# generated using pymatgen
data_Ti3Si(BMo)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11345523
_cell_length_b   7.09234509
_cell_length_c   7.09177334
_cell_angle_alpha   129.53864499
_cell_angle_beta   129.69480557
_cell_angle_gamma   73.95084135
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Si(BMo)2
_chemical_formula_sum   'Ti6 Si2 B4 Mo4'
_cell_volume   207.14376249
_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  0.80768083  0.96300178  0.50072940  1.0
  Ti  Ti1  1  0.30757814  0.80692554  0.84469542  1.0
  Ti  Ti2  1  0.19333418  0.03904797  0.50037123  1.0
  Ti  Ti3  1  0.53680893  0.69140293  0.50043359  1.0
  Ti  Ti4  1  0.03690713  0.53633682  0.84539507  1.0
  Ti  Ti5  1  0.69345187  0.19303698  0.15439223  1.0
  Si  Si6  1  0.74987151  0.74756486  0.99838424  1.0
  Si  Si7  1  0.24987854  0.25145938  0.00232240  1.0
  B  B8  1  0.38931320  0.89046058  0.27879797  1.0
  B  B9  1  0.88927154  0.61054191  0.49886441  1.0
  B  B10  1  0.61214293  0.11218928  0.72360781  1.0
  B  B11  1  0.11222011  0.38852253  0.49993472  1.0
  Mo  Mo12  1  0.00173301  0.00067964  0.99999149  1.0
  Mo  Mo13  1  0.95905762  0.45919615  0.15120948  1.0
  Mo  Mo14  1  0.50172689  0.50166846  0.00097481  1.0
  Mo  Mo15  1  0.45902359  0.30796520  0.49989474  1.0