# generated using pymatgen
data_CaV4(PdO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.52448297
_cell_length_b   6.52448297
_cell_length_c   6.52448297
_cell_angle_alpha   109.47122063
_cell_angle_beta   109.47122063
_cell_angle_gamma   109.47122063
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaV4(PdO4)3
_chemical_formula_sum   'Ca1 V4 Pd3 O12'
_cell_volume   213.80429006
_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  0.00000000  0.00000000  0.00000000  1.0
  V  V1  1  0.00000000  0.00000000  0.50000000  1.0
  V  V2  1  0.50000000  0.00000000  0.00000000  1.0
  V  V3  1  0.00000000  0.50000000  0.00000000  1.0
  V  V4  1  0.50000000  0.50000000  0.50000000  1.0
  Pd  Pd5  1  0.50000000  0.00000000  0.50000000  1.0
  Pd  Pd6  1  0.00000000  0.50000000  0.50000000  1.0
  Pd  Pd7  1  0.50000000  0.50000000  0.00000000  1.0
  O  O8  1  0.18120700  0.88547400  0.70426700  1.0
  O  O9  1  0.81879300  0.11452600  0.29573300  1.0
  O  O10  1  0.81879300  0.52306000  0.70426700  1.0
  O  O11  1  0.18120700  0.47694000  0.29573300  1.0
  O  O12  1  0.88547400  0.70426700  0.18120700  1.0
  O  O13  1  0.11452600  0.29573300  0.81879300  1.0
  O  O14  1  0.52306000  0.70426700  0.81879300  1.0
  O  O15  1  0.47694000  0.29573300  0.18120700  1.0
  O  O16  1  0.70426700  0.18120700  0.88547400  1.0
  O  O17  1  0.29573300  0.81879300  0.11452600  1.0
  O  O18  1  0.70426700  0.81879300  0.52306000  1.0
  O  O19  1  0.29573300  0.18120700  0.47694000  1.0