# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 14/01/2013 12:02:35

# icsd_240280.cif -- non-magnetic

data_f6neDXmf
_audit_creation_date               2013-01-14
_audit_creation_method             "Bilbao Crystallographic Server"
_symmetry_Int_Tables_number        164
#_symmetry_space_group_name_H-M    "P-3m11'"
_cell_length_a                     5.7550
_cell_length_b                     5.7550
_cell_length_c                     7.0656
_cell_angle_alpha                  90.0000
_cell_angle_beta                   90.0000
_cell_angle_gamma                  120.0000

loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
   1   x-y,-y,-z
   2   -x,-x+y,-z
   3   y,x,-z
   4   x-y,x,-z
   5   y,-x+y,-z
   6   -x,-y,-z
   7   -x+y,y,z
   8   x,x-y,z
   9   -y,-x,z
  10   -x+y,-x,z
  11   -y,x-y,z
  12   x,y,z

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Ba1 Ba 0.33333 0.66667 0.66380 1.0000
Ba2 Ba 0.00000 0.00000 0.00000 1.0000
Ni1 Ni 0.00000 0.00000 0.50000 1.0000
Nb2 Nb 0.33333 0.66667 0.17700 1.0000
O1 O 0.50000 0.00000 0.00000 1.0000
O2 O 0.16978 0.33960 0.32623 1.0000
