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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/47/1534769.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1534769
loop_
_publ_author_name
'Gromilov, S.A.'
'Alekseev, V.I.'
'Baidina, I.A.'
'Khranenko, S.P.'
'Belyaev, A.V.'
_publ_section_title
;
 Crystal structure of K2 (Pd (N O2)2 Cl2), comparison with K2 (Pd (N O2)4)
 and K2 Pd Cl4
;
_journal_name_full               'Zhurnal Neorganicheskoi Khimii'
_journal_page_first              2017
_journal_page_last               2021
_journal_volume                  39
_journal_year                    1994
_chemical_formula_sum            'Cl2 K2 N2 O4 Pd'
_chemical_name_systematic        'K2 (Pd (N O2)2 Cl2)'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.86
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.663
_cell_length_b                   13.63
_cell_length_c                   4.102
_cell_volume                     407.793
_citation_journal_id_ASTM        ZNOKAQ
_cod_data_source_file            Gromilov_ZNOKAQ_1994_1464.cif
_cod_data_source_block           Cl2K2N2O4Pd1
_cod_original_cell_volume        407.7933
_cod_original_formula_sum        'Cl2 K2 N2 O4 Pd1'
_cod_database_code               1534769
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
O1 O-2 0.62419 0.69295 0.2013 1 0.0
N1 N+3 0.5 0.64698 0 1 0.0
Cl1 Cl-1 0.22292 0.5 0.11505 1 0.0
K1 K+1 0 0.64735 0.5 1 0.0
Pd1 Pd+2 0.5 0.5 0.5 1 0.0
