#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/88/1538836.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_1538836
loop_
_publ_author_name
'Mehmed, F.'
'Haraldsen, H.'
_publ_section_title
;
 Magnetochemische Untersuchungern. XXVIII. Das magnetische Verhalten der
 allotropen Modifikationen des Mangan(II)-Sulfides
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              193
_journal_page_last               200
_journal_volume                  235
_journal_year                    1938
_chemical_formula_sum            'Mn S'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   3.996
_cell_length_b                   3.996
_cell_length_c                   6.446
_cell_volume                     89.140
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Mehmed_ZAACAB_1938_638.cif
_cod_data_source_block           Mn1S1
_cod_original_cell_volume        89.13985
_cod_original_formula_sum        'Mn1 S1'
_cod_database_code               1538836
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
y,x,z+1/2
-x+y,y,z
-x,-x+y,z+1/2
-y,-x,z
x-y,-y,z+1/2
x,x-y,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
Mn1 Mn+2 0.3333 0.6667 0 1 0.0
S1 S-2 0.3333 0.6667 0.375 1 0.0
