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#$Date: 2016-11-14 04:23:27 +0200 (Mon, 14 Nov 2016) $
#$Revision: 188423 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/49/9014970.cif $
#------------------------------------------------------------------------------
#
# 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_9014970
loop_
_publ_author_name
'Averbuch-Pouchot, M. T.'
'Durif, A.'
'Guitel, J. C.'
_publ_section_title
;
 Structure cristalline d'un tripolyphosphate acide d'aluminium-ammonium:
 Al (N H4) H P3 O10
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1436
_journal_page_last               1438
_journal_paper_doi               10.1107/S0567740877006244
_journal_volume                  33
_journal_year                    1977
_chemical_formula_sum            'Al N O10 P3'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2ya'
_symmetry_space_group_name_H-M   'P 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 119.27
_cell_angle_gamma                90
_cell_length_a                   11.643
_cell_length_b                   4.918
_cell_length_c                   8.705
_cell_volume                     434.811
_database_code_amcsd             0009589
_exptl_crystal_density_diffrn    2.245
_cod_duplicate_entry             1007013
_cod_original_formula_sum        'Al P3 N O10'
_cod_database_code               9014970
_amcsd_formula_title             'Al H5 N O10 P3'
loop_
_space_group_symop_operation_xyz
x,y,z
1/2-x,y,-z
1/2+x,-y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Al1 0.00000 0.00000 0.00000
P1 0.00230 0.49970 0.22770
P2 0.25000 0.76190 0.00000
N1 0.25000 0.01100 0.50000
O1 -0.01290 0.20900 0.80910
O2 0.43670 0.45400 0.57460
O3 0.05710 0.30100 0.14900
O4 0.34750 0.56300 0.14910
O5 0.17790 -0.08000 0.07280