#------------------------------------------------------------------------------
#$Date: 2015-09-06 21:29:00 +0200 (Sun 06 de Sep de 2015) $
#$Revision: 154998 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/00/1530036.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_1530036
loop_
_publ_author_name
'Guseinov, G.G.'
'Shnulin, A.N.'
'Mamedov, F.Kh.'
'Mamedov, H.S.'
_publ_section_title
;
 The crystal structure of Nd4 In5 S13
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              1360
_journal_page_last               1362
_journal_volume                  246
_journal_year                    1979
_chemical_formula_sum            'In5 Nd4 S13'
_chemical_name_systematic        'Nd4 In5 S13'
_space_group_IT_number           55
_symmetry_space_group_name_Hall  '-P 2 2ab'
_symmetry_space_group_name_H-M   'P b a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   21.254
_cell_length_b                   11.774
_cell_length_c                   3.968
_cell_volume                     992.971
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Guseinov_DANKAS_1979_468.cif
_cod_data_source_block           In5Nd4S13
_cod_original_cell_volume        992.9705
_cod_database_code               1530036
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z
-x,-y,-z
x,y,-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
S7 S-2 0 0.5 0 1 0.0
Nd1 Nd+2 0.1562 0.1622 0 1 0.0
S3 S-2 -0.0941 -0.0044 0.5 1 0.0
Nd2 Nd+2 -0.3341 -0.0183 0 1 0.0
In3 In+3 -0.1704 0.1525 0.5 1 0.0
S1 S-2 0.1301 0.3463 0.5 1 0.0
S5 S-2 -0.2377 0.173 0 1 0.0
S2 S-2 -0.2421 -0.0781 0.5 1 0.0
S6 S-2 -0.1102 0.337 0.5 1 0.0
In2 In+3 0.0084 0.3342 0.5 1 0.0
S4 S-2 0.0197 0.1977 0 1 0.0
In1 In+3 0 0 0 1 0.0
