data_0-TOPOS_HOZWOK_sqp;5/4/t6;sqc13
_database_code_CSD                  HOZWOK
_audit_creation_date                9/7/2021
_audit_creation_method              ToposPro
_chemical_formula_structural        sqp;5/4/t6;sqc13
_chemical_name_systematic
;
catena-[bis(\m-chloro)-(\m-1H-pyrazol-4-amine)-cadmium(ii)]. 
;
_chemical_formula_sum               ZC0
_citation_journal_abbrev            J.MOL.STRUCT.
_citation_year                      2015
_citation_journal_volume            1089
_citation_page_first                135
_citation_special_details
;
File: H.cif. 
CENTAT: Cd1
SIMPLIG: ZA=C3H5N3 ZB=Cl ZC=Cd
SIMPPAR: 
METH=Stand; INTRA=V| 
;
loop_
_publ_author_name
'Seco J.M.'
'Calahorro A.'
'Cepeda J.'
'Rodriguez-Dieguez A.'
_cell_length_a                      8.602
_cell_length_b                      6.702
_cell_length_c                      12.81
_cell_angle_alpha                   90
_cell_angle_beta                    106.397
_cell_angle_gamma                   90
_cell_volume                        708.4684
_cell_formula_units_Z               4
_symmetry_space_group_name_H-M      'P 21/n'
_symmetry_Int_Tables_number         14
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 1/2-x,1/2+y,1/2-z
3 -x,-y,-z
4 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
ZC1 ZC 4 0.44490 0.02965 0.34345 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
ZC1 ZC1 7.1839 1 0 0 0 2 1 0 0 v 4
ZC1 ZC1 3.8725 1 0 0 0 3 1 0 1 v 2
ZC1 ZC1 4.8654 1 0 0 0 2 0 0 0 v 4
#End of data_0-TOPOS_HOZWOK_sqp;5/4/t6;sqc13