#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 18/12/2019 02:14:57
# paper_6K.cif

data_5yOhtAoR
_audit_creation_date            2019-12-18
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Physical Review B"
_citation_journal_volume        100
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            220406(R)
_citation_year                  2019
_citation_DOI                   10.1103/PhysRevB.100.220406

loop_
_citation_author_name
"N. Matsubara"
"S. Petit"
"C. Martin"
"F. Fauth"
"E. Suard"
"S. Rols"
"F. Damay"



_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  10
_experiment_temperature  1.5

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mY2-  1  1  .  primary  3  .

_exptl_crystal_magnetic_properties_details
;
NPD
Positional structure from a synchrotron powder measurement at 6K
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (4 possible)
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 [1/2 0 0]

_parent_space_group.child_transform_Pp_abc  '2a,b,c;0,0,0'
_space_group_magn.transform_BNS_Pp_abc  'a,b,c;1/4,0,0'



_space_group_magn.number_BNS  14.80
_space_group_magn.name_BNS  "P_a 2_1/c"
_cell_length_a             10.3322
_cell_length_b             9.0579
_cell_length_c             9.9033
_cell_angle_alpha          90.00
_cell_angle_beta           90.18
_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+1/2,-y,-z,+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
2 x+1/2,y,z,-1

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Bi1 Bi 0.12905 0.76080 0.99890
Mn1 Mn 0.38745 0.91490 0.74350
Te1 Te 0.12915 0.08380 0.73520
O1 O 0.31140 0.74740 0.65720
O2 O 0.45015 0.42150 0.86110
O3 O 0.45020 0.73450 0.87270
O4 O 0.23060 0.94690 0.85110
O5 O 0.47830 0.05470 0.84380
O6 O 0.22000 0.57810 0.87700

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 1.7(1) -1.6(1) 2.8(1) mx,my,mz

