#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/76/9017604.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_9017604
loop_
_publ_author_name
'Ondrus, P.'
'Skala, R.'
'Plasil, J.'
'Sejkora, J.'
'Veselovsky, F.'
'Cejka, J.'
'Kallistova, A.'
'Hlousek, J.'
'Fejfarova, K.'
'Skoda, R.'
'Dusek, M.'
'Gabasova, A.'
'Machovic, V.'
'Lapcak, L.'
_publ_section_title
;
 Svenekite, Ca[AsO2(OH)2]2. a new mineral from Jachymov, Czech Republic
;
_journal_name_full               'Mineralogical Magazine'
_journal_page_first              2711
_journal_page_last               2724
_journal_volume                  77
_journal_year                    2013
_chemical_compound_source        'Jachymov, Czech Republic'
_chemical_formula_sum            'As2 Ca H4 O8'
_chemical_name_mineral           Svenekite
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                92.605
_cell_angle_beta                 109.9002
_cell_angle_gamma                109.9017
_cell_length_a                   8.5606
_cell_length_b                   7.6926
_cell_length_c                   5.7206
_cell_formula_units_Z            2
_cell_volume                     327.479
_database_code_amcsd             0019984
_exptl_crystal_density_diffrn    3.265
_cod_data_source_file            inputs/fixed/downloads/18/18510.cif
_cod_data_source_block           18510
_cod_original_formula_sum        'Ca As2 O8 H4'
_cod_database_code               9017604
loop_
_space_group_symop_operation_xyz
x,y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ca 0.08168 0.18648 0.31266 0.01270
As1 0.34172 0.23993 0.98495 0.01135
As2 -0.18668 0.23399 0.66951 0.01220
O1 -0.17440 -0.06180 -0.00280 0.01490
O2 0.37710 0.40010 0.23620 0.02070
O3 0.54160 0.20790 0.07500 0.02110
O4 0.31160 0.32520 0.72130 0.01520
O5 -0.04570 0.32920 -0.03040 0.01680
O6 -0.12540 0.09350 0.52440 0.01440
O7 -0.16910 0.43390 0.53440 0.02060
O8 -0.39740 0.14120 0.65880 0.01860
H2 -0.22900 0.41000 0.43100 0.02480
H3 0.44900 0.46300 0.25300 0.02480
H5 0.55900 0.20200 0.98300 0.02530
H7 0.00000 0.50000 0.00000 0.02020
H8 0.50000 0.00000 0.50000 0.02230
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0019984
