# generated using pymatgen
data_Zr3(V2Fe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06430676
_cell_length_b   5.15137804
_cell_length_c   12.56207776
_cell_angle_alpha   89.20963949
_cell_angle_beta   88.63304788
_cell_angle_gamma   60.59942665
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3(V2Fe)2
_chemical_formula_sum   'Zr6 V8 Fe4'
_cell_volume   285.43179833
_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
  Zr  Zr0  1  0.66284900  0.66619400  0.70530000  1
  Zr  Zr1  1  0.99654400  0.00059400  0.37945900  1
  Zr  Zr2  1  0.33160900  0.33152100  0.04240600  1
  Zr  Zr3  1  0.66839100  0.66847900  0.95759400  1
  Zr  Zr4  1  0.00345600  0.99940600  0.62054100  1
  Zr  Zr5  1  0.33715100  0.33380600  0.29470000  1
  V  V6  1  0.83262200  0.33440500  0.16807100  1
  V  V7  1  0.16737800  0.66559500  0.83192900  1
  V  V8  1  0.66264700  0.67309900  0.33803400  1
  V  V9  1  0.00000000  0.00000000  0.00000000  1
  V  V10  1  0.33735300  0.32690100  0.66196600  1
  V  V11  1  -0.00000000  0.50000000  0.50000000  1
  V  V12  1  0.33447700  0.83183000  0.16734100  1
  V  V13  1  0.66552300  0.16817000  0.83265900  1
  Fe  Fe14  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe15  1  0.83411100  0.83279500  0.16773700  1
  Fe  Fe16  1  0.16588900  0.16720500  0.83226300  1
  Fe  Fe17  1  0.50000000  0.00000000  0.50000000  1
