#------------------------------------------------------------------------------
#$Date: 2024-05-16 08:36:09 +0200 (Thu 16 de May de 2024) $
#$Revision: 291877 $
#$URL: svn://www.crystallography.net/cod/cif/9/01/17/9011751.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# 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_9011751
loop_
_publ_author_name
'Basso, R.'
'Lucchetti, G.'
'Palenzona, A.'
'Zefiro, L.'
_publ_section_title
;
 Haradaite from the Gambatesa mine, eastern Liguria, Italy
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              281
_journal_page_last               288
_journal_volume                  1995
_journal_year                    1995
_chemical_compound_source        'Gambatesa mine, eastern Liguria, Italy'
_chemical_formula_sum            'Ba0.14 O7 Si2 Sr0.86 V'
_chemical_name_mineral           Haradaite
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.314
_cell_length_b                   14.691
_cell_length_c                   7.031
_cell_formula_units_Z            4
_cell_volume                     548.896
_database_code_amcsd             0014874
_exptl_crystal_density_diffrn    3.796
_cod_original_formula_sum        '(Sr.86 Ba.14) V Si2 O7'
_cod_database_code               9011751
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,1/2+z
1/2+x,1/2-y,1/2+z
-x,y,1/2-z
1/2-x,1/2+y,1/2-z
-x,y,z
1/2-x,1/2+y,z
x,-y,-z
1/2+x,1/2-y,-z
x,y,1/2-z
1/2+x,1/2+y,1/2-z
-x,-y,1/2+z
1/2-x,1/2-y,1/2+z
-x,-y,-z
1/2-x,1/2-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Sr 0.00000 0.70640 0.25000 0.86000 0.00773
Ba 0.00000 0.70640 0.25000 0.14000 0.00773
V 0.00000 0.39130 0.25000 1.00000 0.00519
Si 0.00000 0.10760 0.02420 1.00000 0.00481
O1 0.24930 0.34700 0.06020 1.00000 0.00836
O2 0.00000 0.00000 0.00000 1.00000 0.01279
O3 0.00000 0.49980 0.25000 1.00000 0.01178
O4 0.00000 0.13650 0.25000 1.00000 0.00785
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0014874
