# generated using pymatgen
data_TiCoP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03801462
_cell_length_b   3.54815848
_cell_length_c   6.84222383
_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   146.58665915
_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  0.97551300  0.32228600  1
  Ti  Ti1  1  0.25000000  0.47551300  0.17771400  1
  Ti  Ti2  1  0.75000000  0.02448700  0.67771400  1
  Ti  Ti3  1  0.75000000  0.52448700  0.82228600  1
  Co  Co4  1  0.25000000  0.85966700  0.93846400  1
  Co  Co5  1  0.25000000  0.35966700  0.56153600  1
  Co  Co6  1  0.75000000  0.14033300  0.06153600  1
  Co  Co7  1  0.75000000  0.64033300  0.43846400  1
  P  P8  1  0.25000000  0.23225100  0.87752500  1
  P  P9  1  0.25000000  0.73225100  0.62247500  1
  P  P10  1  0.75000000  0.76774900  0.12247500  1
  P  P11  1  0.75000000  0.26774900  0.37752500  1
