# generated using pymatgen
data_LuPa(ReN3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28608640
_cell_length_b   5.69664486
_cell_length_c   7.69743387
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuPa(ReN3)2
_chemical_formula_sum   'Lu2 Pa2 Re4 N12'
_cell_volume   231.79249457
_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
  Lu  Lu0  1  0.52490292  0.57129645  0.75000000  1.0
  Lu  Lu1  1  0.97509708  0.07129645  0.75000000  1.0
  Pa  Pa2  1  0.47834168  0.42487426  0.25000000  1.0
  Pa  Pa3  1  0.02165832  0.92487426  0.25000000  1.0
  Re  Re4  1  0.50549252  0.99788415  0.51184766  1.0
  Re  Re5  1  0.99450748  0.49788415  0.98815234  1.0
  Re  Re6  1  0.99450748  0.49788415  0.51184766  1.0
  Re  Re7  1  0.50549252  0.99788415  0.98815234  1.0
  N  N8  1  0.69623160  0.29442119  0.55586785  1.0
  N  N9  1  0.31264947  0.69789013  0.06198648  1.0
  N  N10  1  0.18735053  0.19789013  0.06198648  1.0
  N  N11  1  0.39356513  0.97936876  0.75000000  1.0
  N  N12  1  0.88251418  0.54407158  0.25000000  1.0
  N  N13  1  0.31264947  0.69789013  0.43801352  1.0
  N  N14  1  0.80376840  0.79442119  0.94413215  1.0
  N  N15  1  0.69623160  0.29442119  0.94413215  1.0
  N  N16  1  0.80376840  0.79442119  0.55586785  1.0
  N  N17  1  0.10643487  0.47936876  0.75000000  1.0
  N  N18  1  0.18735053  0.19789013  0.43801352  1.0
  N  N19  1  0.61748582  0.04407158  0.25000000  1.0