# generated using pymatgen
data_Ti3NbP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43228306
_cell_length_b   6.48692439
_cell_length_c   8.02644800
_cell_angle_alpha   90.31935947
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3NbP2
_chemical_formula_sum   'Ti6 Nb2 P4'
_cell_volume   178.70577324
_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
  Ti  Ti0  1  0.75000000  0.96420513  0.67137822  1.0
  Ti  Ti1  1  0.25000000  0.03579487  0.32862178  1.0
  Ti  Ti2  1  0.25000000  0.63909621  0.56366349  1.0
  Ti  Ti3  1  0.75000000  0.36090379  0.43633651  1.0
  Ti  Ti4  1  0.75000000  0.85685013  0.06299916  1.0
  Ti  Ti5  1  0.25000000  0.14314987  0.93700084  1.0
  Nb  Nb6  1  0.25000000  0.53524099  0.17361725  1.0
  Nb  Nb7  1  0.75000000  0.46475901  0.82638275  1.0
  P  P8  1  0.25000000  0.76369388  0.85825844  1.0
  P  P9  1  0.75000000  0.23630612  0.14174156  1.0
  P  P10  1  0.75000000  0.74858877  0.36536236  1.0
  P  P11  1  0.25000000  0.25141123  0.63463764  1.0