# generated using pymatgen
data_Sc2Cr(ReB2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.00577230
_cell_length_b   6.00577230
_cell_length_c   11.09846737
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2Cr(ReB2)2
_chemical_formula_sum   'Sc8 Cr4 Re8 B16'
_cell_volume   400.31395893
_cell_formula_units_Z   4
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  0.99358323  0.64947569  0.04035501  1.0
  Sc  Sc1  1  0.00641677  0.35052431  0.54035501  1.0
  Sc  Sc2  1  0.35052431  0.00641677  0.45964499  1.0
  Sc  Sc3  1  0.14947569  0.50641677  0.79035501  1.0
  Sc  Sc4  1  0.85052431  0.49358323  0.29035501  1.0
  Sc  Sc5  1  0.50641677  0.14947569  0.20964499  1.0
  Sc  Sc6  1  0.49358323  0.85052431  0.70964499  1.0
  Sc  Sc7  1  0.64947569  0.99358323  0.95964499  1.0
  Cr  Cr8  1  0.67674471  0.67674471  0.50000000  1.0
  Cr  Cr9  1  0.17674471  0.82325529  0.25000000  1.0
  Cr  Cr10  1  0.32325529  0.32325529  0.00000000  1.0
  Cr  Cr11  1  0.82325529  0.17674471  0.75000000  1.0
  Re  Re12  1  0.99533284  0.85780041  0.62515339  1.0
  Re  Re13  1  0.00466716  0.14219959  0.12515339  1.0
  Re  Re14  1  0.85780041  0.99533284  0.37484661  1.0
  Re  Re15  1  0.35780041  0.50466716  0.37515339  1.0
  Re  Re16  1  0.64219959  0.49533284  0.87515339  1.0
  Re  Re17  1  0.50466716  0.35780041  0.62484661  1.0
  Re  Re18  1  0.49533284  0.64219959  0.12484661  1.0
  Re  Re19  1  0.14219959  0.00466716  0.87484661  1.0
  B  B20  1  0.06608676  0.71001794  0.44213076  1.0
  B  B21  1  0.64616644  0.29228317  0.44083335  1.0
  B  B22  1  0.35383356  0.70771683  0.94083335  1.0
  B  B23  1  0.20771683  0.14616644  0.69083335  1.0
  B  B24  1  0.29228317  0.64616644  0.55916665  1.0
  B  B25  1  0.70771683  0.35383356  0.05916665  1.0
  B  B26  1  0.79228317  0.85383356  0.19083335  1.0
  B  B27  1  0.14616644  0.20771683  0.30916665  1.0
  B  B28  1  0.93391324  0.28998206  0.94213076  1.0
  B  B29  1  0.71001794  0.06608676  0.55786924  1.0
  B  B30  1  0.21001794  0.43391324  0.19213076  1.0
  B  B31  1  0.78998206  0.56608676  0.69213076  1.0
  B  B32  1  0.43391324  0.21001794  0.80786924  1.0
  B  B33  1  0.56608676  0.78998206  0.30786924  1.0
  B  B34  1  0.28998206  0.93391324  0.05786924  1.0
  B  B35  1  0.85383356  0.79228317  0.80916665  1.0