#------------------------------------------------------------------------------
#$Date: 2016-08-26 10:28:05 +0200 (vie 26 de ago de 2016) $
#$Revision: 186019 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/46/1534656.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1534656
loop_
_publ_author_name
'Schnick, W.'
'Horstmann, S.'
'Schmidpeter, A.'
_publ_section_title
;
 Synthese und Struktur des ersten TetraaminophosphoniumSalzes P (N H2)4 I
;
_journal_coden_ASTM              ANCEAD
_journal_name_full               'Angewandte Chemie (German Edition)'
_journal_page_first              818
_journal_page_last               819
_journal_paper_doi               10.1002/ange.19941060726
_journal_volume                  106
_journal_year                    1994
_chemical_formula_sum            'H8 I N4 P'
_chemical_name_systematic        '((N H2)4 P) I'
_space_group_IT_number           125
_symmetry_space_group_name_Hall  '-P 4a 2b'
_symmetry_space_group_name_H-M   'P 4/n b m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.426
_cell_length_b                   8.426
_cell_length_c                   4.867
_cell_volume                     345.545
_cod_data_source_file            Schnick_ANCEAD_1994_1623.cif
_cod_data_source_block           H8I1N4P1
_cod_original_cell_volume        345.5447
_cod_original_formula_sum        'H8 I1 N4 P1'
_cod_database_code               1534656
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x,z
-x+1/2,-y+1/2,z
y,-x+1/2,z
x,-y+1/2,-z
y,x,-z
-x+1/2,y,-z
-y+1/2,-x+1/2,-z
-x,-y,-z
y-1/2,-x,-z
x-1/2,y-1/2,-z
-y,x-1/2,-z
-x,y-1/2,z
-y,-x,z
x-1/2,-y,z
y-1/2,x-1/2,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
I1 I-1 0.25 0.25 0 1 0.0
H1 H+1 0.33899 -0.05538 -0.28314 1 0.0
P1 P+5 0.75 0.25 0.5 1 0.0
N1 N-3 0.13083 -0.13083 0.34546 1 0.0
