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

#######################################################################
#
#                 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
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_znmof14

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C63 H43.50 N4.50 O12 Zn3'
_chemical_formula_weight         1251.63

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'
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'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           cubic
_symmetry_space_group_IT_number  204
_symmetry_space_group_name_H-M   'I m -3'
_symmetry_space_group_name_Hall  '-I 2 2 3'

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

_cell_length_a                   26.7517(3)
_cell_length_b                   26.7517(3)
_cell_length_c                   26.7517(3)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_volume                     19144.9(4)
_cell_formula_units_Z            8
_cell_measurement_temperature    147(2)
_cell_measurement_reflns_used    9972
_cell_measurement_theta_min      2.408
_cell_measurement_theta_max      23.952

_exptl_crystal_description       block
_exptl_crystal_colour            light-yellow
_exptl_crystal_size_max          0.33
_exptl_crystal_size_mid          0.32
_exptl_crystal_size_min          0.30
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    0.868
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             5112
_exptl_absorpt_coefficient_mu    0.786
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_correction_T_min  0.7815
_exptl_absorpt_correction_T_max  0.7984
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      147(2)
_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  'Bruker APEX CCD'
_diffrn_measurement_method       'omega scan'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        none
_diffrn_reflns_number            80284
_diffrn_reflns_av_R_equivalents  0.0908
_diffrn_reflns_av_sigmaI/netI    0.0892
_diffrn_reflns_limit_h_min       -36
_diffrn_reflns_limit_h_max       35
_diffrn_reflns_limit_k_min       -34
_diffrn_reflns_limit_k_max       36
_diffrn_reflns_limit_l_min       -36
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_theta_min         1.08
_diffrn_reflns_theta_max         29.14
_reflns_number_total             4235
_reflns_number_gt                2328
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker SMART'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Bruker XP'
_computing_publication_material  'Bruker XCIF'

_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)+(0.0888P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         4235
_refine_ls_number_parameters     171
_refine_ls_number_restraints     65
_refine_ls_R_factor_all          0.0927
_refine_ls_R_factor_gt           0.0536
_refine_ls_wR_factor_ref         0.1600
_refine_ls_wR_factor_gt          0.1515
_refine_ls_goodness_of_fit_ref   0.914
_refine_ls_restrained_S_all      0.925
_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
Zn1 Zn 0.11438(2) 0.5000 0.0000 0.03135(19) Uani 1 4 d S . .
Zn2 Zn 0.22909(2) 0.5000 0.0000 0.0443(2) Uani 1 4 d S . .
O1 O 0.13049(9) 0.44542(7) 0.05258(7) 0.0547(6) Uani 1 1 d . . .
O2 O 0.2097(2) 0.43610(18) 0.0341(2) 0.0664(13) Uani 0.50 1 d PD . .
O2' O 0.21296(19) 0.4624(2) 0.06394(19) 0.0662(13) Uani 0.50 1 d PD . .
C1 C 0.17240(16) 0.42968(17) 0.06284(17) 0.0842(14) Uani 1 1 d D . .
C2 C 0.17637(16) 0.38354(18) 0.09349(16) 0.0908(15) Uani 1 1 d . . .
C3 C 0.13566(15) 0.35748(15) 0.11060(14) 0.0790(12) Uani 1 1 d . . .
H3 H 0.1029 0.3690 0.1034 0.095 Uiso 1 1 calc R . .
C4 C 0.14239(17) 0.31398(16) 0.13859(17) 0.0959(16) Uani 1 1 d . . .
H4 H 0.1141 0.2972 0.1519 0.115 Uiso 1 1 calc R . .
C5 C 0.18958(18) 0.2949(2) 0.1472(2) 0.119(2) Uani 1 1 d . . .
C6 C 0.23064(18) 0.3212(2) 0.1296(2) 0.141(3) Uani 1 1 d . . .
H6 H 0.2634 0.3089 0.1356 0.169 Uiso 1 1 calc R . .
C7 C 0.22422(18) 0.3655(2) 0.1033(2) 0.140(3) Uani 1 1 d . . .
H7 H 0.2526 0.3836 0.0920 0.168 Uiso 1 1 calc R . .
C8 C 0.19824(18) 0.2493(2) 0.1776(2) 0.130(3) Uani 1 1 d . . .
C9 C 0.2377(2) 0.2176(2) 0.16770(19) 0.139(3) Uani 1 1 d . . .
H9 H 0.2575 0.2234 0.1388 0.167 Uiso 1 1 calc R . .
N1I N 0.3047(3) 0.5000 0.0000 0.142(4) Uani 1 4 d SD . .
C1I C 0.3367(4) 0.4655(7) 0.0128(9) 0.33(2) Uani 0.50 1 d PD . .
H1I H 0.3271(15) 0.4310(5) 0.015(2) 0.390 Uiso 0.50 1 d PD . .
C2I C 0.3201(7) 0.4111(9) 0.0069(9) 0.31(3) Uani 0.25 1 d PDU . .
H2I1 H 0.3210 0.4007 -0.0281 0.369 Uiso 0.25 1 d P . .
H2I2 H 0.2860 0.4065 0.0201 0.369 Uiso 0.25 1 d P . .
H2I3 H 0.3427 0.3885 0.0264 0.369 Uiso 0.25 1 d P . .
C3I C 0.3793(3) 0.4770(5) 0.0315(5) 0.166(7) Uani 0.25 1 d PD . .
H3I H 0.4049 0.4551 0.0427 0.199 Uiso 0.50 1 calc PR . .
N2I N 0.3793(3) 0.4770(5) 0.0315(5) 0.166(7) Uani 0.25 1 d P . .
N3I N 0.0406(2) 0.51349(17) 0.0000 0.0378(15) Uani 0.50 2 d SPDU . .
C4I C 0.0000 0.5675(7) 0.0000 0.146(13) Uani 0.50 4 d SPU . .
H4IA H -0.0338 0.5826 0.0000 0.175 Uiso 0.25 2 d SP . .
H4IB H 0.0169 0.5826 0.0293 0.175 Uiso 0.13 1 d P . .
C5I C 0.0000 0.4879(4) 0.0000 0.042(4) Uani 0.50 4 d SPDU . .
C6I C -0.0242(3) 0.4369(4) 0.0000 0.110(6) Uani 0.50 2 d SPDU . .
H6I H -0.0450 0.4081 0.0000 0.132 Uiso 0.50 2 calc SPR . .


_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
Zn1 N3I 2.007(6) 27_565 ?
Zn1 N3I 2.007(6) . ?
Zn1 O1 2.0728(19) 27_565 ?
Zn1 O1 2.0728(19) 4_565 ?
Zn1 O1 2.0728(19) . ?
Zn1 O1 2.0728(19) 26 ?
Zn1 Zn2 3.0688(8) . ?
Zn2 O2 2.006(5) 27_565 ?
Zn2 O2 2.006(5) 4_565 ?
Zn2 O2 2.006(5) . ?
Zn2 O2 2.006(5) 26 ?
Zn2 N1I 2.023(8) . ?
Zn2 O2' 2.031(5) 27_565 ?
Zn2 O2' 2.031(5) 4_565 ?
Zn2 O2' 2.031(5) . ?
Zn2 O2' 2.031(5) 26 ?
O1 C1 1.229(5) . ?
O2 O2' 1.068(7) . ?
O2 C1 1.271(6) . ?
O2' C1 1.394(7) . ?
C1 C2 1.486(5) . ?
C2 C3 1.372(6) . ?
C2 C7 1.393(6) . ?
C3 C4 1.395(5) . ?
C4 C5 1.381(6) . ?
C5 C6 1.387(7) . ?
C5 C8 1.483(5) . ?
C6 C7 1.387(6) . ?
C8 C9 1.382(5) 5 ?
C8 C9 1.381(5) . ?
C9 C8 1.382(5) 9 ?
N1I C1I 1.305(16) 27_565 ?
N1I C1I 1.305(16) 4_565 ?
N1I C1I 1.305(16) . ?
N1I C1I 1.305(16) 26 ?
C1I C3I 1.282(19) . ?
C1I C2I 1.53(2) . ?
C1I C2I 1.61(2) 26 ?
C1I C1I 1.85(4) 27_565 ?
C1I C3I 1.98(2) 27_565 ?
C1I C1I 1.97(4) 4_565 ?
C3I C3I 1.23(3) 27_565 ?
C3I C1I 1.98(2) 27_565 ?
N3I C5I 1.284(8) . ?
N3I C6I 1.397(10) 25_565 ?
C4I C5I 1.480(17) 25_565 ?
C5I C4I 1.480(17) 25_565 ?
C6I C6I 1.296(16) 3 ?
C6I N3I 1.397(10) 25_565 ?

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
N3I Zn1 N3I 20.7(3) 27_565 . ?
N3I Zn1 O1 109.34(12) 27_565 27_565 ?
N3I Zn1 O1 94.47(12) . 27_565 ?
N3I Zn1 O1 109.34(12) 27_565 4_565 ?
N3I Zn1 O1 94.47(12) . 4_565 ?
O1 Zn1 O1 85.47(11) 27_565 4_565 ?
N3I Zn1 O1 94.47(12) 27_565 . ?
N3I Zn1 O1 109.34(12) . . ?
O1 Zn1 O1 89.57(12) 27_565 . ?
O1 Zn1 O1 156.00(14) 4_565 . ?
N3I Zn1 O1 94.47(12) 27_565 26 ?
N3I Zn1 O1 109.34(12) . 26 ?
O1 Zn1 O1 156.00(14) 27_565 26 ?
O1 Zn1 O1 89.57(12) 4_565 26 ?
O1 Zn1 O1 85.47(11) . 26 ?
N3I Zn1 Zn2 169.64(13) 27_565 . ?
N3I Zn1 Zn2 169.64(13) . . ?
O1 Zn1 Zn2 78.00(7) 27_565 . ?
O1 Zn1 Zn2 78.00(7) 4_565 . ?
O1 Zn1 Zn2 78.00(7) . . ?
O1 Zn1 Zn2 78.00(7) 26 . ?
O2 Zn2 O2 54.0(4) 27_565 4_565 ?
O2 Zn2 O2 116.9(3) 27_565 . ?
O2 Zn2 O2 149.9(3) 4_565 . ?
O2 Zn2 O2 149.9(3) 27_565 26 ?
O2 Zn2 O2 116.9(3) 4_565 26 ?
O2 Zn2 O2 54.0(4) . 26 ?
O2 Zn2 N1I 105.03(16) 27_565 . ?
O2 Zn2 N1I 105.03(16) 4_565 . ?
O2 Zn2 N1I 105.03(16) . . ?
O2 Zn2 N1I 105.03(16) 26 . ?
O2 Zn2 O2' 30.68(19) 27_565 27_565 ?
O2 Zn2 O2' 84.5(3) 4_565 27_565 ?
O2 Zn2 O2' 89.1(3) . 27_565 ?
O2 Zn2 O2' 138.6(2) 26 27_565 ?
N1I Zn2 O2' 102.27(14) . 27_565 ?
O2 Zn2 O2' 84.5(3) 27_565 4_565 ?
O2 Zn2 O2' 30.68(19) 4_565 4_565 ?
O2 Zn2 O2' 138.6(2) . 4_565 ?
O2 Zn2 O2' 89.1(3) 26 4_565 ?
N1I Zn2 O2' 102.27(14) . 4_565 ?
O2' Zn2 O2' 114.7(3) 27_565 4_565 ?
O2 Zn2 O2' 89.1(3) 27_565 . ?
O2 Zn2 O2' 138.6(2) 4_565 . ?
O2 Zn2 O2' 30.68(19) . . ?
O2 Zn2 O2' 84.5(3) 26 . ?
N1I Zn2 O2' 102.27(14) . . ?
O2' Zn2 O2' 59.4(4) 27_565 . ?
O2' Zn2 O2' 155.5(3) 4_565 . ?
O2 Zn2 O2' 138.6(2) 27_565 26 ?
O2 Zn2 O2' 89.1(3) 4_565 26 ?
O2 Zn2 O2' 84.5(3) . 26 ?
O2 Zn2 O2' 30.68(19) 26 26 ?
N1I Zn2 O2' 102.27(14) . 26 ?
O2' Zn2 O2' 155.5(3) 27_565 26 ?
O2' Zn2 O2' 59.4(4) 4_565 26 ?
O2' Zn2 O2' 114.7(3) . 26 ?
O2 Zn2 Zn1 74.97(16) 27_565 . ?
O2 Zn2 Zn1 74.97(16) 4_565 . ?
O2 Zn2 Zn1 74.97(16) . . ?
O2 Zn2 Zn1 74.97(16) 26 . ?
N1I Zn2 Zn1 180.0 . . ?
O2' Zn2 Zn1 77.73(14) 27_565 . ?
O2' Zn2 Zn1 77.73(14) 4_565 . ?
O2' Zn2 Zn1 77.73(14) . . ?
O2' Zn2 Zn1 77.73(14) 26 . ?
C1 O1 Zn1 125.6(2) . . ?
O2' O2 C1 72.6(5) . . ?
O2' O2 Zn2 76.0(4) . . ?
C1 O2 Zn2 126.4(4) . . ?
O2 O2' C1 60.5(4) . . ?
O2 O2' Zn2 73.3(4) . . ?
C1 O2' Zn2 117.3(3) . . ?
O1 C1 O2 122.3(4) . . ?
O1 C1 O2' 120.0(4) . . ?
O2 C1 O2' 47.0(3) . . ?
O1 C1 C2 118.2(4) . . ?
O2 C1 C2 113.0(4) . . ?
O2' C1 C2 117.0(4) . . ?
C3 C2 C7 119.3(4) . . ?
C3 C2 C1 123.4(4) . . ?
C7 C2 C1 117.3(4) . . ?
C2 C3 C4 120.0(4) . . ?
C5 C4 C3 121.0(4) . . ?
C4 C5 C6 118.6(4) . . ?
C4 C5 C8 122.6(4) . . ?
C6 C5 C8 118.7(4) . . ?
C7 C6 C5 120.5(4) . . ?
C6 C7 C2 120.4(5) . . ?
C9 C8 C9 117.5(4) 5 . ?
C9 C8 C5 121.2(3) 5 . ?
C9 C8 C5 121.4(3) . . ?
C8 C9 C8 122.4(4) 9 . ?
C1I N1I C1I 30(2) 27_565 4_565 ?
C1I N1I C1I 90.0(17) 27_565 . ?
C1I N1I C1I 97.9(14) 4_565 . ?
C1I N1I C1I 97.9(14) 27_565 26 ?
C1I N1I C1I 90.0(17) 4_565 26 ?
C1I N1I C1I 30(2) . 26 ?
C1I N1I Zn2 131.1(7) 27_565 . ?
C1I N1I Zn2 131.1(7) 4_565 . ?
C1I N1I Zn2 131.1(7) . . ?
C1I N1I Zn2 131.1(7) 26 . ?
C3I C1I N1I 121.1(16) . . ?
C3I C1I C2I 121.8(15) . . ?
N1I C1I C2I 117.1(13) . . ?
C3I C1I C2I 126.1(14) . 26 ?
N1I C1I C2I 111.9(17) . 26 ?
C2I C1I C2I 13.2(16) . 26 ?
C3I C1I C1I 76.1(10) . 27_565 ?
N1I C1I C1I 45.0(8) . 27_565 ?
C2I C1I C1I 162.1(9) . 27_565 ?
C2I C1I C1I 154.7(12) 26 27_565 ?
C3I C1I C3I 37.1(10) . 27_565 ?
N1I C1I C3I 84.0(11) . 27_565 ?
C2I C1I C3I 158.8(14) . 27_565 ?
C2I C1I C3I 160.7(11) 26 27_565 ?
C1I C1I C3I 39.0(6) 27_565 27_565 ?
C3I C1I C1I 84.8(11) . 4_565 ?
N1I C1I C1I 41.1(7) . 4_565 ?
C2I C1I C1I 149(2) . 4_565 ?
C2I C1I C1I 137(3) 26 4_565 ?
C1I C1I C1I 20.3(14) 27_565 4_565 ?
C3I C1I C1I 50.1(8) 27_565 4_565 ?
C3I C3I C1I 103.9(10) 27_565 . ?
C3I C3I C1I 39.0(6) 27_565 27_565 ?
C1I C3I C1I 64.9(12) . 27_565 ?
C5I N3I C6I 104.0(7) . 25_565 ?
C5I N3I Zn1 137.4(5) . . ?
C6I N3I Zn1 118.6(5) 25_565 . ?
N3I C5I C4I 122.3(5) . 25_565 ?
C6I C6I N3I 108.2(4) 3 25_565 ?

_diffrn_measured_fraction_theta_max 0.927
_diffrn_reflns_theta_full        29.14
_diffrn_measured_fraction_theta_full 0.927
_refine_diff_density_max         0.669
_refine_diff_density_min         -0.300
_refine_diff_density_rms         0.069

# SQUEEZE RESULTS (APPEND TO CIF)
# Note: Data are Listed for all Voids in the P1 Unit Cell
# i.e. Centre of Gravity, Solvent Accessible Volume,
# Recovered number of Electrons in the Void and
# Details about the Squeezed Material
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
_platon_squeeze_void_content
1 0.000 0.000 0.000 4785 1504 ' '
2 0.500 0.500 0.500 4785 1504 ' '
_platon_squeeze_details          
;
;
_database_code_depnum_ccdc_archive 'CCDC 987525'
