# generated using pymatgen
data_Zr9TaRe3Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75682609
_cell_length_b   8.75680007
_cell_length_c   8.48656532
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99970710
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr9TaRe3Ni
_chemical_formula_sum   'Zr18 Ta2 Re6 Ni2'
_cell_volume   563.58059438
_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  0.19942077  0.80057899  0.44200265  1.0
  Zr  Zr1  1  0.19941910  0.39884350  0.44200596  1.0
  Zr  Zr2  1  0.60115648  0.80057855  0.44200688  1.0
  Zr  Zr3  1  0.80057923  0.19942101  0.55799735  1.0
  Zr  Zr4  1  0.80058090  0.60115650  0.55799404  1.0
  Zr  Zr5  1  0.39884352  0.19942145  0.55799312  1.0
  Zr  Zr6  1  0.80057923  0.19942101  0.94200265  1.0
  Zr  Zr7  1  0.80058090  0.60115650  0.94200596  1.0
  Zr  Zr8  1  0.39884352  0.19942145  0.94200688  1.0
  Zr  Zr9  1  0.19942077  0.80057899  0.05799735  1.0
  Zr  Zr10  1  0.19941910  0.39884350  0.05799404  1.0
  Zr  Zr11  1  0.60115648  0.80057855  0.05799312  1.0
  Zr  Zr12  1  0.54236652  0.45763019  0.25000000  1.0
  Zr  Zr13  1  0.54236971  0.08473929  0.25000000  1.0
  Zr  Zr14  1  0.91526204  0.45763098  0.25000000  1.0
  Zr  Zr15  1  0.45763348  0.54236981  0.75000000  1.0
  Zr  Zr16  1  0.45763029  0.91526071  0.75000000  1.0
  Zr  Zr17  1  0.08473796  0.54236902  0.75000000  1.0
  Ta  Ta18  1  0.00000000  0.00000000  0.50000000  1.0
  Ta  Ta19  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re20  1  0.88840642  0.11160236  0.25000000  1.0
  Re  Re21  1  0.88840720  0.77680348  0.25000000  1.0
  Re  Re22  1  0.22320344  0.11160232  0.25000000  1.0
  Re  Re23  1  0.11159358  0.88839764  0.75000000  1.0
  Re  Re24  1  0.11159280  0.22319652  0.75000000  1.0
  Re  Re25  1  0.77679656  0.88839768  0.75000000  1.0
  Ni  Ni26  1  0.33332778  0.66666557  0.25000000  1.0
  Ni  Ni27  1  0.66667222  0.33333443  0.75000000  1.0