#------------------------------------------------------------------------------
#$Date: 2016-12-28 09:09:59 +0200 (Wed, 28 Dec 2016) $
#$Revision: 189465 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/49/1544907.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_1544907
loop_
_publ_author_name
'Kato, T.'
_publ_section_title
;
 The crystal structure of ganophyllite; monoclinic subcell
;
_journal_name_full               'Mineralogical Journal'
_journal_page_first              1
_journal_page_last               13
_journal_volume                  10
_journal_year                    1980
_chemical_formula_sum            'Al2.5 Ca0.7 K0.17 Mn7.5 Na0.06 O32 Si9.8'
_chemical_name_common            (K,Na,Ca)0.96Mn6(Si,Al)12(O,OH)32*nH2O
_chemical_name_mineral           'ganophyllite: monoclinic subcell'
_space_group_IT_number           15
_space_group_name_H-M_alt        'I 1 2/a 1'
_symmetry_space_group_name_Hall  '-I 2ya'
_symmetry_space_group_name_H-M   'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 93.96000
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   5.53400
_cell_length_b                   13.56500
_cell_length_c                   25.09000
_cell_volume                     1878.977
_cod_data_source_file            ganophyllite.cif
_cod_data_source_block           ganophyllite
_cod_original_formula_sum        'Si9.8 Al2.5 Mn7.5 Ca0.7 Na0.06 K0.17 O32'
_cod_database_code               1544907
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
'-x+1/2, y, -z'
'x+1/2, -y, z'
'x+1/2, y+1/2, z+1/2'
'-x+1/2, -y+1/2, -z+1/2'
'-x, y+1/2, -z+1/2'
'x, -y+1/2, z+1/2'
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_B_iso_or_equiv
_atom_site_type_symbol
K 1.0 0.000000 0.000000 0.000000 Biso 9.876552 K
Mn1 1.0 -0.0060(4) 0.06210(10) 0.23720(10) Biso 0.798600 Mn
Mn2 1.0 0.4970(4) 0.18700(10) 0.24470(10) Biso 1.006341 Mn
T1 1.0 0.7996(10) 0.4465(4) 0.1515(2) Biso 0.762071 Si
T2 1.0 0.8011(8) 0.2188(4) 0.13820(10) Biso 1.709139 Si
T3 1.0 0.2982(5) 0.1045(2) 0.12870(10) Biso 2.687349 Si
O1 1.0 0.532(3) 0.1765(9) 0.1144(5) Biso 3.898336 O
O2 1.0 0.041(4) 0.1686(9) 0.1130(7) Biso 4.650654 O
O3 1.0 0.8115(18) 0.3349(7) 0.1253(4) Biso 1.549044 O
O4 1.0 0.0364(16) 0.5057(7) 0.1292(4) Biso 1.546680 O
O5 1.0 0.2842(18) 0.0209(8) 0.0816(5) Biso 2.906160 O
O6 1.0 0.3172(14) 0.0667(7) 0.1925(4) Biso 1.503962 O
O7 1.0 0.8188(16) 0.1966(7) 0.2007(4) Biso 1.132218 O
O8 1.0 0.8226(14) 0.4408(7) 0.2171(4) Biso 0.987568 O
OH 1.0 0.3261(15) 0.3209(7) 0.2125(4) Biso 1.047351 O
OW1 1.0 -0.0142(14) 0.0679(7) 0.0633(4) Biso 0.749354 O
OW2 1.0 0.5588(16) 0.0705(7) 0.0624(4) Biso 1.085016 O
