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#$Date: 2013-05-09 16:53:25 +0300 (Thu, 09 May 2013) $
#$Revision: 86000 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/57/9015780.cif $
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#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9015780
loop_
_publ_author_name
'Averbuch-Pouchot M'
'Durif, A.'
'Guitel, J.'
_publ_section_title
;
 Existence d'un nouvel anion condense: Cr2PO10.
 Structures cristallines de deux phosphochromates de baryum:
 BaHCr2PO10*H2O et BaHCr2PO10*3H2O
 _cod_database_code 1007011
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1431
_journal_page_last               1435
_journal_volume                  33
_journal_year                    1977
_chemical_formula_sum            'Ba Cr2 O11 P'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                106.28
_cell_angle_beta                 105.37
_cell_angle_gamma                94.14
_cell_length_a                   9.333
_cell_length_b                   7.779
_cell_length_c                   7.526
_cell_volume                     499.356
_database_code_amcsd             0009587
_exptl_crystal_density_diffrn    2.981
_[local]_cod_chemical_formula_sum_orig 'Ba Cr2 P O11'
_cod_database_code               9015780
_amcsd_formula_title             'Ba Cr2 H3 O11 P'
loop_
_space_group_symop_operation_xyz
x,y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba1 0.11799 0.45756 0.26568
Cr1 0.75030 0.72640 0.24430
Cr2 0.25360 0.93040 0.11870
P1 0.78230 0.14990 0.31650
O1 0.58790 0.70320 0.09740
O2 0.86130 0.62080 0.13160
O3 0.73620 0.65210 0.41810
O4 0.82640 0.96960 0.34560
O5 0.67310 0.21700 0.44090
O6 0.91350 0.29700 0.39040
O7 0.68940 0.11350 0.10230
O8 0.14620 0.74990 0.10320
O9 0.16290 0.10090 0.13120
O10 0.40360 0.97810 0.29830
O11 0.41550 0.46570 0.28770