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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/4/34/43/4344376.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_4344376
loop_
_publ_author_name
'Hriljac, J.A.'
'Torardi, C.C.'
_publ_section_title
;
 Synthesis and structure of the novel layered oxide Bi Mo2 O7 O H . 2H2 O
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6003
_journal_page_last               6007
_journal_volume                  32
_journal_year                    1993
_chemical_formula_sum            'Bi H5 Mo2 O10'
_chemical_name_systematic        'Bi Mo2 O7 (O H) (H2 O)2'
_space_group_IT_number           11
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 113.329
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.34321
_cell_length_b                   11.59703
_cell_length_c                   5.79244
_cell_volume                     391.270
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Hriljac_INOCAJ_1993_1689.cif
_cod_data_source_block           H5Bi1Mo2O10
_cod_original_cell_volume        391.2699
_cod_original_formula_sum        'H5 Bi1 Mo2 O10'
_cod_database_code               4344376
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x,-y,-z
x,-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
Mo1 Mo+6 0.655 0.0956 0.193 1 0.0
O2 O-2 0.591 0.25 0.0336 1 0.0
O6 O-2 0.9426 0.1195 0.3936 1 0.0
Bi1 Bi+3 0.264 0.25 0.6584 1 0.0
O1 O-2 0.074 0.25 0.8756 1 0.0
O5 O-2 0.5117 0.1148 0.3867 1 0.0
O4 O-2 0.8257 0.0708 0.8989 1 0.0
O3 O-2 0.3643 0.0669 0.8381 1 0.0
