#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 09/01/2019

data_5yOhtAoR
_audit_creation_date            2019-01-09
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "PHYSICAL REVIEW B"
_citation_journal_volume        96
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            224405
_citation_year                  2017
_citation_DOI                   10.1103/PhysRevB.96.224405

loop_
_citation_author_name
"E. Emmanouilidou"
"H. Cao"
"P. Tang"
"X. Gui"
"C. Hu"
"B. Shen"
"J. Wu"
"S.-C. Zhang"
"W. Xie"
"N. Ni"




_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  360
_experiment_temperature  150

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

_exptl_crystal_magnetic_properties_details
;
NSD
Positions structure from data at 300K
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry
1-dim irrep active
;

_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  62.443
_space_group_magn.name_BNS  "P n' m a"
_cell_length_a             6.5716
_cell_length_b             3.8605
_cell_length_c             7.3047
_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+1/2,z,+1
4 x+1/2,y,-z+1/2,+1
5 -x,y+1/2,-z,-1
6 -x+1/2,-y,z+1/2,-1
7 -x,-y,-z,-1
8 -x+1/2,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
_atom_site_occupancy
Mn1 Mn 0.46024  0.25000 0.67737  1.0
Cu1 Cu 0.37684  0.25000 0.05894  0.95
As1 As 0.25394 0.25000 0.37525   1.0

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
Mn1 0.0 4.0(1) 0.0 0,my,0
