# generated using pymatgen
data_TiCrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.00537070
_cell_length_b   3.00537070
_cell_length_c   5.03088348
_cell_angle_alpha   72.62092466
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCrN2
_chemical_formula_sum   'Ti1 Cr1 N2'
_cell_volume   36.93769231
_cell_formula_units_Z   1
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
  Ti  Ti0  1  0.50000000  0.00000000  0.50000000  1.0
  Cr  Cr1  1  0.00000000  0.00000000  0.00000000  1.0
  N  N2  1  0.25190900  0.50381900  0.24427200  1.0
  N  N3  1  0.74809100  0.49618100  0.75572800  1.0