#------------------------------------------------------------------------------
#$Date: 2015-10-10 01:31:08 +0300 (Sat, 10 Oct 2015) $
#$Revision: 163666 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/60/1536080.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_1536080
loop_
_publ_author_name
'Nockemann, P.'
'Meyer, G.'
_publ_section_title
;
 Bildung von N H4 (Hg3 (N H)2)(N O3)3 und Umwandlung in (Hg2 N) (N O3)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              2709
_journal_page_last               2714
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'H6 Hg3 N6 O9'
_chemical_name_systematic        '(N H4) (Hg3 (N H)2) (N O3)3'
_space_group_IT_number           213
_symmetry_space_group_name_Hall  'P 4bd 2ab 3'
_symmetry_space_group_name_H-M   'P 41 3 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.3036
_cell_length_b                   10.3036
_cell_length_c                   10.3036
_cell_volume                     1093.873
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Nockemann_ZAACAB_2002_831.cif
_cod_data_source_block           H6Hg3N6O9
_cod_database_code               1536080
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/4,x+3/4,z+1/4
-x+1/2,-y,z+1/2
y+1/4,-x+1/4,z+3/4
x+1/2,-y+1/2,-z
y+3/4,x+1/4,-z+1/4
-x,y+1/2,-z+1/2
-y+3/4,-x+3/4,-z+3/4
z,x,y
-x+1/4,z+3/4,y+1/4
-z+1/2,-x,y+1/2
x+1/4,-z+1/4,y+3/4
z+1/2,-x+1/2,-y
x+3/4,z+1/4,-y+1/4
-z,x+1/2,-y+1/2
-x+3/4,-z+3/4,-y+3/4
y,z,x
y+1/2,-z+1/2,-x
z+3/4,y+1/4,-x+1/4
-y,z+1/2,-x+1/2
-z+3/4,-y+3/4,-x+3/4
-y+1/2,-z,x+1/2
z+1/4,-y+1/4,x+3/4
-z+1/4,y+3/4,x+1/4
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
N1 N-3 -0.2794 -0.2794 -0.2794 1 0.0
Hg1 Hg+2 -0.15648 -0.375 -0.40648 1 0.0
O2 O-2 -0.5205 -0.1212 -0.1292 1 0.0
N3 N-3 -0.125 0.125 -0.375 1 0.0
O1 O-2 0.375 -0.248 -0.002 1 0.0
N2 N+5 0.375 -0.1617 -0.0883 1 0.0
