# generated using pymatgen
data_Ti3TcMo4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13667087
_cell_length_b   3.13667087
_cell_length_c   12.60778093
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3TcMo4
_chemical_formula_sum   'Ti3 Tc1 Mo4'
_cell_volume   124.04422637
_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
  Ti  Ti0  1  0.49999900  0.49999900  0.11827509  1.0
  Ti  Ti1  1  0.00000000  0.00000000  0.50000000  1.0
  Ti  Ti2  1  0.49999900  0.49999900  0.88172591  1.0
  Tc  Tc3  1  0.00000000  0.00000000  0.00000000  1.0
  Mo  Mo4  1  0.00000000  0.00000000  0.25358826  1.0
  Mo  Mo5  1  0.49999900  0.49999900  0.36871794  1.0
  Mo  Mo6  1  0.49999900  0.49999900  0.63128206  1.0
  Mo  Mo7  1  0.00000000  0.00000000  0.74641174  1.0