#------------------------------------------------------------------------------
#$Date: 2024-05-23 12:45:01 +0300 (Thu, 23 May 2024) $
#$Revision: 292002 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/51/9015168.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_9015168
loop_
_publ_author_name
'Boudjada, A.'
'Tranqui, D.'
'Guitel, J. C.'
_publ_section_title
;
 Structure d'un Orthophosphate Acide Mixte de Zinc Ammonium Monohydrate:
 Zn (N H4) H3 (P O4)2 (H2 O)
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1176
_journal_page_last               1178
_journal_paper_doi               10.1107/S0567740880005511
_journal_volume                  36
_journal_year                    1980
_chemical_formula_sum            'N O9 P2 Zn'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                116.25
_cell_angle_beta                 108.21
_cell_angle_gamma                84.14
_cell_length_a                   7.687
_cell_length_b                   8.049
_cell_length_c                   8.060
_cell_formula_units_Z            2
_cell_volume                     424.483
_database_code_amcsd             0016044
_exptl_crystal_density_diffrn    2.232
_cod_duplicate_entry             1008102
_cod_original_formula_sum        'N Zn P2 O9'
_cod_database_code               9015168
_amcsd_formula_title             'H9 N O9 P2 Zn'
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
N1 0.06250 0.19080 0.42540
Zn1 0.24209 0.47461 0.23714
P1 0.11903 0.75256 0.04823
P2 0.42141 0.75985 0.67992
O1 0.23430 0.91000 0.07660
O2 0.01790 0.82380 0.20920
O3 0.23900 0.59620 0.07460
O4 -0.02460 0.67610 -0.15140
O5 0.54380 0.84390 0.61070
O6 0.53460 0.65670 0.79240
O7 0.33730 0.93080 0.81520
O8 0.26810 0.64380 0.50420
O9 0.35830 0.28270 0.78080
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0016044
