#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 15/04/2021

data_5yOhtAoR
_audit_creation_date            2021-04-15
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Journal of Alloys and Compounds"
_citation_journal_volume        857
_citation_page_first            .
_citation_page_last             ,
_citation_article_id            158230
_citation_year                  2021
_citation_DOI                   10.1016/j.jallcom.2020.158230

loop_
_citation_author_name
"A. Donni"
"V. Y. Pomjakushin"
"L. Zhanga"
"K. Yamaura"
"A. A. Belik"

_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_temperature_position_structure         130
_temperature_atom_positions             .              
_temperature_non-magn_atom_positions    .
_temperature_cell_parameters            .

_transition_temperature  76
_experiment_temperature  40

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM3+ 1  1  .  primary  7  .

_exptl_crystal_magnetic_properties_details
;
NPD
Position structure from a determination at 130K
The moment at the mixed Ho/Mn site is an average moment of the site. This moment is assigned here to the two atoms, which are listed separately. 
FiM along a
Below 40K canting along c of the H atoms is observed  (see entry #0.649).
;

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

_parent_space_group.name_H-M_alt  'P n m a'
_parent_space_group.IT_number                       62
_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  62.447
_space_group_magn.name_BNS  "P n m' a'"
_cell_length_a             5.63290
_cell_length_b             7.39080
_cell_length_c             5.24610
_cell_angle_alpha          90.00
_cell_angle_beta           90.00
_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+1/2,-y+1/2,-z+1/2,+1 
3 -x,-y,-z,+1 
4 -x+1/2,y+1/2,z+1/2,+1 
5 -x,y+1/2,-z,-1 
6 -x+1/2,-y,z+1/2,-1 
7 x,-y+1/2,z,-1 
8 x+1/2,y,-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
_atom_site_occupancy
Ho1 Ho 0.07830 0.25000 0.98340 0.832
Mn1 Mn 0.07830 0.25000 0.98340 0.168
Mn2 Mn 0.00000 0.00000 0.50000 1.
O1 O 0.46190 0.25000 0.10590 1.
O2 O 0.31830 0.05340 0.69830 1.

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
Ho1 -2.02(2) 0.00000 0.00000 mx,0,mz   2.02(2)
Mn1 -2.02(2) 0.00000 0.00000 mx,0,mz   2.02(2)
Mn2 2.20(2) 0.00000 0.00000 mx,my,mz   2.20(2)

