#------------------------------------------------------------------------------
#$Date: 2016-02-16 02:10:39 +0100 (mar 16 de feb de 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/94/7209436.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_7209436
loop_
_publ_author_name
'Bluhm, K.'
'Utzolino, A.'
_publ_section_title
;
 Synthese und Kristallstruktur von manganhaltigen Pyroboraten: Mn Co (B2
 O5) und Mn Mg (B2 O5)
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische
 Chemie (42,1987-)
;
_journal_page_first              912
_journal_page_last               916
_journal_volume                  51
_journal_year                    1996
_chemical_formula_sum            'B2 Mg Mn O5'
_chemical_name_systematic        'Mn Mg (B2 O5)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                104.47
_cell_angle_beta                 90.6
_cell_angle_gamma                91.98
_cell_formula_units_Z            2
_cell_length_a                   3.1897
_cell_length_b                   6.198
_cell_length_c                   9.367
_cell_volume                     179.167
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            boron_244.cif
_cod_data_source_block           B2Mg1Mn1O5
_cod_original_cell_volume        179.1671
_cod_original_formula_sum        'B2 Mg1 Mn1 O5'
_cod_database_code               7209436
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-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
O4 O-2 0.5504 0.8591 0.2992 1 0.0
B1 B+3 0.691 0.6793 0.3523 1 0.0
Mg2 Mg+2 0.2322 0.36625 0.09986 0.5 0.0
O3 O-2 0.7393 0.4777 0.2562 1 0.0
Mn2 Mn+2 0.2322 0.36625 0.09986 0.5 0.0
B2 B+3 0.3327 0.8784 0.1699 1 0.0
Mn1 Mn+2 0.7384 0.21454 0.36242 0.5 0.0
Mg1 Mg+2 0.7384 0.21454 0.36242 0.5 0.0
O1 O-2 0.2658 0.6975 0.0543 1 0.0
O2 O-2 0.2164 0.0899 0.1821 1 0.0
O5 O-2 0.7624 0.7222 0.4994 1 0.0
