data_CoTe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.3
_cell_length_b   3.3
_cell_length_c   7.0
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTe2P
_chemical_formula_sum   'Co1 Te2 P1'
_cell_volume   76.28
_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
  Co  Co0  1  0.0  0.0  0.5  1.0
  Te  Te2  1  0.65  0.65  0.93  1.0
  Te  Te3  1  0.65  0.65  0.07  1.0
  P  P1  1  0.0  0.0  0.0  1.0

data_CoTe2P
_symmetry_space_group_name_H-M   Amm2
_cell_length_a   7.0
_cell_length_b   4.67
_cell_length_c   4.67
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   38
_chemical_formula_structural   CoTe2P
_chemical_formula_sum   'Co2 Te4 P2'
_cell_volume   152.56
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  'x, -y, z'
  5  'x, y+1/2, z+1/2'
  6  '-x, -y+1/2, z+1/2'
  7  '-x, y+1/2, z+1/2'
  8  'x, -y+1/2, z+1/2'
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
  Co  Co0  2  0.5  0.0  0.0  1.0
  Te  Te1  4  0.07  0.0  0.65  1.0
  P  P2  2  0.0  0.0  0.0  1.0

Co Te Te P
CoPTe2 crystallizes in the monoclinic Cm space group. Co(1) is bonded to four equivalent Co(1), one Te(1), and one Te(2) atom to form a mixture of distorted corner and edge-sharing CoCo4Te2 octahedra. The corner-sharing octahedra are not tilted. All Co(1)-Co(1) bond lengths are 3.30 Å. The Co(1)-Te(1) bond length is 3.42 Å. The Co(1)-Te(2) bond length is 3.42 Å. P(1) is bonded in a 2-coordinate geometry to one Te(1) and one Te(2) atom. The P(1)-Te(1) bond length is 1.70 Å. The P(1)-Te(2) bond length is 1.71 Å. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a 1-coordinate geometry to one Co(1), one P(1), and one Te(2) atom. The Te(1)-Te(2) bond length is 0.99 Å. In the second Te site, Te(2) is bonded in a distorted single-bond geometry to one Co(1), one P(1), and one Te(1) atom.