# generated using pymatgen
data_Ca4SiAsPd28
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.88502485
_cell_length_b   8.88502485
_cell_length_c   7.02519276
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4SiAsPd28
_chemical_formula_sum   'Ca4 Si1 As1 Pd28'
_cell_volume   554.59447442
_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
  Ca  Ca0  1  0.50000000  0.00000000  0.93729842  1.0
  Ca  Ca1  1  0.00000000  0.50000000  0.06071123  1.0
  Ca  Ca2  1  0.00000000  0.00000000  0.50121558  1.0
  Ca  Ca3  1  0.50000000  0.50000000  0.50121558  1.0
  Si  Si4  1  0.00000000  0.50000000  0.55127745  1.0
  As  As5  1  0.50000000  0.00000000  0.45029502  1.0
  Pd  Pd6  1  0.32985569  0.82985569  0.62038009  1.0
  Pd  Pd7  1  0.32985569  0.17014431  0.62038009  1.0
  Pd  Pd8  1  0.67014431  0.82985569  0.62038009  1.0
  Pd  Pd9  1  0.67014431  0.17014431  0.62038009  1.0
  Pd  Pd10  1  0.16536306  0.66536306  0.38262465  1.0
  Pd  Pd11  1  0.16536306  0.33463694  0.38262465  1.0
  Pd  Pd12  1  0.83463694  0.66536306  0.38262465  1.0
  Pd  Pd13  1  0.83463694  0.33463694  0.38262465  1.0
  Pd  Pd14  1  0.50000000  0.76677824  0.25334638  1.0
  Pd  Pd15  1  0.50000000  0.23322176  0.25334638  1.0
  Pd  Pd16  1  0.26677824  0.00000000  0.25334638  1.0
  Pd  Pd17  1  0.73322176  0.00000000  0.25334638  1.0
  Pd  Pd18  1  0.00000000  0.72967369  0.74121108  1.0
  Pd  Pd19  1  0.00000000  0.27032631  0.74121108  1.0
  Pd  Pd20  1  0.22967369  0.50000000  0.74121108  1.0
  Pd  Pd21  1  0.77032631  0.50000000  0.74121108  1.0
  Pd  Pd22  1  0.50000000  0.34856025  0.85832724  1.0
  Pd  Pd23  1  0.50000000  0.65143975  0.85832724  1.0
  Pd  Pd24  1  0.84856025  0.00000000  0.85832724  1.0
  Pd  Pd25  1  0.15143975  0.00000000  0.85832724  1.0
  Pd  Pd26  1  0.00000000  0.15145196  0.14423316  1.0
  Pd  Pd27  1  0.00000000  0.84854804  0.14423316  1.0
  Pd  Pd28  1  0.65145196  0.50000000  0.14423316  1.0
  Pd  Pd29  1  0.34854804  0.50000000  0.14423316  1.0
  Pd  Pd30  1  0.24828398  0.74828398  0.99937484  1.0
  Pd  Pd31  1  0.24828398  0.25171602  0.99937484  1.0
  Pd  Pd32  1  0.75171602  0.74828398  0.99937484  1.0
  Pd  Pd33  1  0.75171602  0.25171602  0.99937484  1.0