#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 20/02/2021 

data_5yOhtAoR
_audit_creation_date            2021-02-20
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Journal of Alloys and Compounds"
_citation_journal_volume        844
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            156105
_citation_year                  2020
_citation_DOI                   10.1016/j.jallcom.2020.156105

loop_
_citation_author_name
"T. Mahon"
"E. Gaudin"
"V. Nassif"
"S. Tence"

_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
mM1-  1  1  .  primary  1  .

_exptl_crystal_magnetic_properties_details
;
NPD
;

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

_parent_space_group.name_H-M_alt  'I 4/m m m'
_parent_space_group.IT_number                       139
_parent_space_group.transform_Pp_abc  'a,b,c;0,0,0'

loop_
_parent_propagation_vector.id
_parent_propagation_vector.kxkykz
k1 [1 1 1]

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



_space_group_magn.number_BNS  126.386
_space_group_magn.name_BNS  "P_I 4/n n c"
_cell_length_a             4.37851(6)
_cell_length_b             4.37851
_cell_length_c             15.3765(5)
_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 -y,x,z,+1 
3 y,-x,z,+1 
4 x,-y,-z,+1 
5 -x,y,-z,+1 
6 -x,-y,z,+1 
7 y,x,-z,+1 
8 -y,-x,-z,+1 
9 -x+1/2,-y+1/2,-z+1/2,+1 
10 y+1/2,-x+1/2,-z+1/2,+1 
11 -y+1/2,x+1/2,-z+1/2,+1 
12 -x+1/2,y+1/2,z+1/2,+1 
13 x+1/2,-y+1/2,z+1/2,+1 
14 x+1/2,y+1/2,-z+1/2,+1 
15 -y+1/2,-x+1/2,z+1/2,+1 
16 y+1/2,x+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+1/2,z+1/2,-1 

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Nd1 Nd 0.00000 0.00000 0.330(2) 1.
Sc1 Sc 0.00000 0.50000 0.00000 0.92
Si1 Si 0.00000 0.00000 0.130(3) 1.
C1 C 0.00000 0.00000 0.50000 0.48
H1 H 0.00000 0.50000 0.25000 0.21

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
Nd1 0.00000 0.00000 2.73(2) 0,0,mz 2.73(2)

