O11 Rb3 O13 164.07(7) . 3_565 ?
O11 Rb3 O12 89.08(7) . 4_654 ?
O11 Rb3 O21 131.39(7) . 2_664 ?
O11 Rb3 O19 149.25(7) . 3_565 ?
O11 Rb3 O8 62.14(7) . 4_654 ?
O11 Rb3 O8 44.83(7) . . ?
O11 Rb3 Be2 156.38(10) . 2_664 ?
O8 Rb3 O23 105.23(7) . 3_565 ?
O8 Rb3 O23 176.46(7) 4_654 3_565 ?
O8 Rb3 O8 78.15(8) 4_654 . ?
O8 Rb3 Be2 111.88(10) . 2_664 ?
O8 Rb3 Be2 115.53(10) 4_654 2_664 ?
Rb1 P1 Rb1 74.12(2) 1_455 4_655 ?
Rb1 P1 Rb3 131.26(3) 1_455 3_565 ?
Rb1 P1 Rb3 88.36(2) 4_655 3_565 ?
O9 P1 Rb1 69.99(12) . 1_455 ?
O9 P1 Rb1 141.86(13) . 4_655 ?
O9 P1 Rb3 69.24(12) . . ?
O9 P1 Rb3 125.30(13) . 3_565 ?
O9 P1 O14 106.57(17) . . ?
O9 P1 O13 112.13(18) . . ?
Rb3 P1 Rb1 138.52(3) . 1_455 ?
Rb3 P1 Rb1 147.32(3) . 4_655 ?
Rb3 P1 Rb3 70.56(2) . 3_565 ?
O14 P1 Rb1 67.33(11) . 1_455 ?
O14 P1 Rb1 45.75(10) . 4_655 ?
O14 P1 Rb3 132.83(11) . . ?
O14 P1 Rb3 127.94(11) . 3_565 ?
O23 P1 Rb1 61.88(13) . 4_655 ?
O23 P1 Rb1 69.40(13) . 1_455 ?
O23 P1 O9 114.69(18) . . ?
O23 P1 Rb3 122.83(14) . . ?
O23 P1 Rb3 62.28(14) . 3_565 ?
O23 P1 O14 102.06(16) . . ?
O23 P1 O13 113.80(18) . . ?
O13 P1 Rb1 102.31(12) . 4_655 ?
O13 P1 Rb1 173.69(12) . 1_455 ?
O13 P1 Rb3 45.06(11) . . ?
O13 P1 Rb3 52.91(12) . 3_565 ?
O13 P1 O14 106.43(17) . . ?
Rb1 O14 Rb1 90.20(7) 4_655 1_455 ?
P2 O14 Rb1 101.66(13) . 1_455 ?
P2 O14 Rb1 113.37(13) . 4_655 ?
P2 O14 P1 133.46(19) . . ?
P1 O14 Rb1 111.88(14) . 4_655 ?
P1 O14 Rb1 88.44(12) . 1_455 ?
Rb2 O18 Rb2 79.77(6) 4_655 . ?
Rb2 O18 Rb4 105.69(8) 4_655 3 ?
Rb2 O18 Rb4 174.49(9) . 3 ?
P3 O18 Rb2 73.34(11) . . ?
P3 O18 Rb2 85.88(12) . 4_655 ?
P3 O18 Rb4 107.38(14) . 3 ?
P3 O18 Be3 146.0(3) . 3 ?
Be3 O18 Rb2 120.3(2) 3 4_655 ?
Be3 O18 Rb2 89.5(2) 3 . ?
Be3 O18 Rb4 87.2(2) 3 3 ?
Rb2 O22 Rb2 96.62(8) 4_655 . ?
P3 O22 Rb2 116.09(14) . 4_655 ?
P3 O22 Rb2 84.28(12) . . ?
P3 O22 Be2 131.7(3) . 4_655 ?
Be2 O22 Rb2 110.8(2) 4_655 4_655 ?
Be2 O22 Rb2 101.6(2) 4_655 . ?
Rb1 O1 Rb1 92.77(8) 2_664 4_654 ?
P4 O1 Rb1 103.99(13) . 2_664 ?
P4 O1 Rb1 85.65(12) . 4_654 ?
P4 O1 Be1 135.6(3) . . ?
Be1 O1 Rb1 105.9(2) . 4_654 ?
Be1 O1 Rb1 117.7(2) . 2_664 ?
Rb4 O3 Rb3 93.28(8) . . ?
P4 O3 Rb4 121.47(15) . . ?
P4 O3 Rb3 105.09(14) . . ?
P4 O3 Be1 129.4(3) . 4_554 ?
Be1 O3 Rb4 106.2(2) 4_554 . ?
Be1 O3 Rb3 86.8(2) 4_554 . ?
Rb4 O6 Rb4 96.17(10) 4_554 . ?
P5 O6 Rb4 92.22(15) . . ?
P5 O6 Rb4 119.74(15) . 4_554 ?
P5 O6 Li1 126.4(3) . . ?
Li1 O6 Rb4 109.1(2) . 4_554 ?
Li1 O6 Rb4 103.5(3) . . ?
Rb2 O17 Rb4 111.88(9) 4_655 3 ?
Rb2 O17 Rb1 77.67(7) 4_655 4_655 ?
Rb4 O17 Rb1 168.26(10) 3 4_655 ?
P2 O17 Rb2 126.01(17) . 4_655 ?
P2 O17 Rb4 84.34(15) . 3 ?
P2 O17 Rb1 95.55(15) . 4_655 ?
P2 O17 Li1 143.1(3) . 3 ?
Li1 O17 Rb2 88.6(2) 3 4_655 ?
Li1 O17 Rb4 94.9(3) 3 3 ?
Li1 O17 Rb1 78.1(2) 3 4_655 ?
P5 O7 Rb4 96.22(12) . . ?
P5 O7 P6 141.5(2) . . ?
P6 O7 Rb4 115.23(14) . . ?
Rb2 O5 Rb1 91.65(9) 4_654 4_654 ?
P5 O5 Rb2 133.61(16) . 4_654 ?
P5 O5 Rb1 107.47(17) . 4_654 ?
P5 O5 Li1 117.9(3) . 3_554 ?
Li1 O5 Rb2 105.3(2) 3_554 4_654 ?
Li1 O5 Rb1 84.9(2) 3_554 4_654 ?
Rb1 O2 Rb1 87.28(8) 2_664 4_654 ?
Rb1 O2 Rb3 106.39(10) 2_664 . ?
Rb1 O2 Rb3 165.16(10) 4_654 . ?
P4 O2 Rb1 85.42(15) . 4_654 ?
P4 O2 Rb1 91.64(13) . 2_664 ?
P4 O2 Rb3 99.63(16) . . ?
P4 O2 Be4 147.3(3) . 4_654 ?
Be4 O2 Rb1 88.1(2) 4_654 4_654 ?
Be4 O2 Rb1 120.1(2) 4_654 2_664 ?
Be4 O2 Rb3 80.1(2) 4_654 . ?
Rb1 O4 Rb4 109.18(9) 4_654 4_554 ?
P4 O4 Rb4 120.82(17) . 4_554 ?
P4 O4 Rb1 89.70(16) . 4_654 ?
P5 O4 Rb4 86.47(14) . 4_554 ?
P5 O4 Rb1 100.68(17) . 4_654 ?
P5 O4 P4 145.9(2) . . ?
Rb2 O15 Rb3 107.67(8) . . ?
P3 O15 Rb2 84.49(12) . . ?
P3 O15 Rb3 119.97(14) . . ?
P3 O15 Be3 146.1(3) . . ?
Be3 O15 Rb2 105.0(2) . . ?
Be3 O15 Rb3 88.6(2) . . ?
Rb4 O16 Rb4 87.36(8) . 3 ?
Rb4 O16 Rb1 158.32(10) 3 1_455 ?
Rb4 O16 Rb1 110.75(10) . 1_455 ?
P2 O16 Rb4 99.73(15) . . ?
P2 O16 Rb4 82.81(15) . 3 ?
P2 O16 Rb1 104.77(17) . 1_455 ?
P2 O16 Li1 137.9(3) . 2 ?
Li1 O16 Rb4 120.0(3) 2 . ?
Li1 O16 Rb4 85.7(2) 2 3 ?
Li1 O16 Rb1 75.0(2) 2 1_455 ?
Rb1 O23 Rb3 103.40(8) 4_655 3_565 ?
P1 O23 Rb1 95.85(13) . 4_655 ?
P1 O23 Rb3 95.65(15) . 3_565 ?
P1 O23 Be1 146.1(3) . 2_565 ?
Be1 O23 Rb1 117.4(3) 2_565 4_655 ?
Be1 O23 Rb3 83.6(2) 2_565 3_565 ?
Rb3 O13 Rb3 92.04(8) . 3_565 ?
P1 O13 Rb3 113.87(14) . . ?
P1 O13 Rb3 105.72(14) . 3_565 ?
P1 O13 Be2 131.8(3) . 4_655 ?
Be2 O13 Rb3 112.7(2) 4_655 . ?
Be2 O13 Rb3 84.2(2) 4_655 3_565 ?
Rb1 O20 Rb2 89.99(8) . . ?
P7 O20 Rb2 86.55(12) . . ?
P7 O20 Rb1 109.76(13) . . ?
P7 O20 Be4 132.9(3) . . ?
Be4 O20 Rb2 107.0(2) . . ?
Be4 O20 Rb1 114.9(2) . . ?
P7 O12 Rb3 106.03(14) 3_565 4_654 ?
P7 O12 Rb3 116.45(14) 3_565 . ?
P7 O12 Be4 128.6(3) 3_565 . ?
Rb3 O12 Rb3 91.58(8) . 4_654 ?
Be4 O12 Rb3 110.6(2) . . ?
Be4 O12 Rb3 91.7(2) . 4_654 ?
Rb2 O21 Rb3 168.13(10) . 2_665 ?
Rb1 O21 Rb2 80.76(7) . . ?
Rb1 O21 Rb3 111.02(9) . 2_665 ?
P7 O21 Rb2 81.60(13) . . ?
P7 O21 Rb1 91.73(13) . . ?
P7 O21 Rb3 98.93(14) . 2_665 ?
P7 O21 Be2 140.8(3) . . ?
Be2 O21 Rb2 90.8(2) . . ?
Be2 O21 Rb1 125.1(2) . . ?
Be2 O21 Rb3 81.3(2) . 2_665 ?
Rb2 O19 Rb3 107.92(9) . . ?
Rb2 O19 Rb3 172.15(10) . 3_565 ?
P7 O19 Rb2 84.96(12) . . ?
P7 O19 Rb3 116.92(15) . . ?
P7 O19 Rb3 89.69(13) . 3_565 ?
P7 O19 Be2 147.5(3) . 4_655 ?
Rb3 O19 Rb3 79.63(6) 3_565 . ?
Be2 O19 Rb2 101.8(2) 4_655 . ?
Be2 O19 Rb3 91.5(2) 4_655 . ?
Be2 O19 Rb3 79.8(2) 4_655 3_565 ?
Rb2 P6 Rb4 127.92(3) 4_654 . ?
Rb3 P6 Rb2 134.09(3) . 4_654 ?
Rb3 P6 Rb4 73.96(2) . . ?
O7 P6 Rb2 84.45(11) . 4_654 ?
O7 P6 Rb4 43.54(11) . . ?
O7 P6 Rb3 106.82(12) . . ?
O11 P6 Rb2 173.06(11) . 4_654 ?
O11 P6 Rb4 58.61(11) . . ?
O11 P6 Rb3 46.94(11) . . ?
O11 P6 O7 101.92(16) . . ?
O11 P6 O10 113.58(16) . . ?
O10 P6 Rb2 61.35(12) . 4_654 ?
O10 P6 Rb4 126.02(11) . . ?
O10 P6 Rb3 144.35(11) . . ?
O10 P6 O7 106.69(16) . . ?
O8 P6 Rb2 67.10(12) . 4_654 ?
O8 P6 Rb4 119.00(12) . . ?
O8 P6 Rb3 67.10(12) . . ?
O8 P6 O7 108.15(17) . . ?
O8 P6 O11 112.84(17) . . ?
O8 P6 O10 112.74(16) . . ?
Rb3 O11 Rb4 93.24(7) . . ?
P6 O11 Rb4 99.62(12) . . ?
P6 O11 Rb3 111.13(13) . . ?
P6 O11 Be3 132.6(3) . . ?
Be3 O11 Rb4 89.9(2) . . ?
Be3 O11 Rb3 114.6(2) . . ?
Rb2 O10 Rb2 97.23(8) 2_654 4_654 ?
P6 O10 Rb2 124.04(14) . 2_654 ?
P6 O10 Rb2 95.35(12) . 4_654 ?
P6 O10 Be3 122.6(3) . 4_654 ?
Be3 O10 Rb2 108.9(2) 4_654 2_654 ?
Be3 O10 Rb2 98.8(2) 4_654 4_654 ?
Rb3 O8 Rb2 105.37(8) 4_654 4_654 ?
Rb3 O8 Rb2 176.63(10) . 4_654 ?
Rb3 O8 Rb3 77.78(6) 4_654 . ?
P6 O8 Rb2 89.89(13) . 4_654 ?
P6 O8 Rb3 117.85(14) . 4_654 ?
P6 O8 Rb3 89.65(13) . . ?
P6 O8 Be4 153.6(3) . 4_654 ?
Be4 O8 Rb2 96.1(2) 4_654 4_654 ?
Be4 O8 Rb3 82.9(2) 4_654 . ?
Be4 O8 Rb3 85.3(2) 4_654 4_654 ?
Rb2 Be3 Rb2 75.15(9) 3 . ?
Rb2 Be3 Rb3 151.77(14) 3 . ?
Rb4 Be3 Rb2 133.65(13) . 3 ?
Rb4 Be3 Rb2 128.90(14) . . ?
Rb4 Be3 Rb3 74.33(9) . . ?
Rb3 Be3 Rb2 89.33(10) . . ?
O18 Be3 Rb2 65.95(19) 3 3 ?
O18 Be3 Rb2 121.8(3) 3 . ?
O18 Be3 Rb4 67.90(19) 3 . ?
O18 Be3 Rb3 141.0(2) 3 . ?
O18 Be3 O11 108.7(3) 3 . ?
O18 Be3 O10 112.1(3) 3 4_654 ?
O15 Be3 Rb2 52.15(18) . . ?
O15 Be3 Rb2 116.6(2) . 3 ?
O15 Be3 Rb4 77.1(2) . . ?
O15 Be3 Rb3 67.4(2) . . ?
O15 Be3 O18 111.6(3) . 3 ?
O15 Be3 O11 106.2(3) . . ?
O15 Be3 O10 108.2(3) . 4_654 ?
O11 Be3 Rb2 135.8(3) . 3 ?
O11 Be3 Rb2 129.2(2) . . ?
O11 Be3 Rb4 64.96(18) . . ?
O11 Be3 Rb3 43.24(17) . . ?
O11 Be3 O10 109.9(3) . 4_654 ?
O10 Be3 Rb2 47.33(17) 4_654 3 ?
O10 Be3 Rb2 56.74(18) 4_654 . ?
O10 Be3 Rb4 173.8(3) 4_654 . ?
O10 Be3 Rb3 104.4(2) 4_654 . ?
Rb1 Be4 Rb2 66.90(9) . . ?
Rb3 Be4 Rb2 130.98(15) 4_654 . ?
Rb3 Be4 Rb2 91.66(11) . . ?
Rb3 Be4 Rb1 139.35(14) 4_654 . ?
Rb3 Be4 Rb1 148.00(15) . . ?
Rb3 Be4 Rb3 72.64(10) 4_654 . ?
O2 Be4 Rb2 119.4(3) 4_654 . ?
O2 Be4 Rb1 66.5(2) 4_654 . ?
O2 Be4 Rb3 73.8(2) 4_654 4_654 ?
O2 Be4 Rb3 144.5(3) 4_654 . ?
O20 Be4 Rb2 50.67(19) . . ?
O20 Be4 Rb1 42.58(17) . . ?
O20 Be4 Rb3 105.5(2) . . ?
O20 Be4 Rb3 177.2(3) . 4_654 ?
O20 Be4 O2 107.5(3) . 4_654 ?
O20 Be4 O8 110.6(4) . 4_654 ?
O12 Be4 Rb2 133.5(2) . . ?
O12 Be4 Rb1 137.9(3) . . ?
O12 Be4 Rb3 62.4(2) . 4_654 ?
O12 Be4 Rb3 45.62(17) . . ?
O12 Be4 O2 107.1(3) . 4_654 ?
O12 Be4 O20 114.8(3) . . ?
O12 Be4 O8 106.5(3) . 4_654 ?
O8 Be4 Rb2 60.2(2) 4_654 . ?
O8 Be4 Rb1 114.8(3) 4_654 . ?
O8 Be4 Rb3 70.9(2) 4_654 4_654 ?
O8 Be4 Rb3 68.73(19) 4_654 . ?
O8 Be4 O2 110.3(3) 4_654 4_654 ?
Rb2 Be2 Rb2 72.67(9) . 4_655 ?
Rb2 Be2 Rb3 150.06(15) . 4_655 ?
Rb3 Be2 Rb2 89.97(11) 4_655 4_655 ?
Rb3 Be2 Rb2 129.37(15) 2_665 4_655 ?
Rb3 Be2 Rb2 135.86(15) 2_665 . ?
Rb3 Be2 Rb3 73.95(10) 2_665 4_655 ?
O22 Be2 Rb2 54.09(18) 4_655 4_655 ?
O22 Be2 Rb2 44.99(17) 4_655 . ?
O22 Be2 Rb3 176.1(3) 4_655 2_665 ?
O22 Be2 Rb3 105.1(2) 4_655 4_655 ?
O22 Be2 O13 109.0(3) 4_655 4_655 ?
O13 Be2 Rb2 128.8(3) 4_655 4_655 ?
O13 Be2 Rb2 133.7(3) 4_655 . ?
O13 Be2 Rb3 67.60(19) 4_655 2_665 ?
O13 Be2 Rb3 44.02(17) 4_655 4_655 ?
O21 Be2 Rb2 64.3(2) . . ?
O21 Be2 Rb2 122.9(3) . 4_655 ?
O21 Be2 Rb3 72.4(2) . 2_665 ?
O21 Be2 Rb3 143.3(3) . 4_655 ?
O21 Be2 O22 107.5(3) . 4_655 ?
O21 Be2 O13 108.1(3) . 4_655 ?
O19 Be2 Rb2 118.6(3) 4_655 . ?
O19 Be2 Rb2 55.4(2) 4_655 4_655 ?
O19 Be2 Rb3 74.5(2) 4_655 2_665 ?
O19 Be2 Rb3 65.1(2) 4_655 4_655 ?
O19 Be2 O22 108.6(3) 4_655 4_655 ?
O19 Be2 O13 105.4(3) 4_655 4_655 ?
O19 Be2 O21 118.1(4) 4_655 . ?
Rb2 Li1 Rb4 91.71(15) 2_654 . ?
Rb2 Li1 Rb4 127.04(19) 2_654 2_554 ?
Rb2 Li1 Rb4 150.4(2) 2_654 4_554 ?
Rb4 Li1 Rb4 136.22(17) . 2_554 ?
Rb4 Li1 Rb4 68.87(12) 4_554 . ?
Rb4 Li1 Rb4 67.40(11) 4_554 2_554 ?
Rb1 Li1 Rb2 70.92(13) 2_654 2_654 ?
Rb1 Li1 Rb4 87.30(14) 2_654 2_554 ?
Rb1 Li1 Rb4 128.9(2) 2_654 . ?
Rb1 Li1 Rb4 138.66(19) 2_654 4_554 ?
P5 Li1 Rb2 85.74(16) . 2_654 ?
P5 Li1 Rb2 69.75(14) 3_554 2_654 ?
P5 Li1 Rb4 65.22(13) . 4_554 ?
P5 Li1 Rb4 114.5(2) 3_554 4_554 ?
P5 Li1 Rb4 57.62(12) 3_554 2_554 ?
P5 Li1 Rb4 146.6(2) 3_554 . ?
P5 Li1 Rb4 58.43(13) . . ?
P5 Li1 Rb4 100.45(18) . 2_554 ?
P5 Li1 Rb1 72.39(16) 3_554 2_654 ?
P5 Li1 Rb1 155.0(2) . 2_654 ?
P5 Li1 P5 91.7(2) 3_554 . ?
O6 Li1 Rb2 106.8(3) . 2_654 ?
O6 Li1 Rb4 94.7(3) . 2_554 ?
O6 Li1 Rb4 49.9(2) . . ?
O6 Li1 Rb4 43.60(17) . 4_554 ?
O6 Li1 Rb1 177.6(3) . 2_654 ?
O6 Li1 P5 107.7(3) . 3_554 ?
O6 Li1 P5 23.17(14) . . ?
O6 Li1 O5 116.6(4) . 3_554 ?
O6 Li1 O16 107.7(4) . 2_554 ?
O17 Li1 Rb2 61.9(2) 3 2_654 ?
O17 Li1 Rb4 118.7(3) 3 4_554 ?
O17 Li1 Rb4 153.2(3) 3 2_554 ?
O17 Li1 Rb4 58.1(2) 3 . ?
O17 Li1 Rb1 71.6(2) 3 2_654 ?
O17 Li1 P5 126.6(3) 3 3_554 ?
O17 Li1 P5 105.6(3) 3 . ?
O17 Li1 O6 106.8(4) 3 . ?
O17 Li1 O5 101.1(3) 3 3_554 ?
O17 Li1 O16 117.6(4) 3 2_554 ?
O5 Li1 Rb2 44.58(16) 3_554 2_654 ?
O5 Li1 Rb4 138.6(3) 3_554 4_554 ?
O5 Li1 Rb4 132.7(3) 3_554 . ?
O5 Li1 Rb4 82.5(2) 3_554 2_554 ?
O5 Li1 Rb1 62.4(2) 3_554 2_654 ?
O5 Li1 P5 94.9(3) 3_554 . ?
O5 Li1 P5 26.03(14) 3_554 3_554 ?
O16 Li1 Rb2 143.5(3) 2_554 2_654 ?
O16 Li1 Rb4 65.2(2) 2_554 4_554 ?
O16 Li1 Rb4 38.19(19) 2_554 2_554 ?
O16 Li1 Rb4 119.9(3) 2_554 . ?
O16 Li1 Rb1 74.7(2) 2_554 2_654 ?
O16 Li1 P5 88.5(3) 2_554 3_554 ?
O16 Li1 P5 125.2(3) 2_554 . ?
O16 Li1 O5 107.4(4) 2_554 3_554 ?
Rb4 Be1 Rb1 145.55(14) 4_554 2_664 ?
O9 Be1 Rb4 62.5(2) 4_554 4_554 ?
O9 Be1 Rb1 121.4(3) 4_554 2_664 ?
O9 Be1 Rb3 72.4(2) 4_554 4_554 ?
O9 Be1 O3 105.5(3) 4_554 4_554 ?
O9 Be1 O23 112.2(4) 4_554 2_564 ?
Rb3 Be1 Rb4 77.12(11) 4_554 4_554 ?
Rb3 Be1 Rb1 137.27(15) 4_554 2_664 ?
O1 Be1 Rb4 104.2(2) . 4_554 ?
O1 Be1 Rb1 41.39(18) . 2_664 ?
O1 Be1 O9 112.2(4) . 4_554 ?
O1 Be1 Rb3 175.3(3) . 4_554 ?
O1 Be1 O3 110.3(4) . 4_554 ?
O1 Be1 O23 107.3(4) . 2_564 ?
O3 Be1 Rb4 49.46(18) 4_554 4_554 ?
O3 Be1 Rb1 131.2(3) 4_554 2_664 ?
O3 Be1 Rb3 67.1(2) 4_554 4_554 ?
O23 Be1 Rb4 147.2(3) 2_564 4_554 ?
O23 Be1 Rb1 66.6(2) 2_564 2_664 ?
O23 Be1 Rb3 70.8(2) 2_564 4_554 ?
O23 Be1 O3 109.4(4) 2_564 4_554 ?

_olex2_submission_special_instructions 'No special instructions were received'
