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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/1/52/45/1524546.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_1524546
loop_
_publ_author_name
'Hideki, A.'
'Masaru, A.'
'Iwai, S.I.'
_publ_section_title
;
 Synthesis and crystal structure of cadmium hydrogen phosphate hydrate
;
_journal_name_full
'Iyo Kizai Kenkyusho Hokoku, Tokyo Ika Shika Daigaku'
_journal_page_first              63
_journal_page_last               68
_journal_volume                  10
_journal_year                    1976
_chemical_formula_sum            'Cd5 H10 O20 P4'
_chemical_name_systematic        'Cd5 H2 (P O4)4 (H2 O)4'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.59
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   17.887
_cell_length_b                   9.394
_cell_length_c                   9.675
_cell_volume                     1614.954
_citation_journal_id_ASTM        IKKHBS
_cod_data_source_file            Hideki_IKKHBS_1976_338.cif
_cod_data_source_block           H10Cd5O20P4
_cod_original_formula_sum        'H10 Cd5 O20 P4'
_cod_database_code               1524546
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-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
Cd2 Cd+2 0.32198 0.08886 -0.31013 1 0.0
O7 O-2 0.20142 0.40135 -0.33056 1 0.0
O5 O-2 0.16238 0.23713 -0.52919 1 0.0
O4 O-2 0.41605 0.39225 0.0523 1 0.0
O6 O-2 0.07822 0.26812 -0.3413 1 0.0
Cd3 Cd+2 0.17666 -0.02808 -0.13165 1 0.0
O3 O-2 0.4221 0.42774 -0.20448 1 0.0
P2 P+5 0.16042 0.26127 -0.37144 1 0.0
O10 O-2 0.26338 0.08974 0.0331 1 0.0
P1 P+5 0.41722 0.32111 -0.0889 1 0.0
O8 O-2 0.20172 0.1368 -0.2933 1 0.0
O1 O-2 0.34637 0.23014 -0.12732 1 0.0
O9 O-2 0.42946 -0.01963 -0.34765 1 0.0
O2 O-2 0.48599 0.21838 -0.08062 1 0.0
Cd1 Cd+2 0 0.10454 -0.25 1 0.0
