# generated using pymatgen
data_AlCr6Si5Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.17103324
_cell_length_b   5.89971197
_cell_length_c   12.51935852
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99976254
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCr6Si5Ru12
_chemical_formula_sum   'Al1 Cr6 Si5 Ru12'
_cell_volume   308.07505715
_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
  Al  Al0  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr1  1  0.00000000  0.50000100  0.00000000  1.0
  Cr  Cr2  1  0.50003609  0.00000000  0.16477074  1.0
  Cr  Cr3  1  0.99995455  0.50000100  0.33386911  1.0
  Cr  Cr4  1  0.50000000  0.00000000  0.50000000  1.0
  Cr  Cr5  1  0.00004645  0.50000100  0.66613089  1.0
  Cr  Cr6  1  0.49996291  0.00000000  0.83522926  1.0
  Si  Si7  1  0.50002806  0.50000100  0.16754092  1.0
  Si  Si8  1  0.99997549  0.00000000  0.33337329  1.0
  Si  Si9  1  0.50000000  0.50000100  0.50000000  1.0
  Si  Si10  1  0.00002551  0.00000000  0.66662671  1.0
  Si  Si11  1  0.49997294  0.50000100  0.83245908  1.0
  Ru  Ru12  1  0.50000000  0.25558174  0.00000000  1.0
  Ru  Ru13  1  0.50000000  0.74441826  0.00000000  1.0
  Ru  Ru14  1  0.00002039  0.25253130  0.16974089  1.0
  Ru  Ru15  1  0.00002039  0.74746870  0.16974089  1.0
  Ru  Ru16  1  0.49997681  0.24943633  0.33416559  1.0
  Ru  Ru17  1  0.49997681  0.75056367  0.33416559  1.0
  Ru  Ru18  1  0.00000000  0.24927648  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.75072352  0.50000000  1.0
  Ru  Ru20  1  0.50002419  0.24943633  0.66583441  1.0
  Ru  Ru21  1  0.50002419  0.75056367  0.66583441  1.0
  Ru  Ru22  1  0.99998061  0.25253130  0.83025911  1.0
  Ru  Ru23  1  0.99998061  0.74746870  0.83025911  1.0