KBa(FeAs)4

# generated using pymatgen
data_KBa(FeAs)4
_symmetry_space_group_name_H-M   Cmmm
_cell_length_a   5.48002400
_cell_length_b   13.16868200
_cell_length_c   5.47902700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   65
_chemical_formula_structural   KBa(FeAs)4
_chemical_formula_sum   'K2 Ba2 Fe8 As8'
_cell_volume   395.39230363
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, -z'
  3  '-x, -y, z'
  4  'x, y, -z'
  5  'x, -y, -z'
  6  '-x, y, z'
  7  '-x, y, -z'
  8  'x, -y, z'
  9  'x+1/2, y+1/2, z'
  10  '-x+1/2, -y+1/2, -z'
  11  '-x+1/2, -y+1/2, z'
  12  'x+1/2, y+1/2, -z'
  13  'x+1/2, -y+1/2, -z'
  14  '-x+1/2, y+1/2, z'
  15  '-x+1/2, y+1/2, -z'
  16  'x+1/2, -y+1/2, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  K  K0  2  0.00000000  0.00000000  0.00000000  1
  Ba  Ba1  2  0.00000000  0.50000000  0.50000000  1
  Fe  Fe2  8  0.25000000  0.25000000  0.24995800  1
  As  As3  4  0.00000000  0.15429300  0.50000000  1
  As  As4  4  0.00000000  0.34567800  0.00000000  1