#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/81/1528118.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_1528118
loop_
_publ_author_name
'Templeton, D.H.'
'Carter, G.F.'
_publ_section_title
;
 The crystal structure of yttrium trichloride and similar compounds
;
_journal_name_full               'Journal of Physical Chemistry'
_journal_page_first              940
_journal_page_last               944
_journal_volume                  58
_journal_year                    1954
_chemical_formula_sum            'Cl3 Y'
_chemical_name_systematic        'Y Cl3'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 111
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.92
_cell_length_b                   11.94
_cell_length_c                   6.44
_cell_volume                     496.762
_citation_journal_id_ASTM        JPCHAX
_cod_data_source_file            Templeton_JPCHAX_1954_1607.cif
_cod_data_source_block           Cl3Y1
_cod_original_cell_volume        496.7616
_cod_original_formula_sum        'Cl3 Y1'
_cod_database_code               1528118
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-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
Cl1 Cl-1 0.211 0 0.247 1 0.0
Y1 Y+3 0 0.166 0 1 0.0
Cl2 Cl-1 0.229 0.179 0.76 1 0.0
