# generated using pymatgen
data_Ca2Hf3Ni9As7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.71739154
_cell_length_b   9.71739070
_cell_length_c   3.84887393
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000948
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Hf3Ni9As7
_chemical_formula_sum   'Ca2 Hf3 Ni9 As7'
_cell_volume   314.74848037
_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  0.33333300  0.66666700  0.00000000  1.0
  Ca  Ca1  1  0.66666700  0.33333300  0.50000000  1.0
  Hf  Hf2  1  0.22984538  0.11774095  0.50000000  1.0
  Hf  Hf3  1  0.88225905  0.11210343  0.50000000  1.0
  Hf  Hf4  1  0.88789657  0.77015462  0.50000000  1.0
  Ni  Ni5  1  0.12872462  0.28079432  0.00000000  1.0
  Ni  Ni6  1  0.71920568  0.84793030  0.00000000  1.0
  Ni  Ni7  1  0.15206970  0.87127538  0.00000000  1.0
  Ni  Ni8  1  0.41823136  0.35045553  0.00000000  1.0
  Ni  Ni9  1  0.64954447  0.06777684  0.00000000  1.0
  Ni  Ni10  1  0.93222316  0.58176864  0.00000000  1.0
  Ni  Ni11  1  0.05961886  0.43362629  0.50000000  1.0
  Ni  Ni12  1  0.56637371  0.62599257  0.50000000  1.0
  Ni  Ni13  1  0.37400743  0.94038114  0.50000000  1.0
  As  As14  1  0.29797122  0.41763230  0.50000000  1.0
  As  As15  1  0.58236770  0.88033792  0.50000000  1.0
  As  As16  1  0.11966208  0.70202878  0.50000000  1.0
  As  As17  1  0.42373425  0.10190155  0.00000000  1.0
  As  As18  1  0.89809845  0.32183270  0.00000000  1.0
  As  As19  1  0.67816730  0.57626575  0.00000000  1.0
  As  As20  1  0.00000000  0.00000000  0.00000000  1.0