data_NiTeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66
_cell_length_b   3.76
_cell_length_c   5.33
_cell_angle_alpha   90.0
_cell_angle_beta   93.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiTeP2
_chemical_formula_sum   'Ni1 Te1 P2'
_cell_volume   73.38
_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
  Ni  Ni0  1  0.65  0.0  0.42  1.0
  Te  Te3  1  0.32  0.88  0.79  1.0
  P  P1  1  0.36  0.88  0.35  1.0
  P  P2  1  0.68  0.0  0.43  1.0

data_NiTeP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.66
_cell_length_b   3.76
_cell_length_c   5.33
_cell_angle_alpha   90.0
_cell_angle_beta   93.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiTeP2
_chemical_formula_sum   'Ni1 Te1 P2'
_cell_volume   73.38
_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
  Ni  Ni0  1  0.65  0.0  0.42  1.0
  Te  Te1  1  0.32  0.88  0.79  1.0
  P  P2  1  0.36  0.88  0.35  1.0
  P  P3  1  0.68  0.0  0.43  1.0

Ni Te P P
Ni Te P P 0 3 o o o 0 1 o - o 0 2 o - o 1 3 o + o 1 2 o o o 2 3 o + o 