# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2023

####################################################################### 
# 
# 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_a
_database_code_depnum_ccdc_archive 'CCDC 2216613'
loop_
_audit_author_name
_audit_author_address
'Sheng-Ping Guo'
;Yangzhou University
China
;
_audit_update_record             
;
2022-10-31 deposited with the CCDC.	2023-03-03 downloaded from the CCDC.
;
_audit_creation_date             2022-07-29
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'Eu3 Ge O S4'
_chemical_formula_sum            'Eu3 Ge O S4'
_chemical_formula_weight         672.71
_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
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 '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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           29
_space_group_name_H-M_alt        'P c a 21'
_space_group_name_Hall           'P 2c -2ac'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z+1/2'
'x+1/2, -y, z'
'-x+1/2, y, z+1/2'

_cell_length_a                   11.7433(6)
_cell_length_b                   5.9456(3)
_cell_length_c                   11.6103(6)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     810.64(7)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    5041
_cell_measurement_temperature    296
_cell_measurement_theta_max      27.51
_cell_measurement_theta_min      3.43
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    27.504
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.5936
_exptl_absorpt_correction_type   MULTI-SCAN
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0845 before and 0.0450 after correction.
The Ratio of minimum to maximum transmission is 0.7961.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    5.512
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1172
_exptl_crystal_size_max          0.03
_exptl_crystal_size_mid          0.02
_exptl_crystal_size_min          0.01
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0271
_diffrn_reflns_av_unetI/netI     0.0287
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       7
_diffrn_reflns_limit_k_min       -7
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            5391
_diffrn_reflns_point_group_measured_fraction_full 0.975
_diffrn_reflns_point_group_measured_fraction_max 0.965
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.485
_diffrn_reflns_theta_min         3.427
_diffrn_ambient_temperature      296
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.834
_reflns_Friedel_fraction_full    0.948
_reflns_Friedel_fraction_max     0.926
_reflns_number_gt                1617
_reflns_number_total             1634
_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. Completness statistics refer to single and
 composite reflections containing twin component 1 only.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'SAINT v8.37A (Bruker, 2015)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT v8.37A (Bruker, 2015)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         0.579
_refine_diff_density_min         -0.907
_refine_diff_density_rms         0.202
_refine_ls_abs_structure_details 
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   0.116(18)
_refine_ls_extinction_coef       0.0099(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.071
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     84
_refine_ls_number_reflns         1634
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0143
_refine_ls_R_factor_gt           0.0140
_refine_ls_restrained_S_all      1.071
_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)] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0281
_refine_ls_wR_factor_ref         0.0282
_refine_special_details          
;
 Refined as a 2-component inversion twin.
;
_olex2_refinement_description    
;
1. Twinned data refinement
 Scales: 0.884(18)
 0.116(18)
;
_atom_sites_solution_hydrogens   .
_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
Eu3 Eu 0.29904(3) 0.03601(5) 0.24761(4) 0.00842(9) Uani 1 1 d . . . . .
Eu1 Eu 0.01900(3) 0.41543(5) 0.24161(3) 0.00832(10) Uani 1 1 d . . . . .
Eu2 Eu 0.26930(3) 0.60094(5) 0.00588(3) 0.00830(10) Uani 1 1 d . . . . .
Ge1 Ge 0.00477(7) 0.00673(16) 0.00000(9) 0.00555(14) Uani 1 1 d . . . . .
S2 S 0.26760(13) 0.5214(3) 0.25806(18) 0.0073(3) Uani 1 1 d . . . . .
S3 S 0.49891(14) 0.3639(3) 0.01125(19) 0.0091(3) Uani 1 1 d . . . . .
S4 S 0.54969(15) 0.0844(3) 0.32198(16) 0.0088(4) Uani 1 1 d . . . . .
S1 S 0.18675(13) 0.0961(3) 0.01571(18) 0.0091(4) Uani 1 1 d . . . . .
O1 O 0.4206(4) -0.1510(8) 0.1002(4) 0.0083(10) 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
Eu3 Eu1 3.7258(5) 3 ?
Eu3 Eu1 4.1611(5) 3_565 ?
Eu3 Eu1 3.9885(5) . ?
Eu3 Eu2 4.0407(6) 4_545 ?
Eu3 Eu2 3.8328(6) 1_545 ?
Eu3 S2 3.0843(15) 1_545 ?
Eu3 S2 2.9119(15) . ?
Eu3 S4 3.0810(18) . ?
Eu3 S4 3.1357(18) 3_455 ?
Eu3 S1 3.138(2) 4 ?
Eu3 S1 3.019(2) . ?
Eu3 O1 2.491(5) . ?
Eu1 Eu2 4.0123(5) 3_465 ?
Eu1 Eu2 4.1001(5) 4 ?
Eu1 Ge1 3.7151(11) . ?
Eu1 S2 2.9926(16) . ?
Eu1 S2 2.9822(16) 3_465 ?
Eu1 S3 3.153(2) 4 ?
Eu1 S3 2.988(2) 3_465 ?
Eu1 S4 3.1375(17) 3_465 ?
Eu1 S4 3.1357(17) 3_455 ?
Eu1 O1 2.550(5) 3_455 ?
Eu2 Ge1 3.6183(9) 3_565 ?
Eu2 S2 2.948(2) 4_554 ?
Eu2 S2 2.966(2) . ?
Eu2 S3 3.1827(16) 3_465 ?
Eu2 S3 3.0433(16) . ?
Eu2 S1 3.1018(18) 1_565 ?
Eu2 S1 3.1561(17) . ?
Eu2 O1 2.556(5) 1_565 ?
Ge1 S3 2.2083(18) 3_455 ?
Ge1 S4 2.212(2) 4_554 ?
Ge1 S1 2.2098(17) . ?
Ge1 O1 1.751(4) 3_455 ?

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
Eu1 Eu3 Eu1 168.169(12) 3 . ?
Eu1 Eu3 Eu1 97.699(12) 3 3_565 ?
Eu1 Eu3 Eu1 93.912(8) . 3_565 ?
Eu1 Eu3 Eu2 102.198(11) . 4_545 ?
Eu1 Eu3 Eu2 64.104(10) 3 1_545 ?
Eu1 Eu3 Eu2 71.963(10) 3 4_545 ?
Eu2 Eu3 Eu1 107.087(12) 1_545 . ?
Eu2 Eu3 Eu1 124.982(14) 1_545 3_565 ?
Eu2 Eu3 Eu1 129.605(14) 4_545 3_565 ?
Eu2 Eu3 Eu2 95.350(10) 1_545 4_545 ?
S2 Eu3 Eu1 148.49(3) 1_545 3_565 ?
S2 Eu3 Eu1 117.59(3) 1_545 . ?
S2 Eu3 Eu1 143.38(3) . 3 ?
S2 Eu3 Eu1 50.88(3) 1_545 3 ?
S2 Eu3 Eu1 45.78(3) . 3_565 ?
S2 Eu3 Eu1 48.37(3) . . ?
S2 Eu3 Eu2 133.46(4) . 1_545 ?
S2 Eu3 Eu2 46.52(4) 1_545 4_545 ?
S2 Eu3 Eu2 49.33(4) 1_545 1_545 ?
S2 Eu3 Eu2 125.33(4) . 4_545 ?
S2 Eu3 S2 165.09(7) . 1_545 ?
S2 Eu3 S4 90.97(5) . . ?
S2 Eu3 S4 95.53(5) . 3_455 ?
S2 Eu3 S4 69.57(4) 1_545 3_455 ?
S2 Eu3 S1 94.61(5) 1_545 4 ?
S2 Eu3 S1 82.21(5) . . ?
S2 Eu3 S1 81.52(5) . 4 ?
S4 Eu3 Eu1 50.51(3) 3_455 . ?
S4 Eu3 Eu1 139.75(3) 3_455 3_565 ?
S4 Eu3 Eu1 137.71(3) . . ?
S4 Eu3 Eu1 119.21(3) 3_455 3 ?
S4 Eu3 Eu1 48.58(3) . 3_565 ?
S4 Eu3 Eu1 53.85(3) . 3 ?
S4 Eu3 Eu2 87.85(3) 3_455 1_545 ?
S4 Eu3 Eu2 57.59(3) 3_455 4_545 ?
S4 Eu3 Eu2 110.81(3) . 1_545 ?
S4 Eu3 Eu2 92.38(3) . 4_545 ?
S4 Eu3 S2 101.30(4) . 1_545 ?
S4 Eu3 S4 146.75(7) . 3_455 ?
S4 Eu3 S1 70.15(5) . 4 ?
S4 Eu3 S1 78.61(4) 3_455 4 ?
S1 Eu3 Eu1 99.40(3) . 3_565 ?
S1 Eu3 Eu1 111.80(4) . 3 ?
S1 Eu3 Eu1 63.73(3) . . ?
S1 Eu3 Eu1 93.65(3) 4 3 ?
S1 Eu3 Eu1 83.93(3) 4 3_565 ?
S1 Eu3 Eu1 89.81(3) 4 . ?
S1 Eu3 Eu2 130.60(3) . 4_545 ?
S1 Eu3 Eu2 49.25(3) 4 4_545 ?
S1 Eu3 Eu2 143.92(4) 4 1_545 ?
S1 Eu3 Eu2 52.20(3) . 1_545 ?
S1 Eu3 S2 95.75(5) . 1_545 ?
S1 Eu3 S4 131.00(5) . . ?
S1 Eu3 S4 82.23(5) . 3_455 ?
S1 Eu3 S1 153.43(4) . 4 ?
O1 Eu3 Eu1 88.99(10) . 3_565 ?
O1 Eu3 Eu1 42.95(10) . 3 ?
O1 Eu3 Eu1 135.49(11) . . ?
O1 Eu3 Eu2 41.23(10) . 1_545 ?
O1 Eu3 Eu2 109.75(10) . 4_545 ?
O1 Eu3 S2 122.93(11) . . ?
O1 Eu3 S2 69.69(11) . 1_545 ?
O1 Eu3 S4 128.51(11) . 3_455 ?
O1 Eu3 S4 71.73(11) . . ?
O1 Eu3 S1 71.97(11) . . ?
O1 Eu3 S1 134.58(11) . 4 ?
Eu3 Eu1 Eu3 99.430(8) 3_455 . ?
Eu3 Eu1 Eu2 126.925(11) . 3_465 ?
Eu3 Eu1 Eu2 126.882(13) 3_455 4 ?
Eu3 Eu1 Eu2 59.242(10) 3_455 3_465 ?
Eu3 Eu1 Eu2 68.848(10) . 4 ?
Eu2 Eu1 Eu2 163.762(9) 3_465 4 ?
Ge1 Eu1 Eu3 71.357(15) . . ?
Ge1 Eu1 Eu3 60.771(14) . 3_455 ?
Ge1 Eu1 Eu2 140.200(18) . 4 ?
Ge1 Eu1 Eu2 55.681(15) . 3_465 ?
S2 Eu1 Eu3 46.66(3) . . ?
S2 Eu1 Eu3 145.77(3) . 3_455 ?
S2 Eu1 Eu3 152.42(3) 3_465 . ?
S2 Eu1 Eu3 53.36(3) 3_465 3_455 ?
S2 Eu1 Eu2 121.23(4) 3_465 4 ?
S2 Eu1 Eu2 47.41(4) 3_465 3_465 ?
S2 Eu1 Eu2 139.60(4) . 3_465 ?
S2 Eu1 Eu2 45.90(4) . 4 ?
S2 Eu1 Ge1 103.28(4) . . ?
S2 Eu1 Ge1 94.94(4) 3_465 . ?
S2 Eu1 S2 159.25(3) 3_465 . ?
S2 Eu1 S3 83.26(5) 3_465 4 ?
S2 Eu1 S3 91.27(5) . 4 ?
S2 Eu1 S3 85.63(5) 3_465 3_465 ?
S2 Eu1 S4 88.58(4) 3_465 3_465 ?
S2 Eu1 S4 93.92(5) . 3_455 ?
S2 Eu1 S4 70.70(4) . 3_465 ?
S2 Eu1 S4 102.36(5) 3_465 3_455 ?
S3 Eu1 Eu3 106.16(3) 3_465 3_455 ?
S3 Eu1 Eu3 82.25(3) 4 3_455 ?
S3 Eu1 Eu3 109.21(3) 3_465 . ?
S3 Eu1 Eu3 89.01(3) 4 . ?
S3 Eu1 Eu2 128.77(3) 4 3_465 ?
S3 Eu1 Eu2 47.43(3) 4 4 ?
S3 Eu1 Eu2 126.83(3) 3_465 4 ?
S3 Eu1 Eu2 48.89(3) 3_465 3_465 ?
S3 Eu1 Ge1 133.09(3) 4 . ?
S3 Eu1 Ge1 66.91(4) 3_465 . ?
S3 Eu1 S2 92.39(5) 3_465 . ?
S3 Eu1 S3 157.84(2) 3_465 4 ?
S3 Eu1 S4 81.90(5) 3_465 3_465 ?
S3 Eu1 S4 133.75(5) 3_465 3_455 ?
S4 Eu1 Eu3 50.51(3) 3_455 . ?
S4 Eu1 Eu3 139.19(4) 3_465 3_455 ?
S4 Eu1 Eu3 115.86(3) 3_465 . ?
S4 Eu1 Eu3 52.51(3) 3_455 3_455 ?
S4 Eu1 Eu2 56.83(3) 3_465 4 ?
S4 Eu1 Eu2 87.85(3) 3_455 4 ?
S4 Eu1 Eu2 108.05(3) 3_465 3_465 ?
S4 Eu1 Eu2 105.31(3) 3_455 3_465 ?
S4 Eu1 Ge1 148.18(4) 3_465 . ?
S4 Eu1 Ge1 67.04(4) 3_455 . ?
S4 Eu1 S3 67.66(4) 3_455 4 ?
S4 Eu1 S3 78.73(5) 3_465 4 ?
S4 Eu1 S4 142.80(6) 3_455 3_465 ?
O1 Eu1 Eu3 92.06(10) 3_455 . ?
O1 Eu1 Eu3 41.73(10) 3_455 3_455 ?
O1 Eu1 Eu2 157.27(11) 3_455 4 ?
O1 Eu1 Eu2 38.26(10) 3_455 3_465 ?
O1 Eu1 Ge1 24.51(10) 3_455 . ?
O1 Eu1 S2 127.79(10) 3_455 . ?
O1 Eu1 S2 70.76(10) 3_455 3_465 ?
O1 Eu1 S3 123.31(11) 3_455 4 ?
O1 Eu1 S3 70.05(11) 3_455 3_465 ?
O1 Eu1 S4 70.08(11) 3_455 3_455 ?
O1 Eu1 S4 145.89(11) 3_455 3_465 ?
Eu3 Eu2 Eu3 97.437(11) 1_565 4_564 ?
Eu3 Eu2 Eu1 132.397(12) 1_565 4_554 ?
Eu3 Eu2 Eu1 74.769(11) 4_564 4_554 ?
Eu3 Eu2 Eu1 56.653(9) 1_565 3_565 ?
Eu1 Eu2 Eu3 131.826(11) 3_565 4_564 ?
Eu1 Eu2 Eu1 93.485(8) 3_565 4_554 ?
Ge1 Eu2 Eu3 60.598(17) 3_565 1_565 ?
Ge1 Eu2 Eu3 74.041(18) 3_565 4_564 ?
Ge1 Eu2 Eu1 72.298(18) 3_565 4_554 ?
Ge1 Eu2 Eu1 57.994(17) 3_565 3_565 ?
S2 Eu2 Eu3 146.76(3) 4_554 1_565 ?
S2 Eu2 Eu3 52.07(3) . 1_565 ?
S2 Eu2 Eu3 146.44(3) . 4_564 ?
S2 Eu2 Eu3 49.40(3) 4_554 4_564 ?
S2 Eu2 Eu1 46.81(3) 4_554 4_554 ?
S2 Eu2 Eu1 47.75(3) . 3_565 ?
S2 Eu2 Eu1 134.42(3) . 4_554 ?
S2 Eu2 Eu1 140.29(3) 4_554 3_565 ?
S2 Eu2 Ge1 101.38(4) 4_554 3_565 ?
S2 Eu2 Ge1 97.27(4) . 3_565 ?
S2 Eu2 S2 159.55(5) 4_554 . ?
S2 Eu2 S3 94.35(5) 4_554 . ?
S2 Eu2 S3 84.95(5) . . ?
S2 Eu2 S3 83.28(5) 4_554 3_465 ?
S2 Eu2 S3 89.11(5) . 3_465 ?
S2 Eu2 S1 79.08(5) . . ?
S2 Eu2 S1 98.18(5) 4_554 1_565 ?
S2 Eu2 S1 96.48(5) . 1_565 ?
S2 Eu2 S1 80.65(5) 4_554 . ?
S3 Eu2 Eu3 119.19(4) . 4_564 ?
S3 Eu2 Eu3 91.84(4) 3_465 1_565 ?
S3 Eu2 Eu3 76.96(4) 3_465 4_564 ?
S3 Eu2 Eu3 102.53(4) . 1_565 ?
S3 Eu2 Eu1 47.72(4) . 3_565 ?
S3 Eu2 Eu1 129.59(4) 3_465 4_554 ?
S3 Eu2 Eu1 49.72(4) . 4_554 ?
S3 Eu2 Eu1 135.84(4) 3_465 3_565 ?
S3 Eu2 Ge1 67.78(3) . 3_565 ?
S3 Eu2 Ge1 136.09(3) 3_465 3_565 ?
S3 Eu2 S3 156.06(2) . 3_465 ?
S3 Eu2 S1 80.27(4) . . ?
S3 Eu2 S1 135.71(4) . 1_565 ?
S1 Eu2 Eu3 50.28(4) 1_565 1_565 ?
S1 Eu2 Eu3 130.04(4) . 1_565 ?
S1 Eu2 Eu3 125.08(4) . 4_564 ?
S1 Eu2 Eu3 50.03(4) 1_565 4_564 ?
S1 Eu2 Eu1 100.18(4) . 3_565 ?
S1 Eu2 Eu1 87.56(4) . 4_554 ?
S1 Eu2 Eu1 118.19(4) 1_565 4_554 ?
S1 Eu2 Eu1 103.08(4) 1_565 3_565 ?
S1 Eu2 Ge1 148.05(3) . 3_565 ?
S1 Eu2 Ge1 68.13(3) 1_565 3_565 ?
S1 Eu2 S3 67.98(4) 1_565 3_465 ?
S1 Eu2 S3 75.84(4) . 3_465 ?
S1 Eu2 S1 143.65(5) 1_565 . ?
O1 Eu2 Eu3 94.97(10) 1_565 4_564 ?
O1 Eu2 Eu3 39.95(10) 1_565 1_565 ?
O1 Eu2 Eu1 38.15(10) 1_565 3_565 ?
O1 Eu2 Eu1 93.11(10) 1_565 4_554 ?
O1 Eu2 Ge1 26.46(10) 1_565 3_565 ?
O1 Eu2 S2 127.80(10) 1_565 4_554 ?
O1 Eu2 S2 70.96(11) 1_565 . ?
O1 Eu2 S3 130.34(10) 1_565 3_465 ?
O1 Eu2 S3 69.05(10) 1_565 . ?
O1 Eu2 S1 69.74(10) 1_565 1_565 ?
O1 Eu2 S1 138.32(11) 1_565 . ?
Eu2 Ge1 Eu1 66.325(19) 3_465 . ?
S3 Ge1 Eu1 127.54(7) 3_455 . ?
S3 Ge1 Eu2 128.19(5) 3_455 3_465 ?
S3 Ge1 S4 104.75(8) 3_455 4_554 ?
S3 Ge1 S1 105.38(7) 3_455 . ?
S4 Ge1 Eu1 125.58(6) 4_554 . ?
S4 Ge1 Eu2 70.25(5) 4_554 3_465 ?
S1 Ge1 Eu1 74.74(6) . . ?
S1 Ge1 Eu2 125.62(6) . 3_465 ?
S1 Ge1 S4 107.85(8) . 4_554 ?
O1 Ge1 Eu1 37.17(15) 3_455 . ?
O1 Ge1 Eu2 40.57(16) 3_455 3_465 ?
O1 Ge1 S3 115.59(17) 3_455 3_455 ?
O1 Ge1 S4 110.82(17) 3_455 4_554 ?
O1 Ge1 S1 111.90(16) 3_455 . ?
Eu3 S2 Eu3 165.09(7) . 1_565 ?
Eu3 S2 Eu1 84.97(4) . . ?
Eu3 S2 Eu1 89.81(4) . 3_565 ?
Eu3 S2 Eu2 96.66(6) . . ?
Eu3 S2 Eu2 102.61(6) . 4 ?
Eu1 S2 Eu3 75.76(4) 3_565 1_565 ?
Eu1 S2 Eu3 108.85(5) . 1_565 ?
Eu1 S2 Eu1 171.17(8) 3_565 . ?
Eu2 S2 Eu3 78.59(5) . 1_565 ?
Eu2 S2 Eu3 84.08(4) 4 1_565 ?
Eu2 S2 Eu1 100.83(6) 4 3_565 ?
Eu2 S2 Eu1 88.69(5) . . ?
Eu2 S2 Eu1 87.29(5) 4 . ?
Eu2 S2 Eu1 84.84(5) . 3_565 ?
Eu2 S2 Eu2 159.87(6) 4 . ?
Eu1 S3 Eu1 148.35(6) 3_565 4_554 ?
Eu1 S3 Eu2 83.39(5) 3_565 . ?
Eu1 S3 Eu2 84.83(5) 3_565 3_565 ?
Eu1 S3 Eu2 92.33(5) 4_554 3_565 ?
Eu2 S3 Eu1 82.85(5) . 4_554 ?
Eu2 S3 Eu2 148.55(6) . 3_565 ?
Ge1 S3 Eu1 119.25(9) 3 3_565 ?
Ge1 S3 Eu1 92.32(7) 3 4_554 ?
Ge1 S3 Eu2 91.91(5) 3 3_565 ?
Ge1 S3 Eu2 119.24(6) 3 . ?
Eu3 S4 Eu3 142.53(7) . 3 ?
Eu3 S4 Eu1 84.00(4) . 3_565 ?
Eu3 S4 Eu1 103.99(5) 3 3_565 ?
Eu3 S4 Eu1 73.64(4) . 3 ?
Eu1 S4 Eu3 78.99(4) 3 3 ?
Eu1 S4 Eu1 142.80(6) 3 3_565 ?
Ge1 S4 Eu3 88.06(6) 4 . ?
Ge1 S4 Eu3 118.66(7) 4 3 ?
Ge1 S4 Eu1 92.69(6) 4 3 ?
Ge1 S4 Eu1 116.27(7) 4 3_565 ?
Eu3 S1 Eu3 147.99(6) . 4_554 ?
Eu3 S1 Eu2 90.61(5) . . ?
Eu3 S1 Eu2 77.52(4) . 1_545 ?
Eu3 S1 Eu2 93.22(5) 4_554 . ?
Eu2 S1 Eu3 80.72(5) 1_545 4_554 ?
Eu2 S1 Eu2 143.64(5) 1_545 . ?
Ge1 S1 Eu3 86.68(7) . 4_554 ?
Ge1 S1 Eu3 117.87(8) . . ?
Ge1 S1 Eu2 94.06(6) . 1_545 ?
Ge1 S1 Eu2 121.52(7) . . ?
Eu3 O1 Eu1 95.31(16) . 3 ?
Eu3 O1 Eu2 98.82(15) . 1_545 ?
Eu1 O1 Eu2 103.59(16) 3 1_545 ?
Ge1 O1 Eu3 124.2(2) 3 . ?
Ge1 O1 Eu1 118.3(2) 3 3 ?
Ge1 O1 Eu2 113.0(2) 3 1_545 ?

_olex2_submission_special_instructions 'No special instructions were received'
loop_
_twin_individual_id
_twin_individual_mass_fraction_refined
1 0.884(18)
2 0.116(18)

