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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/1/53/05/1530535.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_1530535
loop_
_publ_author_name
'Palkina, K.K.'
'Maksimova, S.I.'
'Chalisova, N.A.'
'Lavrov, A.V.'
_publ_section_title
;
 Synthesis and structure of palladium polyphosphate Pd (P O3)2 crystals
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              829
_journal_page_last               831
_journal_volume                  242
_journal_year                    1978
_chemical_formula_sum            'O6 P2 Pd'
_chemical_name_systematic        'Pd (P O3)2'
_space_group_IT_number           53
_symmetry_space_group_name_Hall  '-P 2 2ac'
_symmetry_space_group_name_H-M   'P c n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.233
_cell_length_b                   4.571
_cell_length_c                   12.472
_cell_volume                     241.321
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Palkina_DANKAS_1978_499.cif
_cod_data_source_block           O6P2Pd1
_cod_original_cell_volume        241.3213
_cod_original_sg_symbol_Hall     '-P 2ac 2 (z,y,-x)'
_cod_original_formula_sum        'O6 P2 Pd1'
_cod_database_code               1530535
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x+1/2,-y,-z+1/2
-x,-y,z
-x+1/2,y,-z+1/2
-x,-y,-z
-x-1/2,y,z-1/2
x,y,-z
x-1/2,-y,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
Pd1 Pd+2 0 0 0 1 0.0
P1 P+5 0 0.5 0.17217 1 0.0
O2 O-2 0.25 0.3519 0.25 1 0.0
O1 O-2 0.1692 0.73422 0.11294 1 0.0
