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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/63/1536305.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_1536305
loop_
_publ_author_name
'Olenev, A.V.'
'Shevelkov, A.V.'
'Oleneva, O.S.'
'Popovkin, B.A.'
_publ_section_title
;
 Synthesis and crystal and electronic structure of Cd2 P Cl2: the
 influence of the cation on the structure features of pnictide halides of
 group 12 metals
;
_journal_name_full               'Izvestiya Akad. Nauk, Seriya Khimicheskaya'
_journal_page_first              548
_journal_page_last               553
_journal_volume                  52
_journal_year                    2003
_chemical_formula_sum            'Cd2 Cl2 P'
_chemical_name_systematic        'Cd2 P Cl2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 118.92
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.736
_cell_length_b                   8.957
_cell_length_c                   7.88
_cell_volume                     477.925
_citation_journal_id_ASTM        IASKEA
_cod_data_source_file            Olenev_IASKEA_2003_740.cif
_cod_data_source_block           Cd2Cl2P1
_cod_original_cell_volume        477.9254
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Cd2 Cl2 P1'
_cod_database_code               1536305
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-y-1/2,z-1/2
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
Cl2 Cl 0.5482 0.03113 0.3047 1 0.0
P1 P 0.00997 0.10837 0.94191 1 0.0
Cd1 Cd 0.67713 0.20238 0.7035 1 0.0
Cd2 Cd 0.20595 0.08029 0.77387 1 0.0
Cl1 Cl 0.0059 0.19807 0.42512 1 0.0
