# generated using pymatgen
data_Ti4SiGeH2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06659680
_cell_length_b   5.06659650
_cell_length_c   5.06659708
_cell_angle_alpha   104.96715206
_cell_angle_beta   104.96715861
_cell_angle_gamma   118.91223432
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4SiGeH2
_chemical_formula_sum   'Ti4 Si1 Ge1 H2'
_cell_volume   98.05295790
_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  0.16036950  0.66036950  0.82074101  1.0
  Ti  Ti1  1  0.83963050  0.33963050  0.17925899  1.0
  Ti  Ti2  1  0.33963050  0.16036950  0.50000000  1.0
  Ti  Ti3  1  0.66036950  0.83963050  0.50000000  1.0
  Si  Si4  1  0.75000000  0.75000000  0.00000000  1.0
  Ge  Ge5  1  0.25000000  0.25000000  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