#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/69/9016911.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_9016911
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 4-2
;
_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            'Al0.618 Ca1.42 H2 Mg4.88 Na0.65 O24 Si7.712'
_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                 104.423
_cell_angle_gamma                90
_cell_length_a                   9.7739
_cell_length_b                   17.9636
_cell_length_c                   5.2659
_cell_formula_units_Z            2
_cell_volume                     895.418
_database_code_amcsd             0020108
_exptl_crystal_density_diffrn    3.003
_cod_data_source_file            inputs/fixed/downloads/05/05538.cif
_cod_data_source_block           05538
_cod_original_formula_sum        'Na.65 Mg4.88 Ca1.42 Al.618 Si7.712 H2 O24'
_cod_database_code               9016911
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
NaA 0.00000 0.50000 0.00000 0.28000 0.07814
MgM4 0.00000 0.27693 0.50000 0.10500 0.01203
CaM4 0.00000 0.27693 0.50000 0.71000 0.01203
NaM4 0.00000 0.27693 0.50000 0.18500 0.01203
AlM1 0.00000 0.08830 0.50000 0.06600 0.00722
MgM1 0.00000 0.08830 0.50000 0.93400 0.00722
AlM2 0.00000 0.17747 0.00000 0.06600 0.00823
MgM2 0.00000 0.17747 0.00000 0.93400 0.00823
AlM3 0.00000 0.00000 0.00000 0.06600 0.00798
MgM3 0.00000 0.00000 0.00000 0.93400 0.00798
SiT1 0.28063 0.08459 0.29511 0.96400 0.00583
AlT1 0.28063 0.08459 0.29511 0.03600 0.00583
SiT2 0.28941 0.17146 0.80351 0.96400 0.00621
AlT2 0.28941 0.17146 0.80351 0.03600 0.00621
H 0.19245 0.00000 0.74231 1.00000 0.01659
O1 0.11062 0.08673 0.21645 1.00000 0.00823
O2 0.11904 0.17120 0.72635 1.00000 0.00912
O3 0.10974 0.00000 0.71485 1.00000 0.00963
O4 0.36571 0.24868 0.79115 1.00000 0.01191
O5 0.34784 0.13441 0.09800 1.00000 0.01191
O6 0.34347 0.11794 0.58877 1.00000 0.01089
O7 0.33775 0.00000 0.28706 1.00000 0.01216
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0020108
