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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/1/53/03/1530315.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_1530315
loop_
_publ_author_name
'Louer, M.'
'Louer, D.'
_publ_section_title
;
 Etude structurale des hydroxysulfates de cadmium V. Synthese et structure
 cristalline de Cd3 M2 (O H)2 (S O4)3 (H2 O)2 M= Cs,K
;
_journal_name_full               'Revue de Chimie Minerale'
_journal_page_first              162
_journal_page_last               171
_journal_volume                  19
_journal_year                    1982
_chemical_formula_sum            'Cd3 Cs2 H6 O16 S3'
_chemical_name_systematic        'Cd3 Cs2 (O H)2 (S O4)3 (H2 O)2'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   19.376
_cell_length_b                   8.114
_cell_length_c                   10.132
_cell_volume                     1592.921
_citation_journal_id_ASTM        RVCMA8
_cod_data_source_file            Louer_RVCMA8_1982_792.cif
_cod_data_source_block           H6Cd3Cs2O16S3
_cod_original_formula_sum        'H6 Cd3 Cs2 O16 S3'
_cod_database_code               1530315
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
S2 S+6 0 0.3108 0.1186 1 0.0
Cd1 Cd+2 0.0862 0.9633 0 1 0.0
O10 O-2 0 0.048 -0.139 1 0.0
O1 O-2 0.3804 0.176 0.276 1 0.0
O3 O-2 0.2592 0.225 0.258 1 0.0
O2 O-2 0.3265 0.396 0.402 1 0.0
O9 O-2 0 0.797 0.081 1 0.0
S1 S+6 0.3279 0.306 0.2773 1 0.0
O7 O-2 0.06 0.21 0.12 1 0.0
O8 O-2 0.1297 0.249 0.372 1 0.0
O4 O-2 0.3398 0.423 0.169 1 0.0
Cs1 Cs+1 0.18957 0.4645 0.0443 1 0.0
O6 O-2 0 0.425 -0.006 1 0.0
Cd2 Cd+2 0 0.694 0.2824 1 0.0
O5 O-2 0 0.417 0.235 1 0.0
