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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/02/1530273.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_1530273
loop_
_publ_author_name
'Leineweber, A.'
'Friedriszik, M.W.'
'Jacobs, H.'
_publ_section_title
;
 Preparation and crystal structure of Mg (N H3)2 Cl2, Mg (N H3)2 Br2, and
 Mg (N H3)2 I2
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              229
_journal_page_last               234
_journal_volume                  147
_journal_year                    1999
_chemical_formula_sum            'Cl2 H6 Mg N2'
_chemical_name_systematic        '(Mg (N H3)2) Cl2'
_space_group_IT_number           65
_symmetry_space_group_name_Hall  '-C 2 2'
_symmetry_space_group_name_H-M   'C m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.181
_cell_length_b                   8.2067
_cell_length_c                   3.755
_cell_volume                     252.107
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Leineweber_JSSCBI_1999_1538.cif
_cod_data_source_block           H6Cl2Mg1N2
_cod_original_formula_sum        'H6 Cl2 Mg1 N2'
_cod_database_code               1530273
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z
-x,y,-z
-x,-y,-z
x,y,-z
-x,y,z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,y+1/2,-z
-x+1/2,y+1/2,z
x+1/2,-y+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
Cl1 Cl-1 0.2133 0 0.5 1 0.0
H1 H+1 0.045 0.312 0.158 0.75 0.0
Mg1 Mg+2 0 0 0 1 0.0
N1 N-3 0 0.2595 0 1 0.0
