# generated using pymatgen
data_ZrAlCr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14782924
_cell_length_b   5.14863872
_cell_length_c   8.60391600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.34999798
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAlCr
_chemical_formula_sum   'Zr4 Al4 Cr4'
_cell_volume   198.18201573
_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
  Zr  Zr0  1  0.33487100  0.33472400  0.55951600  1.0
  Zr  Zr1  1  0.66980500  0.66981900  0.42864800  1.0
  Zr  Zr2  1  0.66980500  0.66981900  0.07135200  1.0
  Zr  Zr3  1  0.33487100  0.33472400  0.94048400  1.0
  Al  Al4  1  0.99459800  0.99489400  0.49000700  1.0
  Al  Al5  1  0.99459800  0.99489400  0.00999300  1.0
  Al  Al6  1  0.83362700  0.34160700  0.75000000  1.0
  Al  Al7  1  0.34159900  0.83362500  0.75000000  1.0
  Cr  Cr8  1  0.83320700  0.83332900  0.75000000  1.0
  Cr  Cr9  1  0.17753100  0.63977600  0.25000000  1.0
  Cr  Cr10  1  0.63985800  0.17736900  0.25000000  1.0
  Cr  Cr11  1  0.17563000  0.17542000  0.25000000  1.0