#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/69/9016910.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_9016910
loop_
_publ_author_name
'Jenkins, D. M.'
'Della Ventura, G.'
'Oberti, R.'
'Bozhilov, K.'
_publ_section_title
;
 Synthesis and characterization of amphiboles along the tremolite-glaucophane join
 Note: Sample WIN 9-1
;
_journal_name_full               'American Mineralogist'
_journal_page_first              588
_journal_page_last               600
_journal_volume                  98
_journal_year                    2013
_chemical_compound_source        Synthetic
_chemical_formula_sum            'Al0.596 Ca1.42 H2 Mg4.74 Na0.6 O24 Si7.824'
_chemical_name_mineral           Winchite
_space_group_IT_number           12
_space_group_name_Hall           '-C 2y'
_space_group_name_H-M_alt        'C 1 2/m 1'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.575
_cell_angle_gamma                90
_cell_length_a                   9.8076
_cell_length_b                   18.0004
_cell_length_c                   5.2804
_cell_formula_units_Z            2
_cell_volume                     902.206
_database_code_amcsd             0020107
_exptl_crystal_density_diffrn    2.973
_cod_data_source_file            inputs/fixed/downloads/05/05537.cif
_cod_data_source_block           05537
_cod_original_formula_sum        'Na.6 Mg4.74 Ca1.42 Al.596 Si7.824 H2 O24'
_cod_database_code               9016910
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,z
1/2+x,1/2-y,z
-x,y,-z
1/2-x,1/2+y,-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
NaA2 0.00000 0.47927 0.00000 0.09000 0.04053
MgM4 0.00000 0.27719 0.50000 0.08000 0.01368
CaM4 0.00000 0.27719 0.50000 0.71000 0.01368
NaM4 0.00000 0.27719 0.50000 0.21000 0.01368
AlM1 0.00000 0.08826 0.50000 0.08400 0.00988
MgM1 0.00000 0.08826 0.50000 0.91600 0.00988
AlM2 0.00000 0.17748 0.00000 0.08400 0.01064
MgM2 0.00000 0.17748 0.00000 0.91600 0.01064
AlM3 0.00000 0.00000 0.00000 0.08400 0.01051
MgM3 0.00000 0.00000 0.00000 0.91600 0.01051
SiT1 0.28068 0.08468 0.29671 0.97800 0.00899
AlT1 0.28068 0.08468 0.29671 0.02200 0.00899
SiT2 0.28869 0.17169 0.80393 0.97800 0.01039
AlT2 0.28869 0.17169 0.80393 0.02200 0.01039
H 0.20284 0.00000 0.76357 1.00000 0.02394
O1 0.11079 0.08660 0.21658 1.00000 0.01115
O2 0.11901 0.17091 0.72730 1.00000 0.01229
O3 0.10967 0.00000 0.71368 1.00000 0.01418
O4 0.36549 0.24850 0.79236 1.00000 0.01570
O5 0.34739 0.13453 0.09805 1.00000 0.01456
O6 0.34379 0.11802 0.58993 1.00000 0.01330
O7 0.33697 0.00000 0.28829 1.00000 0.01444
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0020107
