data_NbRe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   6.26
_cell_length_c   6.26
_cell_angle_alpha   29.26
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbRe2P
_chemical_formula_sum   'Nb1 Re2 P1'
_cell_volume   61.36
_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
  Nb  Nb0  1  0.6  0.0  0.05  1.0
  Re  Re2  1  0.6  0.0  0.88  1.0
  Re  Re3  1  0.0  0.0  0.3  1.0
  P  P1  1  0.0  0.0  0.1  1.0

data_NbRe2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.16
_cell_length_b   3.2
_cell_length_c   6.26
_cell_angle_alpha   90.0
_cell_angle_beta   104.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbRe2P
_chemical_formula_sum   'Nb1 Re2 P1'
_cell_volume   61.36
_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
  Nb  Nb0  1  0.95  0.6  0.95  1.0
  Re  Re1  1  0.12  0.6  0.12  1.0
  Re  Re2  1  0.7  0.0  0.7  1.0
  P  P3  1  0.9  0.0  0.9  1.0

Nb Re Re P
Nb Re Re P 0 1 o o - 0 3 + o o 2 3 o o o 