# generated using pymatgen
data_Pa2(TiRe8)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.34318279
_cell_length_b   8.45025301
_cell_length_c   8.45025338
_cell_angle_alpha   109.72646955
_cell_angle_beta   109.21474273
_cell_angle_gamma   109.21475376
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pa2(TiRe8)3
_chemical_formula_sum   'Pa2 Ti3 Re24'
_cell_volume   460.05968094
_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
  Pa  Pa0  1  0.99120075  0.00000000  0.00000000  1.0
  Pa  Pa1  1  0.64356955  0.00000000  0.00000000  1.0
  Ti  Ti2  1  0.99888527  0.62840007  1.00000000  1.0
  Ti  Ti3  1  0.99888527  0.00000000  0.62840007  1.0
  Ti  Ti4  1  0.37048520  0.37159993  0.37159993  1.0
  Re  Re5  1  0.39699298  0.68010673  0.00000000  1.0
  Re  Re6  1  0.71688524  0.31989327  0.31989327  1.0
  Re  Re7  1  0.39699298  0.00000000  0.68010673  1.0
  Re  Re8  1  0.68258608  0.39904197  1.00000000  1.0
  Re  Re9  1  0.99825057  0.40167590  0.68121983  1.0
  Re  Re10  1  0.31703174  0.72045707  0.31878017  1.0
  Re  Re11  1  0.31703174  0.31878017  0.72045707  1.0
  Re  Re12  1  0.99825057  0.68121983  0.40167590  1.0
  Re  Re13  1  0.68258608  0.00000000  0.39904197  1.0
  Re  Re14  1  0.59657467  0.59832410  0.27954293  1.0
  Re  Re15  1  0.28354311  0.60095803  0.60095803  1.0
  Re  Re16  1  0.59657467  0.27954293  0.59832410  1.0
  Re  Re17  1  0.37425104  0.19572291  1.00000000  1.0
  Re  Re18  1  0.17852813  0.80427709  0.80427709  1.0
  Re  Re19  1  0.37425104  1.00000000  0.19572291  1.0
  Re  Re20  1  0.19723991  0.38423621  1.00000000  1.0
  Re  Re21  1  0.01008079  0.39019970  0.20046176  1.0
  Re  Re22  1  0.80961902  0.18973694  0.79953824  1.0
  Re  Re23  1  0.80961902  0.79953824  0.18973694  1.0
  Re  Re24  1  0.01008079  0.20046176  0.39019970  1.0
  Re  Re25  1  0.19723991  1.00000000  0.38423621  1.0
  Re  Re26  1  0.61988109  0.60980030  0.81026306  1.0
  Re  Re27  1  0.81300370  0.61576379  0.61576379  1.0
  Re  Re28  1  0.61988109  0.81026306  0.60980030  1.0