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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/1/52/95/1529556.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_1529556
loop_
_publ_author_name
'Amberg, M.'
'Guenter, J.R.'
'Schmalle, H.W.'
'Blasse, G.'
_publ_section_title
;
 Preparation, crystal structure, and luminescence of magnesium molybdate
 and tungstate monohydrates, Mg Mo O4 H2 O and Mg W O4 H2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              162
_journal_page_last               169
_journal_volume                  77
_journal_year                    1988
_chemical_formula_sum            'H2 Mg Mo O5'
_chemical_name_systematic        'Mg Mo O4 (H2 O)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                100.84
_cell_angle_beta                 95.03
_cell_angle_gamma                106.57
_cell_formula_units_Z            2
_cell_length_a                   5.662
_cell_length_b                   5.861
_cell_length_c                   6.869
_cell_volume                     212.151
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Amberg_JSSCBI_1988_1678.cif
_cod_data_source_block           H2Mg1Mo1O5
_cod_original_cell_volume        212.1514
_cod_original_formula_sum        'H2 Mg1 Mo1 O5'
_cod_database_code               1529556
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
Mg1 Mg+2 0.3594 0.2926 -0.1944 1 0.0
O5 O-2 0.0969 0.4764 -0.2215 1 0.0
H1 H+1 0.1237 0.6493 -0.1984 1 0.0
O2 O-2 0.364 -0.1288 0.1674 1 0.0
Mo1 Mo+6 0.25802 0.12151 0.25128 1 0.0
O4 O-2 -0.0715 0.0239 0.2123 1 0.0
O3 O-2 0.3653 0.2341 0.505 1 0.0
H2 H+1 -0.0404 0.4229 -0.1815 1 0.0
O1 O-2 0.3744 0.3625 0.1229 1 0.0
