#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 11/11/2022

data_5yOhtAoR
_audit_creation_date            2022-11-11
_audit_creation_method          "Bilbao Crystallographic Server"

_chemical_name_systematic
;
;
_chemical_name_common                    ?
_chemical_formula_moiety                 ?
_chemical_formula_structural             ?
_chemical_formula_analytical             ?
_chemical_formula_iupac                  ?
_chemical_formula_sum                    "Na2 Ru1 O4"
_chemical_formula_weight                 ?
_chemical_melting_point                  ?
_chemical_compound_source                ?
_chemical_absolute_configuration         ?


_citation_journal_abbrev        "Eur. Phys. J. B"
_citation_journal_volume        52
_citation_page_first            371
_citation_page_last             376
_citation_article_id            .
_citation_year                  2006
_citation_DOI                   10.1140/epjb/e2006-00316-5

loop_
_citation_author_name
"K. M. Mogare"
"D. V. Sheptyakov"
"R. Bircher"
"H.-U. Gudel"
"M. Jansen"

_temperature_position_structure         .
_temperature_atom_positions             .
_temperature_non-magn_atom_positions    .
_temperature_cell_parameters            .

_atomic_positions_source_database_code_ICSD  157318
_atomic_positions_source_other               .

_transition_temperature     37.2
_experiment_temperature     1.5

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM1- 1 1 . primary 6 .

_exptl_crystal_magnetic_properties_details
;
NPD
;

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

_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 [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  14.78
_space_group_magn.name_BNS  "P 2_1/c'"
_space_group_magn.point_group_name  "2/m'"
_space_group_magn.point_group_number  "5.4.15"
_cell_length_a                 10.65120
_cell_length_b                 7.01140
_cell_length_c                 10.83000
_cell_angle_alpha              90.00
_cell_angle_beta               119.20
_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+1/2,-z+1/2,+1 
3 -x,-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 

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Ru1 Ru 0.50040 0.24170 0.25110 1
Ru2 Ru 0.99980 0.22940 0.24760 1
Na1 Na 0.30080 0.45730 0.41040 1
Na2 Na 0.35050 0.57170 0.91530 1
Na3 Na 0.18930 0.51030 0.08850 1
Na4 Na 0.15200 0.00030 0.09930 1
O1 O 0.16420 0.14220 0.38600 1
O2 O 0.48180 0.64320 0.39040 1
O3 O 0.32730 0.25020 0.23840 1
O4 O 0.00690 0.31930 0.10010 1
O5 O 0.16480 0.72340 0.24720 1
O6 O 0.34200 0.68210 0.59530 1
O7 O 0.46790 0.01080 0.65330 1
O8 O 0.04840 0.47730 0.35120 1

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
_atom_site_moment.spherical_azimuthal
_atom_site_moment.spherical_polar
Ru1 1.85(2) 0.0 0.56(7) mx,my,mz 1.65 ? ?
Ru2 1.85(2) 0.0 0.56(7) mx,my,mz 1.65 ? ?

