#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/02/03/2020362.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2020362
loop_
_publ_author_name
'Riou, A.'
'Cudennec, Y.'
'Gerault, Y.'
_publ_section_title
;
 Cobalt(II) orthophosphate octahydrate
;
_journal_name_full               'Acta Crystallographica C (39,1983-)'
_journal_page_first              1412
_journal_page_last               1413
_journal_volume                  45
_journal_year                    1989
_chemical_formula_sum            'Co3 H16 O16 P2'
_chemical_name_systematic        'Co3 (P O4)2 (H2 O)8'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.9
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   10.021
_cell_length_b                   13.331
_cell_length_c                   4.673
_cell_volume                     603.276
_citation_journal_id_ASTM        ACSCEE
_cod_data_source_file            Riou_ACSCEE_1989_757.cif
_cod_data_source_block           H16Co3O16P2
_cod_original_cell_volume        603.2756
_cod_original_formula_sum        'H16 Co3 O16 P2'
_cod_database_code               2020362
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z
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
O1 O-2 0.1573 0 0.3711 1 0.0
O4 O-2 0.4009 0.38454 0.1956 1 0.0
H1 H+1 0.38 0.411 0.319 1 0.0
O5 O-2 0.1029 0.276 0.282 1 0.0
P1 P+5 0.31424 0 0.3811 1 0.0
Co2 Co+2 0 0.38993 0 1 0.0
O2 O-2 0.3935 0 0.7092 1 0.0
Co1 Co+2 0 0 0 1 0.0
H2 H+1 0.348 0.372 0.123 1 0.0
H4 H+1 0.058 0.221 0.286 1 0.0
H3 H+1 0.116 0.299 0.382 1 0.0
O3 O-2 0.3444 0.09648 0.2282 1 0.0
