#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 14/03/2021 

data_5yOhtAoR
_audit_creation_date            2021-03-14
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "JOURNAL OF SOLID STATE CHEMISTRY"
_citation_journal_volume        101
_citation_page_first            296
_citation_page_last             308
_citation_article_id            .
_citation_year                  1992
_citation_DOI                   10.1016/0022-4596(92)90185-X

loop_
_citation_author_name
"P. Lacorre"
"J. Pannetier"
"J. Pebler"
"S. Nagel"
"D. Babel"
"A.de Kozak"
"M. Samouel"
"G. Ferey"

_atomic_positions_source_database_code_ICSD  41057
_atomic_positions_source_other               .

_transition_temperature  84.9(5)
_experiment_temperature  2

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM2+  1  1  .  primary  6  .

_exptl_crystal_magnetic_properties_details
;
NPD
FM on the plane xz
Ferrimagnetic
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry
1-dim irrep as primary
;

_parent_space_group.name_H-M_alt  'P 2_1/c'
_parent_space_group.IT_number                       14
_parent_space_group.transform_Pp_abc  'a,b,c;0,0,0'

loop_
_parent_propagation_vector.id
_parent_propagation_vector.kxkykz
k1 [0 0 0]

_parent_space_group.child_transform_Pp_abc  'a,b,c;0,0,0'
_space_group_magn.transform_BNS_Pp_abc  'a,b,c;0,0,0'



_space_group_magn.number_BNS  14.79
_space_group_magn.name_BNS  "P 2_1'/c'"
_cell_length_a             5.50750
_cell_length_b             10.95840
_cell_length_c             9.14270
_cell_angle_alpha          90.00
_cell_angle_beta           94.57
_cell_angle_gamma          90.00

loop_
_space_group_symop_magn_operation.id
_space_group_symop_magn_operation.xyz
1 x,y,z,+1 
2 -x,-y,-z,+1 
3 -x,y+1/2,-z+1/2,-1 
4 x,-y+1/2,z+1/2,-1 

loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1 

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba1 Ba 0.22800 0.16850 0.04250
Mn1 Mn 0.81030 0.06310 0.38030
Fe1 Fe 0.69260 0.12050 0.76650
F1 F 0.40400 0.28230 0.28530
F2 F 0.49930 0.02990 0.25150
F3 F 0.14450 0.39960 0.01070
F4 F 0.98370 0.48350 0.28070
F5 F 0.09720 0.73780 0.21440
F6 F 0.34660 0.64690 0.93980
F7 F 0.71590 0.40530 0.47540

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
_atom_site_moment.magnitude
Mn1 -0.58(15) 0.00000 -4.09(6) mx,my,mz  4.08(6)
Fe1 0.72(14) 0.00000 4.10(7) mx,my,mz    4.11(7)

