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#$Date: 2015-10-05 11:50:49 +0300 (Mon, 05 Oct 2015) $
#$Revision: 159687 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/34/1533443.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_1533443
loop_
_publ_author_name
'Alonso, J.A.'
'Rivillas, F.'
'Martinez-Lope, M.J.'
'Pomjakushin, V.'
_publ_section_title
;
 Preparation and structural study from neutron diffraction data of R2 Mo
 O6 ( R= Dy, Ho, Er, Tm, Yb, Y )
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              2470
_journal_page_last               2476
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Mo O6 Y2'
_chemical_name_systematic        'Y2 (Mo O6)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 108.523
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   16.3538
_cell_length_b                   11.0183
_cell_length_c                   5.3506
_cell_volume                     914.185
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Alonso_JSSCBI_2004_1782.cif
_cod_data_source_block           Mo1O6Y2
_cod_original_cell_volume        914.1847
_cod_chemical_formula_sum_orig   'Mo1 O6 Y2'
_cod_database_code               1533443
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-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
O5 O-2 0.0718 0.2646 0.5835 1 0.0
O6 O-2 0.5921 0.0183 0.5791 1 0.0
Y3 Y+3 0.3316 0.1167 0.1207 1 0.0
Y1 Y+3 0 0.3929 0.25 1 0.0
O3 O-2 0.2281 0.2038 0.7408 1 0.0
Mo1 Mo+6 0.1545 0.1418 0.4405 1 0.0
O2 O-2 0.07917 0.0328 0.4859 1 0.0
Y2 Y+3 0 0.8644 0.25 1 0.0
O1 O-2 0.235 0.0518 0.3672 1 0.0
O4 O-2 0.106 0.221 0.1339 1 0.0