# generated using pymatgen
data_TaNiAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.70268000
_cell_length_b   6.29053100
_cell_length_c   7.30167200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaNiAs
_chemical_formula_sum   'Ta4 Ni4 As4'
_cell_volume   170.06925419
_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
  Ta  Ta0  1  0.25000000  0.01935300  0.33854300  1.0
  Ta  Ta1  1  0.25000000  0.51935300  0.16145700  1.0
  Ta  Ta2  1  0.75000000  0.98064700  0.66145700  1.0
  Ta  Ta3  1  0.75000000  0.48064700  0.83854300  1.0
  Ni  Ni4  1  0.25000000  0.15730800  0.92756500  1.0
  Ni  Ni5  1  0.25000000  0.65730800  0.57243500  1.0
  Ni  Ni6  1  0.75000000  0.84269200  0.07243500  1.0
  Ni  Ni7  1  0.75000000  0.34269200  0.42756500  1.0
  As  As8  1  0.25000000  0.28610700  0.62380800  1.0
  As  As9  1  0.25000000  0.78610700  0.87619200  1.0
  As  As10  1  0.75000000  0.71389300  0.37619200  1.0
  As  As11  1  0.75000000  0.21389300  0.12380800  1.0