#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 20/10/2020

data_5yOhtAoR
_audit_creation_date            2020-10-20
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "PHYSICAL REVIEW B"
_citation_journal_volume        102
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            024408
_citation_year                  2020
_citation_DOI                   10.1103/PhysRevB.102.024408

loop_
_citation_author_name
"S. Calder"
"A.V. Haglund"
"Y. Liu"
"D.M. Pajerowski"
"H.B. Cao"
"T.J. Williams"
"V.O. Garlea"
"D. Mandrus"



_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  40
_experiment_temperature  4

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mA2  1  1  .  primary 4  .

_exptl_crystal_magnetic_properties_details
;
NPD
Moment components only approximate. They have been estimated from a figure of the original reference.
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (2 possible)
1-dim irrep as primary
;

_parent_space_group.name_H-M_alt  'C 2'
_parent_space_group.IT_number                       5
_parent_space_group.transform_Pp_abc  'a,b,c;0,0,0'

loop_
_parent_propagation_vector.id
_parent_propagation_vector.kxkykz
k1 [0 0 1/2]

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



_space_group_magn.number_BNS  5.16
_space_group_magn.name_BNS  "C_c 2"
_cell_length_a             10.8510
_cell_length_b             7.2560
_cell_length_c             12.2116
_cell_angle_alpha          90.00
_cell_angle_beta           92.036
_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

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
3 x,y,z+1/2,-1
4 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
Cr1 Cr 0.00000 0.03750 0.00000
Cr2 Cr 0.00000 0.54270 0.00000
P1 P 0.2946 0.2738 0.08205
S1 S 0.1430 0.0000 0.34680
S2 S 0.1279 0.5304 0.35125
S3 S 0.1042 0.2845 0.09775
S4 S 0.1271 0.7612 0.07680

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
Cr1 0.6 0.0 2.8 mx,0,mz
Cr2 0.6 0.0 2.8 mx,0,mz

