data_TaAlMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27
_cell_length_b   5.27
_cell_length_c   5.27
_cell_angle_alpha   143.87
_cell_angle_beta   130.15
_cell_angle_gamma   63.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAlMo2
_chemical_formula_sum   'Ta1 Al1 Mo2'
_cell_volume   65.12
_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  Ta3  1  0.63  0.0  0.38  1.0
  Al  Al0  1  0.0  0.0  0.79  1.0
  Mo  Mo1  1  0.63  0.0  0.11  1.0
  Mo  Mo2  1  0.0  0.0  0.19  1.0

data_TaAlMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   4.44
_cell_length_c   5.27
_cell_angle_alpha   114.93
_cell_angle_beta   108.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAlMo2
_chemical_formula_sum   'Ta1 Al1 Mo2'
_cell_volume   65.12
_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  0.0  0.38  0.74  1.0
  Al  Al1  1  0.0  0.79  0.79  1.0
  Mo  Mo2  1  0.0  0.11  0.48  1.0
  Mo  Mo3  1  0.0  0.19  0.19  1.0

Ta Al Mo Mo