# generated using pymatgen
data_Ti3Nb11P8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.66933152
_cell_length_b   7.66933151
_cell_length_c   13.83412836
_cell_angle_alpha   75.57825120
_cell_angle_beta   75.57825162
_cell_angle_gamma   26.01599610
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Nb11P8
_chemical_formula_sum   'Ti3 Nb11 P8'
_cell_volume   345.05165024
_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  0.00045659  0.00045659  0.99972394  1.0
  Ti  Ti1  1  0.49974646  0.49974646  0.50023035  1.0
  Ti  Ti2  1  0.82301258  0.82301258  0.54437454  1.0
  Nb  Nb3  1  0.43060053  0.43060053  0.17150262  1.0
  Nb  Nb4  1  0.56977289  0.56977289  0.82779625  1.0
  Nb  Nb5  1  0.19625054  0.19625054  0.68739853  1.0
  Nb  Nb6  1  0.80488874  0.80488874  0.31197869  1.0
  Nb  Nb7  1  0.20910198  0.20910198  0.20077701  1.0
  Nb  Nb8  1  0.79119270  0.79119270  0.79943361  1.0
  Nb  Nb9  1  0.33794813  0.33794813  0.97239138  1.0
  Nb  Nb10  1  0.66252032  0.66252032  0.02741834  1.0
  Nb  Nb11  1  0.00168778  0.00168778  0.33566506  1.0
  Nb  Nb12  1  0.99793575  0.99793575  0.66434227  1.0
  Nb  Nb13  1  0.17526218  0.17526218  0.45576097  1.0
  P  P14  1  0.17411548  0.17411548  0.88857576  1.0
  P  P15  1  0.82644275  0.82644275  0.11110813  1.0
  P  P16  1  0.37288242  0.37288242  0.40579246  1.0
  P  P17  1  0.62668113  0.62668113  0.59872804  1.0
  P  P18  1  0.37118568  0.37118568  0.66059101  1.0
  P  P19  1  0.62791484  0.62791484  0.33664916  1.0
  P  P20  1  0.06255969  0.06255969  0.14960194  1.0
  P  P21  1  0.93784083  0.93784083  0.85015796  1.0