# generated using pymatgen
data_Zr3(V2Fe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08459507
_cell_length_b   5.10339043
_cell_length_c   12.70442451
_cell_angle_alpha   90.96930095
_cell_angle_beta   88.50325010
_cell_angle_gamma   118.97258887
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3(V2Fe)2
_chemical_formula_sum   'Zr6 V8 Fe4'
_cell_volume   288.30432867
_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  0.33352602  0.66269467  0.91776510  1.0
  Zr  Zr1  1  0.00293690  0.00400823  0.24816330  1.0
  Zr  Zr2  1  0.66759794  0.33354044  0.58262365  1.0
  Zr  Zr3  1  0.33240293  0.66645586  0.66733264  1.0
  Zr  Zr4  1  0.99706409  0.99598509  0.00186740  1.0
  Zr  Zr5  1  0.66647577  0.33730905  0.33226301  1.0
  V  V6  1  0.16849675  0.33532502  0.45737228  1.0
  V  V7  1  0.83150275  0.66467703  0.79262588  1.0
  V  V8  1  0.33550501  0.67211447  0.29077481  1.0
  V  V9  1  -0.00000656  -0.00000408  0.62499202  1.0
  V  V10  1  0.66450100  0.32789348  0.95924761  1.0
  V  V11  1  0.00000237  0.50000100  0.12501589  1.0
  V  V12  1  0.66795794  0.83582170  0.45752343  1.0
  V  V13  1  0.33204115  0.16417553  0.79247869  1.0
  Fe  Fe14  1  0.50000186  0.49999177  0.12494708  1.0
  Fe  Fe15  1  0.16737357  0.83507177  0.45761902  1.0
  Fe  Fe16  1  0.83261599  0.16493744  0.79243832  1.0
  Fe  Fe17  1  0.50000653  0.00000053  0.12494688  1.0