# generated using pymatgen
data_TiCoP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.53326731
_cell_length_b   6.00600492
_cell_length_c   6.79058023
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCoP
_chemical_formula_sum   'Ti4 Co4 P4'
_cell_volume   144.10168651
_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
  Ti  Ti0  1  0.25000000  0.97667266  0.32119626  1.0
  Ti  Ti1  1  0.25000000  0.47667266  0.17880374  1.0
  Ti  Ti2  1  0.75000000  0.02332734  0.67880374  1.0
  Ti  Ti3  1  0.75000000  0.52332734  0.82119626  1.0
  Co  Co4  1  0.25000000  0.86118561  0.93725929  1.0
  Co  Co5  1  0.25000000  0.36118561  0.56274071  1.0
  Co  Co6  1  0.75000000  0.13881439  0.06274071  1.0
  Co  Co7  1  0.75000000  0.63881439  0.43725929  1.0
  P  P8  1  0.25000000  0.23197284  0.87936860  1.0
  P  P9  1  0.25000000  0.73197284  0.62063140  1.0
  P  P10  1  0.75000000  0.76802716  0.12063140  1.0
  P  P11  1  0.75000000  0.26802716  0.37936860  1.0