# generated using pymatgen
data_NpScCrB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49942361
_cell_length_b   8.99541099
_cell_length_c   11.37169371
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NpScCrB6
_chemical_formula_sum   'Np4 Sc4 Cr4 B24'
_cell_volume   357.96674466
_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
  Np  Np0  1  0.00000000  0.82131392  0.08564078  1.0
  Np  Np1  1  0.00000000  0.17868608  0.91435922  1.0
  Np  Np2  1  0.00000000  0.32131392  0.41435922  1.0
  Np  Np3  1  0.00000000  0.67868608  0.58564078  1.0
  Sc  Sc4  1  0.00000000  0.44410716  0.12920102  1.0
  Sc  Sc5  1  0.00000000  0.55589284  0.87079898  1.0
  Sc  Sc6  1  0.00000000  0.94410716  0.37079898  1.0
  Sc  Sc7  1  0.00000000  0.05589284  0.62920102  1.0
  Cr  Cr8  1  0.00000000  0.14137789  0.18117998  1.0
  Cr  Cr9  1  0.00000000  0.85862211  0.81882002  1.0
  Cr  Cr10  1  0.00000000  0.64137789  0.31882002  1.0
  Cr  Cr11  1  0.00000000  0.35862211  0.68117998  1.0
  B  B12  1  0.50000000  0.05411866  0.06809184  1.0
  B  B13  1  0.50000000  0.94588134  0.93190816  1.0
  B  B14  1  0.50000000  0.55411866  0.43190816  1.0
  B  B15  1  0.50000000  0.44588134  0.56809184  1.0
  B  B16  1  0.50000000  0.25198469  0.08190515  1.0
  B  B17  1  0.50000000  0.74801531  0.91809485  1.0
  B  B18  1  0.50000000  0.75198469  0.41809485  1.0
  B  B19  1  0.50000000  0.24801531  0.58190515  1.0
  B  B20  1  0.50000000  0.29392933  0.23348593  1.0
  B  B21  1  0.50000000  0.70607067  0.76651407  1.0
  B  B22  1  0.50000000  0.79392933  0.26651407  1.0
  B  B23  1  0.50000000  0.20607067  0.73348593  1.0
  B  B24  1  0.50000000  0.13068951  0.31610592  1.0
  B  B25  1  0.50000000  0.86931049  0.68389408  1.0
  B  B26  1  0.50000000  0.63068951  0.18389408  1.0
  B  B27  1  0.50000000  0.36931049  0.81610592  1.0
  B  B28  1  0.50000000  0.48217035  0.28572361  1.0
  B  B29  1  0.50000000  0.51782965  0.71427639  1.0
  B  B30  1  0.50000000  0.98217035  0.21427639  1.0
  B  B31  1  0.50000000  0.01782965  0.78572361  1.0
  B  B32  1  0.50000000  0.09911819  0.47295118  1.0
  B  B33  1  0.50000000  0.90088181  0.52704882  1.0
  B  B34  1  0.50000000  0.59911819  0.02704882  1.0
  B  B35  1  0.50000000  0.40088181  0.97295118  1.0