data_0-TOPOS_GETXEK_sqc25 _database_code_CSD GETXEK _audit_creation_date 12/23/2020 _audit_creation_method ToposPro _chemical_formula_structural sqc25 _chemical_name_systematic ; catena-[(\m~4~-Biphenyl-2,4'-dicarboxylato)-(\m~2~-biphenyl-2,4'-dica rboxylato)-bis(\m~2~-1,2-bis(4-pyridyl)ethane)-di-cadmium(ii) tetrahy drate]. ; _chemical_formula_sum Mn0 _citation_journal_abbrev Synth.React.Inorg.,Met.-Org.,Nano-Met.Chem. _citation_year 2013 _citation_journal_volume 43 _citation_page_first 1146 _citation_special_details ; File: search24.cif. CENTAT: none SIMPLIG: Sc=C6H4 Ti=C5H4N V=CH2 C r=H2O Mn=C4O8Cd2| ; loop_ _publ_author_name 'Aidong WANG' 'Fengkai HU' 'Zhongcheng KE' 'Chen FANG' 'Wei WEI' _cell_length_a 12.872 _cell_length_b 13.68 _cell_length_c 16.117 _cell_angle_alpha 81.363 _cell_angle_beta 88.065 _cell_angle_gamma 63.779 _cell_volume 2515.411 _cell_formula_units_Z 2 _symmetry_space_group_name_H-M 'P -1' _symmetry_Int_Tables_number 2 _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 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 Mn1 Mn 1 0.50000 0.00000 0.00000 1.0000 Mn2 Mn 1 0.00000 0.50000 0.50000 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 Mn1 Mn2 11.2827 1 0 0 0 1 0 0 0 v 2 Mn1 Mn2 10.0595 1 0 0 0 1 1 -1 0 v 2 Mn1 Mn1 13.6800 1 0 0 0 1 0 1 0 v 1 Mn2 Mn2 14.0437 1 0 0 0 1 1 -1 0 v 1 #End of data_0-TOPOS_GETXEK_sqc25