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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/38/8103879.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_8103879
loop_
_publ_author_name
'Basso, R.'
'Lucchetti, G.'
'Zefiro, L.'
'Palenzona, A.'
_publ_section_title
;
 Reppiaite, Mn5(OH)4(VO4)2, a new mineral from Val Graveglia (Northern
 Apennines, Italy)
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              223
_journal_page_last               234
_journal_volume                  201
_journal_year                    1992
_chemical_formula_sum            'As0.22 H4 Mn5 O12 V1.78'
_chemical_name_systematic        'Mn5 (O H)4 ((V0.89 As0.11) O4)2'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 98.45
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.604
_cell_length_b                   9.558
_cell_length_c                   5.393
_cell_volume                     489.677
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Basso_ZEKRDZ_1992_59.cif
_cod_data_source_block           H4As0.22Mn5O12V1.78
_cod_original_cell_volume        489.6766
_cod_original_formula_sum        'H4 As0.22 Mn5 O12 V1.78'
_cod_database_code               8103879
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
As1 As+5 0.3111 0 0.4464 0.11 0.0
Mn2 Mn+2 0 0.3471 0 1 0.0
O3 O-2 0.3748 0 0.1618 1 0.0
Mn3 Mn+2 0 0.1818 0.5 1 0.0
O1 O-2 0.3917 0.3247 0.1336 1 0.0
Mn1 Mn+2 0 0 0 1 0.0
O4 O-2 0.1332 0.3552 0.3817 1 0.0
V1 V+5 0.3111 0 0.4464 0.89 0.0
O2 O-2 0.1281 0 0.3855 1 0.0
