#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/00/1530057.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_1530057
loop_
_publ_author_name
'Harbrecht, B.'
_publ_section_title
;
 Die trikline Modifikation von Ta6 S
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              225
_journal_page_last               234
_journal_volume                  138
_journal_year                    1988
_chemical_formula_sum            'S Ta6'
_chemical_name_systematic        'Ta6 S'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                59.32
_cell_angle_beta                 68.58
_cell_angle_gamma                77.18
_cell_formula_units_Z            2
_cell_length_a                   5.243
_cell_length_b                   7.572
_cell_length_c                   7.611
_cell_volume                     241.676
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Harbrecht_JCOMAH_1988_1598.cif
_cod_data_source_block           S1Ta6
_cod_original_cell_volume        241.6762
_cod_original_formula_sum        'S1 Ta6'
_cod_database_code               1530057
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-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
Ta3 Ta 0.3691 0.7033 0.9248 1 0.0
S1 S-2 0.222 0.418 0.286 1 0.0
Ta6 Ta 0.4286 0.1487 0.5718 1 0.0
Ta4 Ta 0.1639 0.6921 0.3727 1 0.0
Ta2 Ta 0.5 0 0 1 0.0
Ta5 Ta 0.2189 0.4108 0.813 1 0.0
Ta1 Ta 0 0 0 1 0.0
Ta7 Ta 0.0473 0.138 0.2874 1 0.0
