# CIF file
# This file was generated by FINDSYM
# Harold T. Stokes, Branton J. Campbell, Dorian M. Hatch
# Brigham Young University, Provo, Utah, USA
 
data_findsym-output
 
_symmetry_space_group_name_H-M 'P -4 m 2'
_symmetry_Int_Tables_number 115
 
_cell_length_a       3.96800
_cell_length_b       3.96800
_cell_length_c       8.27700
_cell_angle_alpha   90.00000
_cell_angle_beta    90.00000
_cell_angle_gamma   90.00000
 
loop_
_space_group_symop_operation_xyz
x,y,z
-x,-y,z
-y,-x,-z
y,x,-z
-x,y,z
x,-y,z
y,-x,-z
-y,x,-z
 
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
La1 La   0.00000   0.50000   0.33125   1.00000
Fe1 Fe   0.00000   0.00000   0.00000   1.00000
Fe2 Fe   0.50000   0.50000   0.00000   1.00000
As1 As   0.00000   0.50000  -0.14306   1.00000
O1  O    0.00000   0.00000   0.50000   1.00000
F1  F    0.50000   0.50000   0.50000   1.00000
 
# end_of_file
