data_0-TOPOS_VUJSID01_sqc708
_database_code_CSD                  VUJSID01
_audit_creation_date                9/7/2021
_audit_creation_method              ToposPro
_chemical_formula_structural        sqc708
_chemical_name_systematic
;
catena-[bis(\m~4~-but-2-enedioato)-(\m~2~-4,4'-ethene-1,2-diyldipyrid
ine)-di-zinc(ii)]. 
;
_chemical_formula_sum               'Zn0 C0'
_citation_journal_abbrev            'Chem.Asian J.'
_citation_year                      2014
_citation_journal_volume            9
_citation_page_first                1643
_citation_special_details
;
Experiment details: C2 polymorph. Experiment details: C10 and C16 dis
ordered over two sites with occupancies 0.50:0.50; C5,C6,C7,C8,C9 and
 C11,C12,C13,C14,C15 disordered over two sites withoccupancies 0.50:0
.50.. File: search24.cif. 
CENTAT: none
SIMPLIG: Sc=CH Ti=C24N2| 
;
loop_
_publ_author_name
'Kishida K.'
'Horike S.'
'Watanabe Y.'
'Tahara M.'
'Inubushi Y.'
'Kitagawa S.'
_cell_length_a                      13.462
_cell_length_b                      11.499
_cell_length_c                      9.051
_cell_angle_alpha                   90
_cell_angle_beta                    120.052
_cell_angle_gamma                   90
_cell_volume                        1212.744
_cell_formula_units_Z               4
_symmetry_space_group_name_H-M      'C 2'
_symmetry_Int_Tables_number         5
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 -x,y,-z
3 1/2+x,1/2+y,z
4 1/2-x,1/2+y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
C1 C 4 0.88040 0.18190 0.04780 1.0000
C2 C 4 0.61960 0.37530 0.95320 1.0000
Zn1 Zn 4 0.07863 0.02984 0.18914 1.0000
loop_
_topol_link.node_label_1
_topol_link.node_label_2
_topol_link.distance
_topol_link.site_symmetry_symop_1
_topol_link.site_symmetry_translation_1_x
_topol_link.site_symmetry_translation_1_y
_topol_link.site_symmetry_translation_1_z
_topol_link.site_symmetry_symop_2
_topol_link.site_symmetry_translation_2_x
_topol_link.site_symmetry_translation_2_y
_topol_link.site_symmetry_translation_2_z
_topol_link.type
_topol_link.multiplicity
C1 C2 3.8723 1 0 0 0 1 0 0 -1 v 4
C1 Zn1 3.0241 1 0 0 0 2 1 0 0 v 4
C1 Zn1 2.8976 1 0 0 0 1 1 0 0 v 4
C2 Zn1 3.0335 1 0 0 0 3 0 0 1 v 4
C2 Zn1 2.9147 1 0 0 0 4 0 0 1 v 4
Zn1 Zn1 13.3181 1 0 0 0 2 1 0 2 v 2
#End of data_0-TOPOS_VUJSID01_sqc708