#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 15/08/2020

data_5yOhtAoR
_audit_creation_date            2020-08-15
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Inorg. Chem."
_citation_journal_volume        52
_citation_page_first            395
_citation_page_last             401
_citation_article_id            ?
_citation_year                  2013
_citation_DOI                   10.1021/ic302191d

loop_
_citation_author_name
"P. Barpanda"
"M. Avdeev"
"C.D. Ling"
"J. Lu"
"A. Yamada"



_atomic_positions_source_database_code_ICSD  251081
_atomic_positions_source_other               .

_transition_temperature  6.5
_experiment_temperature  3

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM4  1  1  .  primary  6  .

_exptl_crystal_magnetic_properties_details
;
NPD
Moments of the two independent Co sites have not only constrained to have equal modulus, but also their components along x and z are apparently forced to be correlated.
;

_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 n a 2_1'
_parent_space_group.IT_number                       33
_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  33.146
_space_group_magn.name_BNS  "P n' a 2_1'"
_cell_length_a             15.37580
_cell_length_b             10.23930
_cell_length_c             7.68700
_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
3 -x,-y,z+1/2,-1
4 -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
Co1 Co 0.13200 0.50700 0.47600
Co2 Co 0.12620 0.01400 0.43500
P1 P 0.19020 0.07090 0.09200
P2 P 0.06110 0.05260 0.80380
P3 P 0.05420 0.46460 0.85120
P4 P 0.19560 0.47980 0.09630
Na1 Na 0.30100 0.27140 0.29700
Na2 Na 0.93840 0.23350 0.59800
Na3 Na 0.23050 0.28210 0.76300
Na4 Na 0.01080 0.24080 0.12400
O1 O 0.13930 0.10370 0.91910
O2 O 0.13500 0.12280 0.24240
O3 O 0.28260 0.11210 0.10000
O4 O 0.18370 0.92320 0.10950
O5 O 0.07310 0.90720 0.81400
O6 O 0.07570 0.12240 0.62860
O7 O 0.98710 0.10960 0.91270
O8 O 0.10680 0.42670 0.01670
O9 O 0.96670 0.39370 0.86410
O10 O 0.04330 0.60900 0.84300
O11 O 0.09290 0.40780 0.68780
O12 O 0.18920 0.42330 0.27820
O13 O 0.27170 0.41630 0.00340
O14 O 0.19410 0.62790 0.09200

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
Co1 1.09(7) 0.00000 -2.71(3) mx,my,mz
Co2 1.09 0.00000 2.71 mx,my,mz

