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


data_5yOhtAoR
_audit_creation_date            2018-03-24
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Journal of Magnetism and Magnetic Materials"
_citation_journal_volume        369
_citation_page_first            243
_citation_page_last             248
_citation_article_id            ?
_citation_year                  2014
_citation_DOI                   10.1016/j.jmmm.2014.06.052

loop_
_citation_author_name
"P. Schobinger-Papamantellos"
"J. Rodriguez-Carvajal"
"K. Buschow"


_atomic_positions_source_database_code_ICSD  192907
_atomic_positions_source_other               .

_transition_temperature  516
_experiment_temperature  149

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

_exptl_crystal_magnetic_properties_details
;
NPD
Below about 100K an additional incommensurate propagation vector (0,0,kz)is observed, and the phase is incommensurate.
;

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

_parent_space_group.name_H-M_alt  'P  6/m  m  m  '
_parent_space_group.IT_number                       191
_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;0,0,0'



_space_group_magn.number_BNS  192.252
_space_group_magn.name_BNS  "P_c6/mcc"
_cell_length_a             5.17270
_cell_length_b             5.17270
_cell_length_c             16.18880
_cell_angle_alpha          90.00
_cell_angle_beta           90.00
_cell_angle_gamma          120.00

loop_
_space_group_symop_magn_operation.id
_space_group_symop_magn_operation.xyz
1 x,y,z,+1
2 x-y,x,z,+1
3 -y,x-y,z,+1
4 -x,-y,z,+1
5 -x+y,-x,z,+1
6 y,-x+y,z,+1
7 x-y,-y,-z+1/2,+1
8 y,x,-z+1/2,+1
9 -x,-x+y,-z+1/2,+1
10 x,x-y,-z+1/2,+1
11 -x+y,y,-z+1/2,+1
12 -y,-x,-z+1/2,+1
13 -x,-y,-z,+1
14 -x+y,-x,-z,+1
15 y,-x+y,-z,+1
16 x,y,-z,+1
17 x-y,x,-z,+1
18 -y,x-y,-z,+1
19 -x+y,y,z+1/2,+1
20 -y,-x,z+1/2,+1
21 x,x-y,z+1/2,+1
22 -x,-x+y,z+1/2,+1
23 x-y,-y,z+1/2,+1
24 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
Sc1 Sc 0.00000 0.00000 0.00000
Mn1 Mn 0.50000 0.00000 0.12295
Ge1 Ge 0.33333 0.66667 0.25000
Ge2 Ge 0.33333 0.66667 0.00000
Ge3 Ge 0.00000 0.00000 0.16935

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
Mn1 0.00000 0.00000 2.08(4) 0,0,mz


