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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/66/2106677.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2106677
loop_
_publ_author_name
'Fleet, M.E.'
_publ_section_title
;
 The crystal structure of Zn As2
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              122
_journal_page_last               126
_journal_volume                  30
_journal_year                    1974
_chemical_formula_sum            'As2 Zn'
_chemical_name_systematic        'Zn As2'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 102.28
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.287
_cell_length_b                   7.691
_cell_length_c                   8.01
_cell_volume                     559.035
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Fleet_ACBCAR_1974_1333.cif
_cod_data_source_block           As2Zn1
_cod_original_cell_volume        559.0345
_cod_original_formula_sum        'As2 Zn1'
_cod_database_code               2106677
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-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
As3 As 0.2414 0.4918 0.4368 1 0.0
As1 As 0.3803 0.4224 0.2226 1 0.0
As4 As 0.0691 0.2532 0.3919 1 0.0
As2 As 0.2401 0.013 0.4345 1 0.0
Zn2 Zn 0.3925 0.0963 0.2207 1 0.0
Zn1 Zn 0.0809 0.7479 0.3957 1 0.0
