# generated using pymatgen
data_BiTeN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07297500
_cell_length_b   4.07297500
_cell_length_c   9.92587800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiTeN
_chemical_formula_sum   'Bi2 Te2 N2'
_cell_volume   164.66163436
_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
  Bi  Bi0  1  0.50000000  0.00000000  0.11195100  1.0
  Bi  Bi1  1  0.00000000  0.50000000  0.88804900  1.0
  Te  Te2  1  0.50000000  0.00000000  0.54558600  1.0
  Te  Te3  1  0.00000000  0.50000000  0.45441400  1.0
  N  N4  1  0.50000000  0.50000000  0.00000000  1.0
  N  N5  1  0.00000000  0.00000000  0.00000000  1.0