#------------------------------------------------------------------------------
#$Date: 2024-05-02 12:48:35 +0200 (Thu 02 de May de 2024) $
#$Revision: 291455 $
#$URL: svn://www.crystallography.net/cod/cif/9/00/69/9006973.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_9006973
loop_
_publ_author_name
'Leger, J. M.'
'Haines, J.'
'Chateau, C.'
'Bocquillon, G.'
'Schmidt, M. W.'
'Hull, S.'
'Gorelli, F.'
'Lesauze, A.'
'Marchand, R.'
_publ_section_title
;
 Phosphorus oxynitride PON, a silica analogue: structure and compression
 of the cristobalite-like phase; P-T phase diagram
 Note: quartz structure type
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              388
_journal_page_last               398
_journal_paper_doi               10.1007/s002690100161
_journal_volume                  28
_journal_year                    2001
_chemical_formula_structural     PON
_chemical_formula_sum            'N O P'
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.757
_cell_length_b                   4.757
_cell_length_c                   5.2460
_cell_formula_units_Z            3
_cell_volume                     102.808
_database_code_amcsd             0008558
_exptl_crystal_density_diffrn    2.955
_cod_original_formula_sum        'P (O N)'
_cod_database_code               9006973
_amcsd_formula_title             PON
loop_
_space_group_symop_operation_xyz
x,y,z
y,x,2/3-z
-y,x-y,2/3+z
-x,-x+y,1/3-z
-x+y,-x,1/3+z
x-y,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
P 0.47240 0.00000 0.00000 1.00000
O 0.40530 0.26690 0.11590 0.50000
N 0.40530 0.26690 0.11590 0.50000
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0008558
