data_global
_amcsd_formula_title 'PON'
loop_
_publ_author_name
'Chateau C'
'Haines J'
'Leger J M'
'LeSauze A'
'Marchand R'
_journal_name_full 'American Mineralogist'
_journal_volume 84 
_journal_year 1999
_journal_page_first 207
_journal_page_last 210
_publ_section_title
;
 A moganite-type phase in the silica analog phosphorus oxynitride
;
_database_code_amcsd 0002089
_chemical_formula_sum 'P (O N)'
_cell_length_a 8.5173
_cell_length_b 4.7453
_cell_length_c 10.3990
_cell_angle_alpha 90
_cell_angle_beta 90.00
_cell_angle_gamma 90
_cell_volume 420.298
_exptl_crystal_density_diffrn      2.891
_symmetry_space_group_name_H-M 'I 1 2/a 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  '1/2-x,y,-z'
  '-x,1/2+y,1/2-z'
  '1/2+x,-y,z'
  '+x,1/2-y,1/2+z'
  '-x,-y,-z'
  '1/2-x,1/2-y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
P1   0.25000  -0.01310   0.00000   1.00000   0.04889
P2   0.00310   0.24290   0.16530   1.00000   0.04889
O1  -0.00500   0.06020   0.29040   0.50000   0.04889
N1  -0.00500   0.06020   0.29040   0.50000   0.04889
O2   0.16480   0.18420   0.09870   0.50000   0.04889
N2   0.16480   0.18420   0.09870   0.50000   0.04889
O3  -0.13300   0.20220   0.07150   0.50000   0.04889
N3  -0.13300   0.20220   0.07150   0.50000   0.04889