# generated using pymatgen
data_LuPaCrB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58487406
_cell_length_b   9.05888262
_cell_length_c   11.41996562
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuPaCrB6
_chemical_formula_sum   'Lu4 Pa4 Cr4 B24'
_cell_volume   370.86285005
_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
  Lu  Lu0  1  0.00000000  0.44428862  0.12773940  1.0
  Lu  Lu1  1  0.00000000  0.55571138  0.87226060  1.0
  Lu  Lu2  1  0.00000000  0.94428862  0.37226060  1.0
  Lu  Lu3  1  0.00000000  0.05571138  0.62773940  1.0
  Pa  Pa4  1  0.00000000  0.82265225  0.08555817  1.0
  Pa  Pa5  1  0.00000000  0.17734775  0.91444183  1.0
  Pa  Pa6  1  0.00000000  0.32265225  0.41444183  1.0
  Pa  Pa7  1  0.00000000  0.67734775  0.58555817  1.0
  Cr  Cr8  1  0.00000000  0.13965241  0.17959590  1.0
  Cr  Cr9  1  0.00000000  0.86034759  0.82040410  1.0
  Cr  Cr10  1  0.00000000  0.63965241  0.32040410  1.0
  Cr  Cr11  1  0.00000000  0.36034759  0.67959590  1.0
  B  B12  1  0.50000000  0.05417083  0.06781515  1.0
  B  B13  1  0.50000000  0.94582917  0.93218485  1.0
  B  B14  1  0.50000000  0.55417083  0.43218485  1.0
  B  B15  1  0.50000000  0.44582917  0.56781515  1.0
  B  B16  1  0.50000000  0.24974108  0.08148239  1.0
  B  B17  1  0.50000000  0.75025892  0.91851761  1.0
  B  B18  1  0.50000000  0.74974108  0.41851761  1.0
  B  B19  1  0.50000000  0.25025892  0.58148239  1.0
  B  B20  1  0.50000000  0.29275555  0.23468710  1.0
  B  B21  1  0.50000000  0.70724445  0.76531290  1.0
  B  B22  1  0.50000000  0.79275555  0.26531290  1.0
  B  B23  1  0.50000000  0.20724445  0.73468710  1.0
  B  B24  1  0.50000000  0.13182575  0.31501380  1.0
  B  B25  1  0.50000000  0.86817425  0.68498620  1.0
  B  B26  1  0.50000000  0.63182575  0.18498620  1.0
  B  B27  1  0.50000000  0.36817425  0.81501380  1.0
  B  B28  1  0.50000000  0.48348325  0.28666895  1.0
  B  B29  1  0.50000000  0.51651675  0.71333105  1.0
  B  B30  1  0.50000000  0.98348325  0.21333105  1.0
  B  B31  1  0.50000000  0.01651675  0.78666895  1.0
  B  B32  1  0.50000000  0.10568498  0.47098127  1.0
  B  B33  1  0.50000000  0.89431502  0.52901873  1.0
  B  B34  1  0.50000000  0.60568498  0.02901873  1.0
  B  B35  1  0.50000000  0.39431502  0.97098127  1.0