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#$Date: 2013-05-05 17:21:46 +0300 (Sun, 05 May 2013) $
#$Revision: 85285 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/74/9007471.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_9007471
loop_
_publ_author_name
'Fleet, S. G.'
'Megaw, H. D.'
_publ_section_title
;
 The crystal structure of yoderite
 Locality: Mautia Hill, Tanzania
;
_journal_name_full               'Acta Crystallographica'
_journal_page_first              721
_journal_page_last               728
_journal_volume                  15
_journal_year                    1962
_chemical_formula_sum            'Al2.64 Ca0.12 Fe0.24 H Mg O10 Si2'
_chemical_name_mineral           Yoderite
_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                 105.63
_cell_angle_gamma                90
_cell_length_a                   8.035
_cell_length_b                   5.805
_cell_length_c                   7.346
_cell_volume                     329.970
_exptl_crystal_density_diffrn    3.331
_[local]_cod_chemical_formula_sum_orig '(Mg Ca.12 Fe.24 Al2.64) Si2 O10 H'
_cod_database_code               9007471
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,1/2-y,z
-x,1/2+y,-z
-x,-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
MgA1 0.29510 0.00540 0.17790 0.25000 0.00266
CaA1 0.29510 0.00540 0.17790 0.03000 0.00266
FeA1 0.29510 0.00540 0.17790 0.06000 0.00266
AlA1 0.29510 0.00540 0.17790 0.66000 0.00266
MgA2 0.38940 0.25000 0.62970 0.25000 0.00266
CaA2 0.38940 0.25000 0.62970 0.03000 0.00266
FeA2 0.38940 0.25000 0.62970 0.06000 0.00266
AlA2 0.38940 0.25000 0.62970 0.66000 0.00266
MgA3 0.05540 0.25000 0.35470 0.25000 0.00266
CaA3 0.05540 0.25000 0.35470 0.03000 0.00266
FeA3 0.05540 0.25000 0.35470 0.06000 0.00266
AlA3 0.05540 0.25000 0.35470 0.66000 0.00266
Si1 0.06240 0.25000 0.79790 1.00000 0.00291
Si2 0.33970 0.75000 0.80260 1.00000 0.00291
O1 0.05710 0.98170 0.21620 1.00000 0.01064
O2 0.45450 0.97700 0.78180 1.00000 0.01064
O3 0.14550 0.25000 0.61610 1.00000 0.01064
O4 0.22060 0.25000 0.99070 1.00000 0.01064
O5 0.29880 0.25000 0.36070 1.00000 0.01064
O6 0.16860 0.75000 0.63380 1.00000 0.01064
O7 0.28180 0.75000 0.00370 1.00000 0.01064
O-H8 0.36330 0.75000 0.36310 1.00000 0.01064