data_NbSbMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28
_cell_length_b   5.28
_cell_length_c   5.28
_cell_angle_alpha   136.05
_cell_angle_beta   136.05
_cell_angle_gamma   63.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbSbMo2
_chemical_formula_sum   'Nb1 Sb1 Mo2'
_cell_volume   70.04
_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  Nb2  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.98  0.0  0.24  1.0
  Mo  Mo0  1  0.0  0.0  0.48  1.0
  Mo  Mo1  1  0.0  0.98  0.24  1.0

data_NbSbMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.95
_cell_length_b   3.95
_cell_length_c   5.28
_cell_angle_alpha   111.97
_cell_angle_beta   111.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbSbMo2
_chemical_formula_sum   'Nb1 Sb1 Mo2'
_cell_volume   70.04
_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  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.76  0.0  0.74  1.0
  Mo  Mo2  1  0.52  0.0  0.52  1.0
  Mo  Mo3  1  0.74  0.98  0.74  1.0

Nb Sb Mo Mo
Nb Sb Mo Mo 0 1 - o o 0 3 o - o 1 3 + - o 1 2 + o o 2 3 o - o 