#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 14/10/2020

data_5yOhtAoR
_audit_creation_date            2020-10-14
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "PHYSICAL REVIEW B"
_citation_journal_volume        88
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            144405
_citation_year                  2013
_citation_DOI                   10.1103/PhysRevB.88.144405

loop_
_citation_author_name
"J. Ma"
"C.D.D. Cruz"
"T. Hong"
"W. Tian"
"A.A. Aczel"
"S. Chi"
"J.-Q. Yan"
"Z.L. Dun"
"H.D. Zhou"
"M. Matsuda"



_atomic_positions_source_database_code_ICSD  190700
_atomic_positions_source_other               .

_transition_temperature  26
_experiment_temperature  4

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM1+  1  1  .  primary  5  .

_exptl_crystal_magnetic_properties_details
;
NPD
Positional structure from a measurement at 293K.
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (4 possible)
1-dim irrep as primary
Ferrimagnetic along b
;

_parent_space_group.name_H-M_alt  'C 2/c'
_parent_space_group.IT_number                       15
_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  15.85
_space_group_magn.name_BNS  "C 2/c"
_cell_length_a             7.2761
_cell_length_b             12.9361
_cell_length_c             14.0012
_cell_angle_alpha          90.00
_cell_angle_beta           90.21
_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+1/2,+1
3 -x,-y,-z,+1
4 x,-y,z+1/2,+1

loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1
2 x+1/2,y+1/2,z,+1

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba1 Ba 0.20490 0.47170 0.12600
Mn1 Mn 0.00000 0.73740 0.25000
Mn2 Mn 0.00000 0.26300 0.25000
Mn3 Mn 0.03130 0.26600 0.51940
Si1 Si 0.22920 0.12690 0.13010
Si2 Si 0.32270 0.40470 0.38210
O1 O 0.08770 0.22170 0.11050
O2 O 0.18860 0.38920 0.29710
O3 O 0.23400 0.13100 0.51270
O4 O 0.49080 0.32440 0.13810
O5 O 0.09650 0.02030 0.12500
O6 O 0.27670 0.14800 0.24490
O7 O 0.38180 0.10880 0.04780

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 0.00000 3.9 0.00000 0,my,0     3.9
Mn2 0.00000 3.9 0.00000 0,my,0     3.9
Mn3 0.00000 -3.9 0.00000 mx,my,mz  3.9

