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#$Date: 2015-09-12 16:38:15 +0200 (Sat 12 de Sep de 2015) $
#$Revision: 155979 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/07/1530774.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_1530774
loop_
_publ_author_name
'Simonov, M.A.'
'Egorov-Tismenko, Yu.K.'
'Belov, N.V.'
_publ_section_title
;
 About the crystal structures of the ortophosphates with the formula
 (Na1-x Cdx) Cd2 (P O4) (P O3+x (O H)1-x)
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1101
_journal_page_last               1102
_journal_volume                  239
_journal_year                    1978
_chemical_formula_sum            'Cd3 O8 P2'
_chemical_name_systematic        'Cd3 (P O4)2'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   15.65
_cell_length_b                   11.07
_cell_length_c                   7.56
_cell_volume                     1309.736
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Simonov_DANKAS_1978_1289.cif
_cod_data_source_block           Cd3O8P2
_cod_database_code               1530774
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
x+1/2,y+1/2,z
-x+1,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x,y+1/2,-z-1/2
-x+1/2,y+1/2,z
x,-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
Cd1 Cd+2 0.15 0.817 0.574 1 0.0
O3 O-2 0.269 0.358 0.086 1 0.0
O1 O-2 0.082 0.741 0.322 1 0.0
P1 P+5 0.25 0.437 0.25 1 0.0
P2 P+5 0 0.82 0.31 1 0.0
O5 O-2 0 0.898 0.147 1 0.0
O2 O-2 0.332 0.515 0.281 1 0.0
O4 O-2 0 0.89 0.49 1 0.0
Cd2 Cd+2 0.102 0.5 0.5 1 0.0
