# generated using pymatgen
data_UTiN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.20349335
_cell_length_b   5.60846411
_cell_length_c   10.82004144
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   UTiN2
_chemical_formula_sum   'U4 Ti4 N8'
_cell_volume   194.40019515
_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
  U  U0  1  0.75000000  0.07883466  0.85888946  1.0
  U  U1  1  0.75000000  0.57883466  0.64111054  1.0
  U  U2  1  0.25000000  0.92116534  0.14111054  1.0
  U  U3  1  0.25000000  0.42116534  0.35888946  1.0
  Ti  Ti4  1  0.25000000  0.07922952  0.60255833  1.0
  Ti  Ti5  1  0.75000000  0.42077048  0.10255833  1.0
  Ti  Ti6  1  0.25000000  0.57922952  0.89744167  1.0
  Ti  Ti7  1  0.75000000  0.92077048  0.39744167  1.0
  N  N8  1  0.25000000  0.33532773  0.74413840  1.0
  N  N9  1  0.75000000  0.16467227  0.24413840  1.0
  N  N10  1  0.25000000  0.25962784  0.00530373  1.0
  N  N11  1  0.75000000  0.66467227  0.25586160  1.0
  N  N12  1  0.25000000  0.83532773  0.75586160  1.0
  N  N13  1  0.75000000  0.74037216  0.99469627  1.0
  N  N14  1  0.75000000  0.24037216  0.50530373  1.0
  N  N15  1  0.25000000  0.75962784  0.49469627  1.0