data_TaBiMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   2.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBiMo
_chemical_formula_sum   'Ta1 Bi1 Mo1'
_cell_volume   58.25
_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
  Ta  Ta2  1  0.0  0.75  0.89  1.0
  Bi  Bi0  1  0.38  0.37  0.17  1.0
  Mo  Mo1  1  0.0  0.0  0.91  1.0

data_TaBiMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.76
_cell_length_c   4.76
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBiMo
_chemical_formula_sum   'Ta1 Bi1 Mo1'
_cell_volume   58.25
_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
  Ta  Ta0  1  0.89  0.0  0.75  1.0
  Bi  Bi1  1  0.17  0.38  0.37  1.0
  Mo  Mo2  1  0.91  0.0  0.0  1.0

Ta Bi Mo
Ta Bi Mo 0 2 o + o 1 2 o o - 