# generated using pymatgen
data_Ta3Ti2MnRu6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.40084840
_cell_length_b   6.22053896
_cell_length_c   13.19416143
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00040476
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Ti2MnRu6
_chemical_formula_sum   'Ta6 Ti4 Mn2 Ru12'
_cell_volume   361.19873109
_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
  Ta  Ta0  1  0.99998626  0.50000000  0.99503288  1.0
  Ta  Ta1  1  0.49995754  0.00000000  0.16655686  1.0
  Ta  Ta2  1  0.99995167  0.50000000  0.33343797  1.0
  Ta  Ta3  1  0.49998611  0.00000000  0.50496903  1.0
  Ta  Ta4  1  0.00003044  0.50000000  0.67234890  1.0
  Ta  Ta5  1  0.50003629  0.00000000  0.82766215  1.0
  Ti  Ti6  1  0.00000199  0.00000000  0.99810742  1.0
  Ti  Ti7  1  0.49996858  0.50000000  0.16575755  1.0
  Ti  Ti8  1  0.99996840  0.00000000  0.33422148  1.0
  Ti  Ti9  1  0.50000160  0.50000000  0.50189433  1.0
  Mn  Mn10  1  0.00002809  0.00000000  0.66665983  1.0
  Mn  Mn11  1  0.50001789  0.50000000  0.83332992  1.0
  Ru  Ru12  1  0.49999620  0.24675113  0.00214809  1.0
  Ru  Ru13  1  0.49999620  0.75324887  0.00214809  1.0
  Ru  Ru14  1  0.99997272  0.25001423  0.16631560  1.0
  Ru  Ru15  1  0.99997272  0.74998677  0.16631560  1.0
  Ru  Ru16  1  0.49997523  0.24998704  0.33366539  1.0
  Ru  Ru17  1  0.49997523  0.75001296  0.33366539  1.0
  Ru  Ru18  1  0.99999816  0.25324899  0.49785338  1.0
  Ru  Ru19  1  0.99999816  0.74675101  0.49785338  1.0
  Ru  Ru20  1  0.50004471  0.25374990  0.66380214  1.0
  Ru  Ru21  1  0.50004471  0.74625010  0.66380214  1.0
  Ru  Ru22  1  0.00004555  0.24624749  0.83622772  1.0
  Ru  Ru23  1  0.00004555  0.75375351  0.83622772  1.0