# generated using pymatgen
data_CrCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99459183
_cell_length_b   4.99459183
_cell_length_c   3.98008825
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCo3
_chemical_formula_sum   'Cr2 Co6'
_cell_volume   85.98512724
_cell_formula_units_Z   2
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  0.33333300  0.66666700  0.25000000  1
  Cr  Cr1  1  0.66666700  0.33333300  0.75000000  1
  Co  Co2  1  0.83429200  0.16570800  0.25000000  1
  Co  Co3  1  0.83429200  0.66858400  0.25000000  1
  Co  Co4  1  0.33141600  0.16570800  0.25000000  1
  Co  Co5  1  0.16570800  0.83429200  0.75000000  1
  Co  Co6  1  0.16570800  0.33141600  0.75000000  1
  Co  Co7  1  0.66858400  0.83429200  0.75000000  1
