data_0-TOPOS_WEQKEJ_sqc958
_database_code_CSD                  WEQKEJ
_audit_creation_date                9/7/2021
_audit_creation_method              ToposPro
_chemical_formula_structural        sqc958
_chemical_name_systematic
;
catena-(bis(\m~3~-Iminodiacetato)-(\m~2~-oxalato)-chromium-europium(i
ii)). 
;
_chemical_formula_sum               'Eu0 Sc0'
_citation_journal_abbrev            INORG.CHEM.
_citation_year                      2006
_citation_journal_volume            45
_citation_page_first                8471
_citation_special_details
;
Experiment details: paramagnetic; luminescentisomorphous with the sam
arium analogue. File: search24.cif. 
CENTAT: Cr1 Eu1
SIMPLIG: Sc=C4
H5NO4 Ti=C2O4| 
;
loop_
_publ_author_name
'Bin ZHAI'
'Long YI'
'Hong-Shen WANG'
'Bin ZHAO'
'Peng CHENG'
'Dai-Zhang LIAO'
'Shi-Ping YAN'
_cell_length_a                      10.799
_cell_length_b                      10.799
_cell_length_c                      12.511
_cell_angle_alpha                   90
_cell_angle_beta                    90
_cell_angle_gamma                   90
_cell_volume                        1459.013
_cell_formula_units_Z               4
_symmetry_space_group_name_H-M      'P 42/m b c'
_symmetry_Int_Tables_number         135
_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
5 1/2-y,1/2-x,1/2-z
6 1/2+y,1/2+x,1/2-z
7 y,-x,1/2+z
8 -y,x,1/2+z
9 -x,-y,-z
10 x,y,-z
11 1/2-x,1/2+y,z
12 1/2+x,1/2-y,z
13 1/2+y,1/2+x,1/2+z
14 1/2-y,1/2-x,1/2+z
15 -y,x,1/2-z
16 y,-x,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
Sc1 Sc 8 0.96149 0.81081 0.00000 1.0000
Eu1 Eu 4 0.00000 0.50000 0.25000 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
Sc1 Eu1 4.6067 1 0 0 0 1 1 0 0 v 16
Sc1 Sc1 4.1698 1 0 0 0 2 2 2 0 v 4
Eu1 Eu1 6.2555 1 0 0 0 9 0 1 0 v 4
#End of data_0-TOPOS_WEQKEJ_sqc958