# generated using pymatgen
data_CrCo2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78662466
_cell_length_b   5.78662466
_cell_length_c   5.78662466
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCo2As
_chemical_formula_sum   'Cr4 Co8 As4'
_cell_volume   193.76527115
_cell_formula_units_Z   4
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  0.00000000  0.00000000  0.00000000  1
  Cr  Cr1  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr2  1  0.50000000  0.00000000  0.50000000  1
  Cr  Cr3  1  0.50000000  0.50000000  0.00000000  1
  Co  Co4  1  0.25000000  0.75000000  0.25000000  1
  Co  Co5  1  0.25000000  0.75000000  0.75000000  1
  Co  Co6  1  0.25000000  0.25000000  0.75000000  1
  Co  Co7  1  0.25000000  0.25000000  0.25000000  1
  Co  Co8  1  0.75000000  0.75000000  0.75000000  1
  Co  Co9  1  0.75000000  0.75000000  0.25000000  1
  Co  Co10  1  0.75000000  0.25000000  0.25000000  1
  Co  Co11  1  0.75000000  0.25000000  0.75000000  1
  As  As12  1  0.00000000  0.50000000  0.00000000  1
  As  As13  1  0.00000000  0.00000000  0.50000000  1
  As  As14  1  0.50000000  0.50000000  0.50000000  1
  As  As15  1  0.50000000  0.00000000  0.00000000  1
