# generated using pymatgen
data_Sc2CrB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.38485181
_cell_length_b   8.89771956
_cell_length_c   11.17720360
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2CrB6
_chemical_formula_sum   'Sc8 Cr4 B24'
_cell_volume   336.62900645
_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  0.00000000  0.82239071  0.08537061  1.0
  Sc  Sc1  1  -0.00000000  0.17760929  0.91462939  1.0
  Sc  Sc2  1  0.00000000  0.32239071  0.41462939  1.0
  Sc  Sc3  1  -0.00000000  0.67760929  0.58537061  1.0
  Sc  Sc4  1  -0.00000000  0.44288258  0.13037228  1.0
  Sc  Sc5  1  0.00000000  0.55711742  0.86962772  1.0
  Sc  Sc6  1  -0.00000000  0.94288258  0.36962772  1.0
  Sc  Sc7  1  -0.00000000  0.05711742  0.63037228  1.0
  Cr  Cr8  1  -0.00000000  0.14064390  0.18042114  1.0
  Cr  Cr9  1  -0.00000000  0.85935610  0.81957886  1.0
  Cr  Cr10  1  0.00000000  0.64064390  0.31957886  1.0
  Cr  Cr11  1  0.00000000  0.35935610  0.68042114  1.0
  B  B12  1  0.50000000  0.05359403  0.06544742  1.0
  B  B13  1  0.50000000  0.94640597  0.93455258  1.0
  B  B14  1  0.50000000  0.55359403  0.43455258  1.0
  B  B15  1  0.50000000  0.44640597  0.56544742  1.0
  B  B16  1  0.50000000  0.25160557  0.07960832  1.0
  B  B17  1  0.50000000  0.74839443  0.92039168  1.0
  B  B18  1  0.50000000  0.75160557  0.42039168  1.0
  B  B19  1  0.50000000  0.24839443  0.57960832  1.0
  B  B20  1  0.50000000  0.29441218  0.23706774  1.0
  B  B21  1  0.50000000  0.70558782  0.76293226  1.0
  B  B22  1  0.50000000  0.79441218  0.26293226  1.0
  B  B23  1  0.50000000  0.20558782  0.73706774  1.0
  B  B24  1  0.50000000  0.13082410  0.31729932  1.0
  B  B25  1  0.50000000  0.86917590  0.68270068  1.0
  B  B26  1  0.50000000  0.63082410  0.18270068  1.0
  B  B27  1  0.50000000  0.36917590  0.81729932  1.0
  B  B28  1  0.50000000  0.48063914  0.28836140  1.0
  B  B29  1  0.50000000  0.51936086  0.71163860  1.0
  B  B30  1  0.50000000  0.98063914  0.21163860  1.0
  B  B31  1  0.50000000  0.01936086  0.78836140  1.0
  B  B32  1  0.50000000  0.09918188  0.47275568  1.0
  B  B33  1  0.50000000  0.90081812  0.52724432  1.0
  B  B34  1  0.50000000  0.59918188  0.02724432  1.0
  B  B35  1  0.50000000  0.40081812  0.97275568  1.0