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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/00/23/4002378.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_4002378
loop_
_publ_author_name
'Esmaeilzadeh, S.'
'Halenius, E.'
'Valldor, M.'
_publ_section_title
;
 Crystal growth, magnetic, and optical properties of the ternary nitride
 Mn Si N2
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2713
_journal_page_last               2718
_journal_volume                  18
_journal_year                    2006
_chemical_formula_sum            'Mn N2 Si'
_chemical_name_systematic        'Mn Si N2'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.2706
_cell_length_b                   6.5206
_cell_length_c                   5.0706
_cell_volume                     174.264
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Esmaeilzadeh_CMATEX_2006_937.cif
_cod_data_source_block           Mn1N2Si1
_cod_original_cell_volume        174.2637
_cod_original_formula_sum        'Mn1 N2 Si1'
_cod_database_code               4002378
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
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
N2 N-3 0.0478 0.0906 0.348 1 0.0
N1 N-3 0.1133 0.6593 0.42 1 0.0
Si1 Si+4 0.067 0.126 0.006 1 0.0
Mn1 Mn+2 0.077 0.624 0 1 0.0