# generated using pymatgen
data_CrFeAs4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44679528
_cell_length_b   2.91643615
_cell_length_c   6.18073946
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.05301413
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFeAs4
_chemical_formula_sum   'Cr1 Fe1 As4'
_cell_volume   98.18242992
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, 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
  Cr  Cr0  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe1  1  0.00000000  0.00000000  0.00000000  1
  As  As2  1  0.16758300  0.00000000  0.64381000  1
  As  As3  1  0.83241700  0.00000000  0.35619000  1
  As  As4  1  0.31640000  0.50000000  0.12850300  1
  As  As5  1  0.68360000  0.50000000  0.87149700  1
