data_NbMo2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78
_cell_length_b   4.45
_cell_length_c   5.25
_cell_angle_alpha   90.0
_cell_angle_beta   100.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbMo2Os
_chemical_formula_sum   'Nb1 Mo2 Os1'
_cell_volume   63.94
_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  0.95  0.0  0.6  1.0
  Mo  Mo0  1  0.73  0.0  0.03  1.0
  Mo  Mo1  1  0.86  0.23  0.26  1.0
  Os  Os3  1  0.01  0.23  0.86  1.0

data_NbMo2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   4.45
_cell_length_c   5.25
_cell_angle_alpha   90.0
_cell_angle_beta   100.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbMo2Os
_chemical_formula_sum   'Nb1 Mo2 Os1'
_cell_volume   63.94
_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  0.0  0.6  1.0
  Mo  Mo1  1  0.73  0.0  0.03  1.0
  Mo  Mo2  1  0.86  0.23  0.26  1.0
  Os  Os3  1  0.01  0.23  0.86  1.0

Nb Mo Mo Os