# generated using pymatgen
data_Ta5TiP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.12743430
_cell_length_b   10.12743430
_cell_length_c   5.02748062
_cell_angle_alpha   90.02813180
_cell_angle_beta   90.02813180
_cell_angle_gamma   90.00262692
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5TiP2
_chemical_formula_sum   'Ta20 Ti4 P8'
_cell_volume   515.64305049
_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
  Ta  Ta0  1  0.90629314  0.59370686  0.50000000  1.0
  Ta  Ta1  1  0.90546313  0.40823547  0.99798451  1.0
  Ta  Ta2  1  0.59453687  0.09176453  0.50201549  1.0
  Ta  Ta3  1  0.79796100  0.30252477  0.49933840  1.0
  Ta  Ta4  1  0.09288650  0.40711350  0.50000000  1.0
  Ta  Ta5  1  0.09176453  0.59453687  0.00201549  1.0
  Ta  Ta6  1  0.19935199  0.30064801  0.00000000  1.0
  Ta  Ta7  1  0.30252477  0.79796100  0.99933840  1.0
  Ta  Ta8  1  0.30064801  0.19935199  0.50000000  1.0
  Ta  Ta9  1  0.70203900  0.19747523  0.00066160  1.0
  Ta  Ta10  1  0.59370686  0.90629314  0.00000000  1.0
  Ta  Ta11  1  0.35428998  0.49994933  0.74827460  1.0
  Ta  Ta12  1  0.70025099  0.79974901  0.50000000  1.0
  Ta  Ta13  1  0.00005067  0.14571002  0.25172540  1.0
  Ta  Ta14  1  0.19747523  0.70203900  0.50066160  1.0
  Ta  Ta15  1  0.40711350  0.09288650  0.00000000  1.0
  Ta  Ta16  1  0.49994933  0.35428998  0.24827460  1.0
  Ta  Ta17  1  0.40823547  0.90546313  0.49798451  1.0
  Ta  Ta18  1  0.79974901  0.70025099  0.00000000  1.0
  Ta  Ta19  1  0.14571002  0.00005067  0.75172540  1.0
  Ti  Ti20  1  0.49947443  0.64574380  0.25107876  1.0
  Ti  Ti21  1  0.85425620  0.00052557  0.74892124  1.0
  Ti  Ti22  1  0.64574380  0.49947443  0.75107876  1.0
  Ti  Ti23  1  0.00052557  0.85425620  0.24892124  1.0
  P  P24  1  0.99662463  0.79596814  0.74922371  1.0
  P  P25  1  0.50321353  0.29424249  0.74930746  1.0
  P  P26  1  0.20575751  0.99678647  0.25069254  1.0
  P  P27  1  0.79596814  0.99662463  0.24922371  1.0
  P  P28  1  0.99678647  0.20575751  0.75069254  1.0
  P  P29  1  0.70403186  0.50337537  0.25077629  1.0
  P  P30  1  0.29424249  0.50321353  0.24930746  1.0
  P  P31  1  0.50337537  0.70403186  0.75077629  1.0