# generated using pymatgen
data_TaCrP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.51409876
_cell_length_b   6.24843751
_cell_length_c   7.36148363
_cell_angle_alpha   89.99871438
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCrP
_chemical_formula_sum   'Ta4 Cr4 P4'
_cell_volume   161.64070806
_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  0.25000000  0.02979055  0.82821312  1.0
  Ta  Ta1  1  0.25000000  0.52977130  0.67185137  1.0
  Ta  Ta2  1  0.75000000  0.97020251  0.17178791  1.0
  Ta  Ta3  1  0.75000000  0.47024330  0.32814480  1.0
  Cr  Cr4  1  0.25000000  0.14357923  0.43880827  1.0
  Cr  Cr5  1  0.25000000  0.64355559  0.06118106  1.0
  Cr  Cr6  1  0.75000000  0.85640253  0.56118841  1.0
  Cr  Cr7  1  0.75000000  0.35644244  0.93882445  1.0
  P  P8  1  0.25000000  0.76950435  0.36842614  1.0
  P  P9  1  0.25000000  0.26953978  0.13152773  1.0
  P  P10  1  0.75000000  0.23050027  0.63157703  1.0
  P  P11  1  0.75000000  0.73046614  0.86846971  1.0