# generated using pymatgen
data_CaInPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42032051
_cell_length_b   7.31004190
_cell_length_c   8.43036225
_cell_angle_alpha   89.99980360
_cell_angle_beta   89.99937063
_cell_angle_gamma   90.00537147
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaInPd
_chemical_formula_sum   'Ca4 In4 Pd4'
_cell_volume   272.40800192
_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
  Ca  Ca0  1  0.74996624  0.53301073  0.17759990  1.0
  Ca  Ca1  1  0.25004019  0.96698540  0.67760089  1.0
  Ca  Ca2  1  0.74996183  0.03301345  0.32239996  1.0
  Ca  Ca3  1  0.25003238  0.46699033  0.82239898  1.0
  In  In4  1  0.24999656  0.35521715  0.43829807  1.0
  In  In5  1  0.25000073  0.85521276  0.06170123  1.0
  In  In6  1  0.74999924  0.14478874  0.93829903  1.0
  In  In7  1  0.75000360  0.64478206  0.56170287  1.0
  Pd  Pd8  1  0.24998848  0.23135541  0.12811051  1.0
  Pd  Pd9  1  0.75000943  0.76864793  0.87189045  1.0
  Pd  Pd10  1  0.75001725  0.26865514  0.62811409  1.0
  Pd  Pd11  1  0.24998407  0.73134093  0.37188503  1.0