# generated using pymatgen
data_Ti3C2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.04038129
_cell_length_b   3.04038027
_cell_length_c   7.44942012
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001116
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3C2N
_chemical_formula_sum   'Ti3 C2 N1'
_cell_volume   59.63606882
_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  0.00000000  0.00000000  0.50000000  1.0
  Ti  Ti1  1  0.33333300  0.66666700  0.16940511  1.0
  Ti  Ti2  1  0.66666700  0.33333300  0.83059489  1.0
  C  C3  1  0.33333300  0.66666700  0.67019100  1.0
  C  C4  1  0.66666700  0.33333300  0.32980900  1.0
  N  N5  1  0.00000000  0.00000000  0.00000000  1.0