# Electronic Supplementary Material (ESI) for Chemical Communications.
# This journal is © The Royal Society of Chemistry 2014

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#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
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# 
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#  data retrieval see:
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#  from this site to visualise CIF-encoded structures and 
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data_EuBpebc-SJK

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C42 H71 Eu N3 O29.5 S'
_chemical_formula_sum            'C42 H71 Eu N3 O29.5 S'
_chemical_formula_weight         1274.04

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Eu Eu -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 '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'

_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'R -3'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'

_cell_length_a                   17.6479(13)
_cell_length_b                   17.6479(13)
_cell_length_c                   31.002(2)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_volume                     8361.9(10)
_cell_formula_units_Z            6
_cell_measurement_temperature    106.8(5)
_cell_measurement_reflns_used    2348
_cell_measurement_theta_min      3.2212
_cell_measurement_theta_max      66.9956

_exptl_crystal_description       Prism
_exptl_crystal_colour            red
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.07
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.518
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3954
_exptl_absorpt_coefficient_mu    1.254
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.45535
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   ?
_exptl_special_details           
; 
 
;

_diffrn_ambient_temperature      106.8(5)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Xcalibur, Atlas, Gemini ultra'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            11017
_diffrn_reflns_av_R_equivalents  0.0828
_diffrn_reflns_av_sigmaI/netI    0.0638
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         1.49
_diffrn_reflns_theta_max         25.13
_reflns_number_total             3270
_reflns_number_gt                1632
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0600P)²+50.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    geom
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         3270
_refine_ls_number_parameters     215
_refine_ls_number_restraints     642
_refine_ls_R_factor_all          0.1333
_refine_ls_R_factor_gt           0.0981
_refine_ls_wR_factor_ref         0.2430
_refine_ls_wR_factor_gt          0.2244
_refine_ls_goodness_of_fit_ref   1.090
_refine_ls_restrained_S_all      1.053
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Eu1 Eu 0.3333 0.6667 0.34822(3) 0.1293(5) Uani 1 3 d S . .
S1 S 0.2034(4) 0.5684(4) 0.42258(18) 0.0959(18) Uani 0.33 1 d PD . .
O1 O 0.2184(11) 0.5319(10) 0.3825(5) 0.118(4) Uani 0.33 1 d PDU . .
O2 O 0.2540(10) 0.6666(9) 0.4199(5) 0.121(5) Uani 0.33 1 d PDU . .
O3 O 0.2347(10) 0.5400(11) 0.4607(4) 0.141(7) Uani 0.33 1 d PDU A .
O4 O 0.1088(9) 0.5394(10) 0.4282(6) 0.153(7) Uani 0.33 1 d PDU A .
O5 O 0.3168(12) 0.5566(12) 0.3060(5) 0.139(4) Uani 0.513(10) 1 d PDU A 1
O5B O 0.3472(12) 0.5370(13) 0.3192(4) 0.124(4) Uani 0.487(10) 1 d PDU A 2
O6 O 0.4033(9) 0.5004(10) 0.3202(4) 0.132(5) Uani 0.513(10) 1 d PDU A 1
O6B O 0.2557(11) 0.5663(11) 0.2855(4) 0.128(3) Uani 0.487(10) 1 d PDU A 2
O7 O 0.4375(9) 0.6396(10) 0.3824(4) 0.152(4) Uani 0.67 1 d PU A .
C1 C 0.3453(14) 0.5048(14) 0.2985(4) 0.132(4) Uani 0.513(10) 1 d PDU A 1
C1B C 0.3019(16) 0.5299(15) 0.2860(5) 0.131(4) Uani 0.487(10) 1 d PDU A 2
C2 C 0.3075(4) 0.4662(4) 0.25300(13) 0.141(3) Uani 1 1 d GDU . .
C3 C 0.2665(4) 0.4813(4) 0.21852(15) 0.134(3) Uani 1 1 d GU A .
H3A H 0.2553 0.5275 0.2196 0.160 Uiso 1 1 calc R . .
C4 C 0.2421(3) 0.4274(4) 0.18244(14) 0.132(3) Uani 1 1 d GU A .
H4A H 0.2146 0.4375 0.1594 0.158 Uiso 1 1 calc R . .
C5 C 0.2588(3) 0.3583(3) 0.18084(13) 0.136(3) Uani 1 1 d GU A .
C6 C 0.2998(4) 0.3432(4) 0.21531(13) 0.138(3) Uani 1 1 d GU A .
H6A H 0.3110 0.2970 0.2142 0.166 Uiso 1 1 calc R . .
C7 C 0.3242(4) 0.3971(5) 0.25139(11) 0.143(3) Uani 1 1 d GU A .
H7A H 0.3516 0.3870 0.2745 0.172 Uiso 1 1 calc R . .
C8 C 0.2335(9) 0.3008(9) 0.1414(3) 0.159(3) Uani 1 1 d DU . .
H8A H 0.2280 0.2450 0.1489 0.191 Uiso 1 1 calc R A .
H8B H 0.1772 0.2901 0.1308 0.191 Uiso 1 1 calc R . .
C9 C 0.2800(4) 0.3773(5) 0.07193(12) 0.155(3) Uani 1 1 d GU A .
H9A H 0.2248 0.3712 0.0687 0.186 Uiso 1 1 calc R . .
C10 C 0.3447(5) 0.4210(5) 0.04111(11) 0.146(3) Uani 1 1 d GU A .
H10A H 0.3332 0.4446 0.0169 0.175 Uiso 1 1 calc R . .
C11 C 0.4267(5) 0.4292(4) 0.04650(13) 0.138(3) Uani 1 1 d GU A .
C12 C 0.4439(4) 0.3938(5) 0.08271(15) 0.145(3) Uani 1 1 d GU A .
H12A H 0.4988 0.3993 0.0863 0.174 Uiso 1 1 calc R . .
C13 C 0.3792(4) 0.3502(4) 0.11352(14) 0.152(3) Uani 1 1 d GU A .
H13A H 0.3902 0.3262 0.1378 0.182 Uiso 1 1 calc R . .
C14 C 0.5028(9) 0.4791(9) 0.0160(3) 0.136(3) Uani 1 1 d U . .
H14A H 0.5548 0.4790 0.0207 0.164 Uiso 1 1 calc R A .
N1 N 0.2996(7) 0.3430(7) 0.1078(3) 0.148(3) Uani 1 1 d GDU A .


_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
Eu1 O5 2.236(15) 3_565 ?
Eu1 O5 2.236(16) 2_665 ?
Eu1 O5 2.236(15) . ?
Eu1 O7 2.369(13) 2_665 ?
Eu1 O7 2.369(13) 3_565 ?
Eu1 O7 2.369(13) . ?
Eu1 O1 2.465(17) 3_565 ?
Eu1 O1 2.465(17) . ?
Eu1 O1 2.465(17) 2_665 ?
Eu1 O6B 2.523(14) 3_565 ?
Eu1 O6B 2.523(14) . ?
Eu1 O6B 2.523(14) 2_665 ?
S1 O7 1.249(13) 3_565 ?
S1 O1 1.483(12) . ?
S1 O4 1.491(12) . ?
S1 O3 1.493(12) . ?
S1 O2 1.504(12) . ?
S1 O2 2.147(16) 2_665 ?
O1 O7 0.728(18) 3_565 ?
O2 S1 2.147(16) 3_565 ?
O5 C1 1.267(9) . ?
O5B C1B 1.268(9) . ?
O6 C1 1.261(8) . ?
O6B C1B 1.267(9) . ?
O7 O1 0.728(19) 2_665 ?
O7 S1 1.249(13) 2_665 ?
C1 C2 1.563(9) . ?
C1B C2 1.559(9) . ?
C2 C3 1.3900 . ?
C2 C7 1.3900 . ?
C3 C4 1.3900 . ?
C3 H3A 0.9300 . ?
C4 C5 1.3900 . ?
C4 H4A 0.9300 . ?
C5 C6 1.3900 . ?
C5 C8 1.507(12) . ?
C6 C7 1.3900 . ?
C6 H6A 0.9300 . ?
C7 H7A 0.9300 . ?
C8 N1 1.461(8) . ?
C8 H8A 0.9700 . ?
C8 H8B 0.9700 . ?
C9 C10 1.3900 . ?
C9 N1 1.390(11) . ?
C9 H9A 0.9300 . ?
C10 C11 1.3900 . ?
C10 H10A 0.9300 . ?
C11 C12 1.3900 . ?
C11 C14 1.514(14) . ?
C12 C13 1.3900 . ?
C12 H12A 0.9300 . ?
C13 N1 1.357(12) . ?
C13 H13A 0.9300 . ?
C14 C14 1.268(19) 10_665 ?
C14 H14A 0.9300 . ?

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
O5 Eu1 O5 89.3(6) 3_565 2_665 ?
O5 Eu1 O5 89.2(6) 3_565 . ?
O5 Eu1 O5 89.2(6) 2_665 . ?
O5 Eu1 O7 86.3(6) 3_565 2_665 ?
O5 Eu1 O7 82.2(6) 2_665 2_665 ?
O5 Eu1 O7 170.4(6) . 2_665 ?
O5 Eu1 O7 82.2(6) 3_565 3_565 ?
O5 Eu1 O7 170.4(6) 2_665 3_565 ?
O5 Eu1 O7 86.3(6) . 3_565 ?
O7 Eu1 O7 101.5(4) 2_665 3_565 ?
O5 Eu1 O7 170.4(6) 3_565 . ?
O5 Eu1 O7 86.3(6) 2_665 . ?
O5 Eu1 O7 82.2(6) . . ?
O7 Eu1 O7 101.5(4) 2_665 . ?
O7 Eu1 O7 101.5(4) 3_565 . ?
O5 Eu1 O1 74.1(6) 3_565 3_565 ?
O5 Eu1 O1 94.2(6) 2_665 3_565 ?
O5 Eu1 O1 163.0(5) . 3_565 ?
O7 Eu1 O1 17.2(4) 2_665 3_565 ?
O7 Eu1 O1 87.7(4) 3_565 3_565 ?
O7 Eu1 O1 114.6(4) . 3_565 ?
O5 Eu1 O1 94.2(6) 3_565 . ?
O5 Eu1 O1 163.0(5) 2_665 . ?
O5 Eu1 O1 74.1(6) . . ?
O7 Eu1 O1 114.6(4) 2_665 . ?
O7 Eu1 O1 17.2(4) 3_565 . ?
O7 Eu1 O1 87.7(4) . . ?
O1 Eu1 O1 102.8(4) 3_565 . ?
O5 Eu1 O1 163.0(5) 3_565 2_665 ?
O5 Eu1 O1 74.1(6) 2_665 2_665 ?
O5 Eu1 O1 94.2(6) . 2_665 ?
O7 Eu1 O1 87.7(4) 2_665 2_665 ?
O7 Eu1 O1 114.6(4) 3_565 2_665 ?
O7 Eu1 O1 17.2(4) . 2_665 ?
O1 Eu1 O1 102.8(4) 3_565 2_665 ?
O1 Eu1 O1 102.8(4) . 2_665 ?
O5 Eu1 O6B 31.8(4) 3_565 3_565 ?
O5 Eu1 O6B 57.6(6) 2_665 3_565 ?
O5 Eu1 O6B 91.9(5) . 3_565 ?
O7 Eu1 O6B 79.8(5) 2_665 3_565 ?
O7 Eu1 O6B 114.0(5) 3_565 3_565 ?
O7 Eu1 O6B 143.6(4) . 3_565 ?
O1 Eu1 O6B 76.0(5) 3_565 3_565 ?
O1 Eu1 O6B 125.3(5) . 3_565 ?
O1 Eu1 O6B 131.2(4) 2_665 3_565 ?
O5 Eu1 O6B 57.6(6) 3_565 . ?
O5 Eu1 O6B 91.9(5) 2_665 . ?
O5 Eu1 O6B 31.8(4) . . ?
O7 Eu1 O6B 143.6(4) 2_665 . ?
O7 Eu1 O6B 79.8(5) 3_565 . ?
O7 Eu1 O6B 114.0(5) . . ?
O1 Eu1 O6B 131.2(4) 3_565 . ?
O1 Eu1 O6B 76.0(5) . . ?
O1 Eu1 O6B 125.3(5) 2_665 . ?
O6B Eu1 O6B 67.0(6) 3_565 . ?
O5 Eu1 O6B 91.9(5) 3_565 2_665 ?
O5 Eu1 O6B 31.8(4) 2_665 2_665 ?
O5 Eu1 O6B 57.6(6) . 2_665 ?
O7 Eu1 O6B 114.0(5) 2_665 2_665 ?
O7 Eu1 O6B 143.6(4) 3_565 2_665 ?
O7 Eu1 O6B 79.8(5) . 2_665 ?
O1 Eu1 O6B 125.3(5) 3_565 2_665 ?
O1 Eu1 O6B 131.2(4) . 2_665 ?
O1 Eu1 O6B 76.0(5) 2_665 2_665 ?
O6B Eu1 O6B 67.0(6) 3_565 2_665 ?
O6B Eu1 O6B 67.0(6) . 2_665 ?
O7 S1 O1 29.3(9) 3_565 . ?
O7 S1 O4 96.7(10) 3_565 . ?
O1 S1 O4 111.1(5) . . ?
O7 S1 O3 139.2(10) 3_565 . ?
O1 S1 O3 110.0(5) . . ?
O4 S1 O3 109.3(5) . . ?
O7 S1 O2 90.9(9) 3_565 . ?
O1 S1 O2 108.8(5) . . ?
O4 S1 O2 108.7(5) . . ?
O3 S1 O2 108.9(5) . . ?
O7 S1 O2 87.0(9) 3_565 2_665 ?
O1 S1 O2 68.1(8) . 2_665 ?
O4 S1 O2 169.4(9) . 2_665 ?
O3 S1 O2 62.5(7) . 2_665 ?
O2 S1 O2 81.1(10) . 2_665 ?
O7 S1 Eu1 44.2(7) 3_565 . ?
O1 S1 Eu1 51.5(6) . . ?
O4 S1 Eu1 131.8(6) . . ?
O3 S1 Eu1 118.8(6) . . ?
O2 S1 Eu1 57.8(5) . . ?
O2 S1 Eu1 56.6(4) 2_665 . ?
O7 O1 S1 57.2(15) 3_565 . ?
O7 O1 Eu1 73.9(19) 3_565 . ?
S1 O1 Eu1 100.4(7) . . ?
S1 O2 S1 158.1(10) . 3_565 ?
S1 O2 Eu1 93.3(6) . . ?
S1 O2 Eu1 80.3(4) 3_565 . ?
C1 O5 Eu1 144.0(11) . . ?
C1B O5B Eu1 92.1(10) . . ?
C1B O6B Eu1 94.9(9) . . ?
O1 O7 S1 93(2) 2_665 2_665 ?
O1 O7 Eu1 88.9(19) 2_665 . ?
S1 O7 Eu1 114.3(10) 2_665 . ?
O6 C1 O5 125.0(10) . . ?
O6 C1 C2 129.6(12) . . ?
O5 C1 C2 104.2(11) . . ?
O6B C1B O5B 119.6(13) . . ?
O6B C1B C2 130.3(12) . . ?
O5B C1B C2 109.9(11) . . ?
O6B C1B Eu1 59.5(8) . . ?
O5B C1B Eu1 62.2(10) . . ?
C2 C1B Eu1 167.4(13) . . ?
C3 C2 C7 120.0 . . ?
C3 C2 C1B 98.0(6) . . ?
C7 C2 C1B 140.6(7) . . ?
C3 C2 C1 139.4(7) . . ?
C7 C2 C1 100.6(7) . . ?
C1B C2 C1 42.2(7) . . ?
C2 C3 C4 120.0 . . ?
C2 C3 H3A 120.0 . . ?
C4 C3 H3A 120.0 . . ?
C3 C4 C5 120.0 . . ?
C3 C4 H4A 120.0 . . ?
C5 C4 H4A 120.0 . . ?
C6 C5 C4 120.0 . . ?
C6 C5 C8 120.1(6) . . ?
C4 C5 C8 119.9(6) . . ?
C5 C6 C7 120.0 . . ?
C5 C6 H6A 120.0 . . ?
C7 C6 H6A 120.0 . . ?
C6 C7 C2 120.0 . . ?
C6 C7 H7A 120.0 . . ?
C2 C7 H7A 120.0 . . ?
N1 C8 C5 110.1(9) . . ?
N1 C8 H8A 109.6 . . ?
C5 C8 H8A 109.6 . . ?
N1 C8 H8B 109.6 . . ?
C5 C8 H8B 109.6 . . ?
H8A C8 H8B 108.2 . . ?
C10 C9 N1 118.4(5) . . ?
C10 C9 H9A 120.8 . . ?
N1 C9 H9A 120.8 . . ?
C9 C10 C11 120.0 . . ?
C9 C10 H10A 120.0 . . ?
C11 C10 H10A 120.0 . . ?
C10 C11 C12 120.0 . . ?
C10 C11 C14 124.1(5) . . ?
C12 C11 C14 115.9(5) . . ?
C13 C12 C11 120.0 . . ?
C13 C12 H12A 120.0 . . ?
C11 C12 H12A 120.0 . . ?
C12 C13 N1 119.2(4) . . ?
C12 C13 H13A 120.4 . . ?
N1 C13 H13A 120.4 . . ?
C14 C14 C11 121.4(15) 10_665 . ?
C14 C14 H14A 119.3 10_665 . ?
C11 C14 H14A 119.3 . . ?
C13 N1 C9 122.4(8) . . ?
C13 N1 C8 118.7(10) . . ?
C9 N1 C8 118.8(10) . . ?

_diffrn_measured_fraction_theta_max 0.980
_diffrn_reflns_theta_full        25.13
_diffrn_measured_fraction_theta_full 0.980
_refine_diff_density_max         0.929
_refine_diff_density_min         -0.910
_refine_diff_density_rms         0.097

# SQUEEZE RESULTS (APPEND TO CIF)
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
1 -0.028 -0.017 0.000 2474.1 752.4
2 0.000 0.000 0.500 15.4 -2.0
3 0.333 0.667 0.167 15.3 -2.1
4 0.667 0.333 0.833 15.3 -2.0
_platon_squeeze_details          
; ?
;

_database_code_depnum_ccdc_archive 'CCDC 993232'
