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#$Date: 2008-03-10 10:25:41 +0200 (Mon, 10 Mar 2008) $
#$Revision: 255 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9009360.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_9009360
loop_
_publ_author_name
'Basso R'
'Palenzona A'
'Zefiro L'
_publ_section_title
;
 Crystal structure refinement of a Sr-bearing term related to copper
 vanadates and arsenates of adelite and descloizite groups
 Locality: Molinello mine, Val Graveglia, Northern Appenines, Eastern Liguria, Italy
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              300
_journal_page_last               308
_journal_volume                  1989
_journal_year                    1989
_chemical_formula_sum            '(Ca.924 Pb.076) Cu (V.59 As.41) O5 H'
_chemical_name_mineral           Tangeite
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.836
_cell_length_b                   7.430
_cell_length_c                   9.347
_cell_volume                     405.300
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,1/2+y,1/2-z
1/2+x,1/2-y,-z
1/2-x,-y,1/2+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
Ca 0.98030 0.13140 0.82310 0.92400 0.01127
Pb 0.98030 0.13140 0.82310 0.07600 0.01127
Cu 0.25030 0.24600 0.50050 1.00000 0.00836
V 0.48740 0.88400 0.66730 0.59000 0.00722
As 0.48740 0.88400 0.66730 0.41000 0.00722
O1 0.50370 0.06400 0.55020 1.00000 0.01355
O2 0.43230 0.71050 0.55860 1.00000 0.01811
O3 0.73830 0.86230 0.75830 1.00000 0.01482
O4 0.25840 0.89670 0.77780 1.00000 0.01570
O5 0.99670 0.10870 0.56820 1.00000 0.01077
H5 0.01200 0.00600 0.49900 1.00000 ?