# generated using pymatgen
data_Ba4Si7PIr8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71522630
_cell_length_b   7.73723506
_cell_length_c   7.91954696
_cell_angle_alpha   87.74634377
_cell_angle_beta   90.03062832
_cell_angle_gamma   89.64802867
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Si7PIr8
_chemical_formula_sum   'Ba4 Si7 P1 Ir8'
_cell_volume   411.15200469
_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
  Ba  Ba0  1  0.37793588  0.00084576  0.23765333  1.0
  Ba  Ba1  1  0.87314795  0.49950641  0.76350709  1.0
  Ba  Ba2  1  0.12386339  0.49837674  0.23321543  1.0
  Ba  Ba3  1  0.62078604  0.99842823  0.76520265  1.0
  Si  Si4  1  0.14398232  0.18979604  0.56301698  1.0
  Si  Si5  1  0.64418988  0.31385314  0.43488232  1.0
  Si  Si6  1  0.85631505  0.81254272  0.43788126  1.0
  Si  Si7  1  0.91898761  0.12867480  0.07235346  1.0
  Si  Si8  1  0.58261375  0.63374637  0.07534364  1.0
  Si  Si9  1  0.08509124  0.87059461  0.92745140  1.0
  Si  Si10  1  0.35261692  0.68681168  0.56216761  1.0
  P  P11  1  0.41854119  0.36973480  0.92547828  1.0
  Ir  Ir12  1  0.39335686  0.38493186  0.62546436  1.0
  Ir  Ir13  1  0.60732684  0.61563935  0.37822325  1.0
  Ir  Ir14  1  0.10862509  0.88823772  0.62352303  1.0
  Ir  Ir15  1  0.17084812  0.17218826  0.86373577  1.0
  Ir  Ir16  1  0.66068061  0.32883288  0.13356747  1.0
  Ir  Ir17  1  0.83620278  0.83119170  0.13836410  1.0
  Ir  Ir18  1  0.33231443  0.66119454  0.86174973  1.0
  Ir  Ir19  1  0.89257504  0.11487341  0.37721885  1.0