# generated using pymatgen
data_SmPa3(ReN3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38367657
_cell_length_b   5.78669851
_cell_length_c   7.69648484
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.02539092
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmPa3(ReN3)4
_chemical_formula_sum   'Sm1 Pa3 Re4 N12'
_cell_volume   239.73568445
_cell_formula_units_Z   1
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
  Sm  Sm0  1  0.48467628  0.42507546  0.25000000  1.0
  Pa  Pa1  1  0.00789558  0.94447257  0.25000000  1.0
  Pa  Pa2  1  0.52935456  0.56530395  0.75000000  1.0
  Pa  Pa3  1  0.97623978  0.08090648  0.75000000  1.0
  Re  Re4  1  0.48327856  0.99111474  0.50123633  1.0
  Re  Re5  1  0.00702350  0.50552371  0.00929521  1.0
  Re  Re6  1  0.00702350  0.50552371  0.49070479  1.0
  Re  Re7  1  0.48327856  0.99111474  0.99876367  1.0
  N  N8  1  0.68704123  0.30684920  0.56185420  1.0
  N  N9  1  0.29427818  0.71271029  0.04266306  1.0
  N  N10  1  0.18241772  0.19156520  0.05456234  1.0
  N  N11  1  0.40228111  0.97127728  0.75000000  1.0
  N  N12  1  0.92464185  0.51058115  0.25000000  1.0
  N  N13  1  0.29427818  0.71271029  0.45733694  1.0
  N  N14  1  0.81399967  0.80492007  0.93967809  1.0
  N  N15  1  0.68704123  0.30684920  0.93814580  1.0
  N  N16  1  0.81399967  0.80492007  0.56032191  1.0
  N  N17  1  0.12574939  0.45045402  0.75000000  1.0
  N  N18  1  0.18241772  0.19156520  0.44543766  1.0
  N  N19  1  0.61308174  0.02656367  0.25000000  1.0