data_NbTe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.82
_cell_length_b   6.87
_cell_length_c   8.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTe2P
_chemical_formula_sum   'Nb4 Te8 P4'
_cell_volume   399.29
_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
  Nb  Nb0  1  0.54  0.57  0.2  1.0
  Nb  Nb1  1  0.28  0.3  0.2  1.0
  Nb  Nb2  1  0.13  0.3  0.2  1.0
  Nb  Nb3  1  0.7  0.57  0.2  1.0
  Te  Te8  1  0.41  0.43  0.84  1.0
  Te  Te9  1  0.0  0.43  0.84  1.0
  Te  Te10  1  0.71  0.85  0.63  1.0
  Te  Te11  1  0.12  0.02  0.63  1.0
  Te  Te12  1  0.41  0.0  0.59  1.0
  Te  Te13  1  0.0  0.0  0.59  1.0
  Te  Te14  1  0.71  0.83  0.47  1.0
  Te  Te15  1  0.12  0.04  0.47  1.0
  P  P4  1  0.71  0.31  0.23  1.0
  P  P5  1  0.12  0.55  0.23  1.0
  P  P6  1  0.71  0.14  0.47  1.0
  P  P7  1  0.12  0.73  0.47  1.0

data_NbTe2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.82
_cell_length_b   6.87
_cell_length_c   8.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTe2P
_chemical_formula_sum   'Nb4 Te8 P4'
_cell_volume   399.29
_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
  Nb  Nb0  1  0.13  0.3  0.2  1.0
  Nb  Nb1  1  0.28  0.3  0.2  1.0
  Nb  Nb2  1  0.54  0.57  0.2  1.0
  Nb  Nb3  1  0.7  0.57  0.2  1.0
  Te  Te4  1  0.0  0.0  0.59  1.0
  Te  Te5  1  0.0  0.43  0.84  1.0
  Te  Te6  1  0.12  0.02  0.63  1.0
  Te  Te7  1  0.12  0.04  0.47  1.0
  Te  Te8  1  0.41  0.0  0.59  1.0
  Te  Te9  1  0.41  0.43  0.84  1.0
  Te  Te10  1  0.71  0.83  0.47  1.0
  Te  Te11  1  0.71  0.85  0.63  1.0
  P  P12  1  0.12  0.55  0.23  1.0
  P  P13  1  0.12  0.73  0.47  1.0
  P  P14  1  0.71  0.14  0.47  1.0
  P  P15  1  0.71  0.31  0.23  1.0

Nb Nb Nb Nb Te Te Te Te Te Te Te Te P P P P