data_0-TOPOS_XOPWOP_sqc514
_database_code_CSD                  XOPWOP
_audit_creation_date                12/23/2020
_audit_creation_method              ToposPro
_chemical_formula_structural        sqc514
_chemical_name_systematic
;
catena-[tris(\m~2~-4,4'-Bipyridine-N,N')-bis(\m~2~-thiosulfato-O,S)-d
i-cadmium(ii)]. 
;
_chemical_formula_sum               Cd0
_citation_journal_abbrev            CRYSTENGCOMM
_citation_year                      2009
_citation_journal_volume            11
_citation_page_first                55
_citation_special_details
;
File: search24.cif. 
CENTAT: Cd1 Cd2
SIMPLIG: Sc=C10H8N2 Ti=O3S2| 
;
loop_
_publ_author_name
'Paul A.K.'
'Madras G.'
'Natarajan S.'
_cell_length_a                      12.628
_cell_length_b                      15.081
_cell_length_c                      17.362
_cell_angle_alpha                   90
_cell_angle_beta                    107.076
_cell_angle_gamma                   90
_cell_volume                        3160.707
_cell_formula_units_Z               8
_symmetry_space_group_name_H-M      'C 2/c'
_symmetry_Int_Tables_number         15
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 -x,y,1/2-z
3 -x,-y,-z
4 x,-y,1/2+z
5 1/2+x,1/2+y,z
6 1/2-x,1/2+y,1/2-z
7 1/2-x,1/2-y,-z
8 1/2+x,1/2-y,1/2+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
Cd1 Cd 4 0.50000 0.49588 0.25000 1.0000
Cd2 Cd 4 0.50000 0.01410 0.75000 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
Cd1 Cd2 6.3158 1 0 0 0 7 0 0 1 v 8
Cd1 Cd2 11.6807 1 0 0 0 1 0 1 -1 v 8
Cd1 Cd1 11.7488 1 0 0 0 7 0 0 0 v 4
#End of data_0-TOPOS_XOPWOP_sqc514