# generated using pymatgen
data_Ti2SiH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03584157
_cell_length_b   5.03584153
_cell_length_c   5.03584210
_cell_angle_alpha   104.65324712
_cell_angle_beta   104.65324644
_cell_angle_gamma   119.60797479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2SiH
_chemical_formula_sum   'Ti4 Si2 H2'
_cell_volume   95.96621342
_cell_formula_units_Z   2
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  0.16173682  0.66173682  0.82347564  1.0
  Ti  Ti1  1  0.83826318  0.33826318  0.17652436  1.0
  Ti  Ti2  1  0.33826318  0.16173682  0.50000000  1.0
  Ti  Ti3  1  0.66173682  0.83826318  0.50000000  1.0
  Si  Si4  1  0.25000000  0.25000000  0.00000000  1.0
  Si  Si5  1  0.75000000  0.75000000  0.00000000  1.0
  H  H6  1  0.75000000  0.25000000  0.50000000  1.0
  H  H7  1  0.25000000  0.75000000  0.50000000  1.0