#------------------------------------------------------------------------------
#$Date: 2016-12-28 16:25:28 +0200 (Wed, 28 Dec 2016) $
#$Revision: 189486 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/31/09/2310941.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# 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_2310941
loop_
_publ_author_name
'Sakurai, K.'
'Tomiie, Y.'
_publ_section_title
;
 The Crystal Structure of Hydrazinium Bromide, N2 H5 Br
;
_journal_issue                   2
_journal_name_full               'Acta Crystallographica (1,1948-23,1967)'
_journal_page_first              289
_journal_page_last               289
_journal_paper_doi               10.1107/S0365110X52000812
_journal_volume                  5
_journal_year                    1952
_chemical_formula_sum            'Br H5 N2'
_chemical_name_systematic        'N2 H5 Br'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 110.27
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   12.85
_cell_length_b                   4.54
_cell_length_c                   11.94
_cell_volume                     653.430
_citation_journal_id_ASTM        ACCRA9
_cod_data_source_file            Sakurai_ACCRA9_1952_161.cif
_cod_data_source_block           H5Br1N2
_cod_original_cell_volume        653.4296
_cod_original_formula_sum        'H5 Br1 N2'
_cod_database_code               2310941
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2016-12-28
;
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z-1/2
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
_atom_site_attached_hydrogens
Br1 Br-1 -0.1037 0.097 0.0802 1 0.0 0
N1 N-2 0.1492 0.39 0.135 1 0.0 2
N2 N-2 0.141 0.62 0.2165 1 0.0 3
