# generated using pymatgen
data_La2PaSe5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.94991985
_cell_length_b   8.62600451
_cell_length_c   12.63141555
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2PaSe5
_chemical_formula_sum   'La8 Pa4 Se20'
_cell_volume   866.21251414
_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
  La  La0  1  0.52800466  0.49990198  0.32341515  1.0
  La  La1  1  0.97199534  0.00009802  0.82341515  1.0
  La  La2  1  0.47199534  0.99990198  0.67658485  1.0
  La  La3  1  0.02800466  0.50009802  0.17658485  1.0
  La  La4  1  0.47199534  0.50009802  0.67658485  1.0
  La  La5  1  0.02800466  0.99990198  0.17658485  1.0
  La  La6  1  0.52800466  0.00009802  0.32341515  1.0
  La  La7  1  0.97199534  0.49990198  0.82341515  1.0
  Pa  Pa8  1  0.06988331  0.75000000  0.49323297  1.0
  Pa  Pa9  1  0.43011669  0.75000000  0.99323297  1.0
  Pa  Pa10  1  0.93011669  0.25000000  0.50676703  1.0
  Pa  Pa11  1  0.56988331  0.25000000  0.00676703  1.0
  Se  Se12  1  0.83497883  0.95950623  0.59528072  1.0
  Se  Se13  1  0.66502117  0.54049377  0.09528072  1.0
  Se  Se14  1  0.16502117  0.45950623  0.40471928  1.0
  Se  Se15  1  0.33497883  0.04049377  0.90471928  1.0
  Se  Se16  1  0.16502117  0.04049377  0.40471928  1.0
  Se  Se17  1  0.33497883  0.45950623  0.90471928  1.0
  Se  Se18  1  0.83497883  0.54049377  0.59528072  1.0
  Se  Se19  1  0.66502117  0.95950623  0.09528072  1.0
  Se  Se20  1  0.83351109  0.75000000  0.31432836  1.0
  Se  Se21  1  0.66648891  0.75000000  0.81432836  1.0
  Se  Se22  1  0.16648891  0.25000000  0.68567164  1.0
  Se  Se23  1  0.33351109  0.25000000  0.18567164  1.0
  Se  Se24  1  0.45343076  0.75000000  0.49922864  1.0
  Se  Se25  1  0.04656924  0.75000000  0.99922864  1.0
  Se  Se26  1  0.54656924  0.25000000  0.50077136  1.0
  Se  Se27  1  0.95343076  0.25000000  0.00077136  1.0
  Se  Se28  1  0.19078394  0.75000000  0.71442180  1.0
  Se  Se29  1  0.30921606  0.75000000  0.21442180  1.0
  Se  Se30  1  0.80921606  0.25000000  0.28557820  1.0
  Se  Se31  1  0.69078394  0.25000000  0.78557820  1.0