# generated using pymatgen
data_TiMnAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92398664
_cell_length_b   4.97308728
_cell_length_c   8.13530500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.32437668
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiMnAl
_chemical_formula_sum   'Ti4 Mn4 Al4'
_cell_volume   171.95648890
_cell_formula_units_Z   4
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
  Ti  Ti0  1  0.66868300  0.33430800  0.55337000  1.0
  Ti  Ti1  1  0.34327900  0.67165200  0.42503700  1.0
  Ti  Ti2  1  0.34327900  0.67165200  0.07496300  1.0
  Ti  Ti3  1  0.66868300  0.33430800  0.94663000  1.0
  Mn  Mn4  1  0.66566800  0.83278200  0.75000000  1.0
  Mn  Mn5  1  0.81651800  0.64040200  0.25000000  1.0
  Mn  Mn6  1  0.81662600  0.17615800  0.25000000  1.0
  Mn  Mn7  1  0.35010800  0.17513300  0.25000000  1.0
  Al  Al8  1  0.98640800  0.99322100  0.48992700  1.0
  Al  Al9  1  0.98640800  0.99322100  0.01007300  1.0
  Al  Al10  1  0.17718900  0.34470900  0.75000000  1.0
  Al  Al11  1  0.17715200  0.83245500  0.75000000  1.0