#------------------------------------------------------------------------------
#$Date: 2016-02-13 14:50:18 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/85/1538545.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_1538545
loop_
_publ_author_name
'Sadanaga, R.'
'Nishimura, T.'
'Watanabe, T.'
_publ_section_title
;
 The structure of jimboite, Mn3 (B O3)2 and relationship with the
 structure of kotoite
;
_journal_name_full               'Mineralogical Journal (Japan)'
_journal_page_first              380
_journal_page_last               388
_journal_volume                  4
_journal_year                    1965
_chemical_formula_sum            'B2 Mn3 O6'
_chemical_name_systematic        'Mn3 (B O3)2'
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2n 2n'
_symmetry_space_group_name_H-M   'P n m n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.638
_cell_length_b                   8.714
_cell_length_c                   4.633
_cell_volume                     227.617
_citation_journal_id_ASTM        MJTOAS
_cod_data_source_file            Sadanaga_MJTOAS_1965_919.cif
_cod_data_source_block           B2Mn3O6
_cod_original_cell_volume        227.6171
_cod_original_sg_symbol_Hall     '-P 2 2n (y,z,x)'
_cod_database_code               1538545
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,-y,-z
x,-y,z
x-1/2,y-1/2,-z-1/2
-x-1/2,y-1/2,z-1/2
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
Mn2 Mn+2 0 0.3116 0.5 1 0.0
B1 B+3 0.258 0 0.475 1 0.0
O1 O-2 0.299 0 0.76 1 0.0
Mn1 Mn+2 0 0 0 1 0.0
O2 O-2 0.216 0.13 0.302 1 0.0
