# generated using pymatgen
data_Sc4ReTcB12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.51114246
_cell_length_b   8.90436517
_cell_length_c   11.18190458
_cell_angle_alpha   90.05787266
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4ReTcB12
_chemical_formula_sum   'Sc8 Re2 Tc2 B24'
_cell_volume   349.59641810
_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
  Sc  Sc0  1  0.00000000  0.32258893  0.41380434  1.0
  Sc  Sc1  1  0.00000000  0.67741107  0.58619566  1.0
  Sc  Sc2  1  0.00000000  0.82172721  0.08645264  1.0
  Sc  Sc3  1  0.00000000  0.17827279  0.91354736  1.0
  Sc  Sc4  1  0.00000000  0.94275823  0.37036109  1.0
  Sc  Sc5  1  0.00000000  0.05724177  0.62963891  1.0
  Sc  Sc6  1  0.00000000  0.44406714  0.13009992  1.0
  Sc  Sc7  1  0.00000000  0.55593286  0.86990008  1.0
  Re  Re8  1  0.00000000  0.13977937  0.18018535  1.0
  Re  Re9  1  0.00000000  0.86022063  0.81981465  1.0
  Tc  Tc10  1  0.00000000  0.63986638  0.32010421  1.0
  Tc  Tc11  1  0.00000000  0.36013362  0.67989579  1.0
  B  B12  1  0.50000000  0.55332664  0.43474573  1.0
  B  B13  1  0.50000000  0.44667336  0.56525427  1.0
  B  B14  1  0.50000000  0.05309615  0.06523677  1.0
  B  B15  1  0.50000000  0.94690385  0.93476323  1.0
  B  B16  1  0.50000000  0.75287809  0.42122198  1.0
  B  B17  1  0.50000000  0.24712191  0.57877802  1.0
  B  B18  1  0.50000000  0.25344246  0.07867418  1.0
  B  B19  1  0.50000000  0.74655754  0.92132582  1.0
  B  B20  1  0.50000000  0.79475633  0.26376217  1.0
  B  B21  1  0.50000000  0.20524367  0.73623783  1.0
  B  B22  1  0.50000000  0.29544551  0.23662180  1.0
  B  B23  1  0.50000000  0.70455449  0.76337820  1.0
  B  B24  1  0.50000000  0.63014756  0.18256133  1.0
  B  B25  1  0.50000000  0.36985244  0.81743867  1.0
  B  B26  1  0.50000000  0.12998651  0.31796336  1.0
  B  B27  1  0.50000000  0.87001349  0.68203664  1.0
  B  B28  1  0.50000000  0.97895121  0.21220143  1.0
  B  B29  1  0.50000000  0.02104879  0.78779857  1.0
  B  B30  1  0.50000000  0.47984403  0.28803803  1.0
  B  B31  1  0.50000000  0.52015597  0.71196197  1.0
  B  B32  1  0.50000000  0.59771949  0.02707306  1.0
  B  B33  1  0.50000000  0.40228051  0.97292694  1.0
  B  B34  1  0.50000000  0.09748933  0.47301258  1.0
  B  B35  1  0.50000000  0.90251067  0.52698742  1.0