data_TcBiMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   5.41
_cell_angle_alpha   143.78
_cell_angle_beta   131.72
_cell_angle_gamma   61.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcBiMo2
_chemical_formula_sum   'Tc1 Bi1 Mo2'
_cell_volume   69.11
_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
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.64  1.0
  Mo  Mo1  1  0.68  0.0  0.3  1.0
  Mo  Mo2  1  0.0  0.21  0.34  1.0

data_TcBiMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   4.43
_cell_length_c   5.41
_cell_angle_alpha   114.14
_cell_angle_beta   108.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcBiMo2
_chemical_formula_sum   'Tc1 Bi1 Mo2'
_cell_volume   69.11
_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
  Tc  Tc0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.36  0.36  0.36  1.0
  Mo  Mo2  1  0.38  0.7  0.38  1.0
  Mo  Mo3  1  0.66  0.87  0.87  1.0

Tc Bi Mo Mo