#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 16/03/2018 21:41:31

data_5yOhtAoR
_audit_creation_date            2018-03-16
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Phys. Stat. Sol."
_citation_journal_volume        15
_citation_page_first            515
_citation_page_last             519
_citation_article_id            ?
_citation_year                  1966
_citation_DOI                   10.1002/pssb.19660150211

loop_
_citation_author_name
"R. Troc"
"J. Leciejewicz"
"R. Ciszewski"




_atomic_positions_source_database_code_ICSD  77853
_atomic_positions_source_other               .

_transition_temperature  203
_experiment_temperature  ?

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mZ3+  1  1  .  primary  1  .

_exptl_crystal_magnetic_properties_details
;
NPD
;

_active_magnetic_irreps_details
;
k-maximal magnetic symmetry (6 possible)
1-dim irrep active
;

_parent_space_group.name_H-M_alt  'P  4/n  m  m'
_parent_space_group.IT_number                       129
_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;1/4,1/4,0'
_space_group_magn.transform_BNS_Pp_abc  'a,b,c;-1/4,-1/4,0'


_space_group_magn.number_BNS  130.432
_space_group_magn.name_BNS  "P_c4/ncc"
_cell_length_a             3.81000
_cell_length_b             3.81000
_cell_length_c             15.52800
_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+1/2,-y+1/2,-z+1/2,+1
5 -x+1/2,y+1/2,-z+1/2,+1
6 -x,-y,z,+1
7 y+1/2,x+1/2,-z+1/2,+1
8 -y+1/2,-x+1/2,-z+1/2,+1
9 -x+1/2,-y+1/2,-z,+1
10 y+1/2,-x+1/2,-z,+1
11 -y+1/2,x+1/2,-z,+1
12 -x,y,z+1/2,+1
13 x,-y,z+1/2,+1
14 x+1/2,y+1/2,-z,+1
15 -y,-x,z+1/2,+1
16 y,x,z+1/2,+1


loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1
2 x,y,z+1/2,-1

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
U1 U 0.00000 0.00000 0.14000
P1 P 0.50000 0.00000 0.00000
P2 P 0.00000 0.00000 0.31750

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
U1 0.00000 0.00000 1.0(1) 0,0,mz


