#------------------------------------------------------------------------------
#$Date: 2015-10-09 20:24:49 +0200 (Fri, 09 Oct 2015) $
#$Revision: 162793 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/54/1535419.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_1535419
loop_
_publ_author_name
'Hochrein, O.'
'Kniep, R.'
'Kohout, M.'
'Schnelle, W.'
_publ_section_title
;
 Li4 Sr2 (Cr2 N6): ein Hexanitridodichromat(V)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              2738
_journal_page_last               2743
_journal_volume                  628
_journal_year                    2002
_chemical_formula_sum            'Cr2 Li4 N6 Sr2'
_chemical_name_systematic        'Li4 Sr2 (Cr2 N6)'
_space_group_IT_number           61
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.14
_cell_length_b                   7.3541
_cell_length_c                   10.5355
_cell_volume                     708.159
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hochrein_ZAACAB_2002_469.cif
_cod_data_source_block           Cr2Li4N6Sr2
_cod_original_cell_volume        708.1592
_cod_database_code               1535419
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z
-x,y+1/2,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z
x,-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
N2 N-3 -0.2168 0.0778 0.3444 1 0.0
Cr2 Cr+5 -0.04778 0.10639 0.41751 1 0.0
Sr1 Sr+2 0.30787 0.0856 0.41831 1 0.0
N3 N-3 0.0491 0.2946 0.375 1 0.0
N1 N-3 -0.0682 0.1022 0.5967 1 0.0
Li2 Li+1 0.1198 0.2885 0.1837 1 0.0
Li1 Li+1 -0.1181 0.0961 0.7799 1 0.0
