# generated using pymatgen
data_Ta3Ti9(CrP4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37771710
_cell_length_b   7.37771589
_cell_length_c   13.48785561
_cell_angle_alpha   76.57758189
_cell_angle_beta   76.57758338
_cell_angle_gamma   26.36800306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Ti9(CrP4)2
_chemical_formula_sum   'Ta3 Ti9 Cr2 P8'
_cell_volume   316.66080316
_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
  Ta  Ta0  1  0.50000000  0.50000000  0.50000000  1.0
  Ta  Ta1  1  0.42438268  0.42438268  0.17910346  1.0
  Ta  Ta2  1  0.57561732  0.57561732  0.82089654  1.0
  Ti  Ti3  1  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti4  1  0.20945526  0.20945526  0.21125367  1.0
  Ti  Ti5  1  0.79054474  0.79054474  0.78874633  1.0
  Ti  Ti6  1  0.33882048  0.33882048  0.97001311  1.0
  Ti  Ti7  1  0.66117952  0.66117952  0.02998689  1.0
  Ti  Ti8  1  0.00350731  0.00350731  0.33531059  1.0
  Ti  Ti9  1  0.99649269  0.99649269  0.66468941  1.0
  Ti  Ti10  1  0.17927575  0.17927575  0.46275203  1.0
  Ti  Ti11  1  0.82072425  0.82072425  0.53724797  1.0
  Cr  Cr12  1  0.19823626  0.19823626  0.68917835  1.0
  Cr  Cr13  1  0.80176374  0.80176374  0.31082165  1.0
  P  P14  1  0.17995035  0.17995035  0.88940703  1.0
  P  P15  1  0.82004965  0.82004965  0.11059297  1.0
  P  P16  1  0.37003650  0.37003650  0.39024652  1.0
  P  P17  1  0.62996350  0.62996350  0.60975348  1.0
  P  P18  1  0.36547103  0.36547103  0.65794378  1.0
  P  P19  1  0.63452897  0.63452897  0.34205622  1.0
  P  P20  1  0.06360746  0.06360746  0.15156932  1.0
  P  P21  1  0.93639254  0.93639254  0.84843068  1.0