# generated using pymatgen
data_Ti3Si4Mo9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91997584
_cell_length_b   4.89810302
_cell_length_c   9.72469444
_cell_angle_alpha   89.96861840
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Si4Mo9
_chemical_formula_sum   'Ti3 Si4 Mo9'
_cell_volume   234.35098560
_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  0.00000000  0.49970674  0.37684216  1.0
  Ti  Ti1  1  0.00000000  0.50337079  0.87405627  1.0
  Ti  Ti2  1  0.50000000  0.25169332  0.00122861  1.0
  Si  Si3  1  0.50000000  0.49753212  0.25022524  1.0
  Si  Si4  1  0.50000000  0.49760862  0.75375301  1.0
  Si  Si5  1  0.00000000  0.00335027  0.99768676  1.0
  Si  Si6  1  0.00000000  0.00064649  0.49728036  1.0
  Mo  Mo7  1  0.50000000  0.24861489  0.50087291  1.0
  Mo  Mo8  1  0.74954987  0.99895189  0.25000478  1.0
  Mo  Mo9  1  0.74960060  0.99856745  0.74764500  1.0
  Mo  Mo10  1  0.00000000  0.50101441  0.12705375  1.0
  Mo  Mo11  1  0.00000000  0.49815405  0.62467049  1.0
  Mo  Mo12  1  0.50000000  0.75342737  0.00019231  1.0
  Mo  Mo13  1  0.50000000  0.74984126  0.50083656  1.0
  Mo  Mo14  1  0.25045013  0.99895189  0.25000478  1.0
  Mo  Mo15  1  0.25039940  0.99856745  0.74764500  1.0