#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/21/1532177.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_1532177
loop_
_publ_author_name
'Schleid, T.'
'Klein, E.K.'
_publ_section_title
;
 Nd2 S2 Te: Neodymium(III) sulfide telluride with (Ce2 O2 S)-type crystal
 structure
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              807
_journal_page_last               808
_journal_volume                  627
_journal_year                    2001
_chemical_formula_sum            'Nd2 S2 Te'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   4.6106
_cell_length_b                   4.6106
_cell_length_c                   7.6954
_cell_volume                     141.670
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Schleid_ZAACAB_2001_61.cif
_cod_data_source_block           Nd2S2Te1
_cod_original_cell_volume        141.6696
_cod_original_formula_sum        'Nd2 S2 Te1'
_cod_database_code               1532177
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,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
Nd1 Nd+3 0.3333 0.6667 0.26589 1 0.0
S1 S-2 0.3333 0.6667 0.63633 1 0.0
Te1 Te-2 0 0 0 1 0.0
