# generated using pymatgen
data_Zr6Ti6ZnAs5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95515283
_cell_length_b   7.95668465
_cell_length_c   7.95515316
_cell_angle_alpha   127.75528696
_cell_angle_beta   123.41613680
_cell_angle_gamma   80.61354959
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Ti6ZnAs5
_chemical_formula_sum   'Zr6 Ti6 Zn1 As5'
_cell_volume   320.52749319
_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
  Zr  Zr0  1  0.45530805  0.66299654  0.70768949  1.0
  Zr  Zr1  1  0.54589203  0.25361040  0.20771837  1.0
  Zr  Zr2  1  0.74984985  0.84574456  0.59589471  1.0
  Zr  Zr3  1  0.24993068  0.84276707  0.09283538  1.0
  Zr  Zr4  1  0.04471439  0.25212890  0.70741451  1.0
  Zr  Zr5  1  0.95368980  0.66130850  0.20761870  1.0
  Ti  Ti6  1  0.49871586  0.49900966  0.99762449  1.0
  Ti  Ti7  1  0.00138617  0.49900966  0.50029481  1.0
  Ti  Ti8  1  0.12209174  0.25347490  0.13002120  1.0
  Ti  Ti9  1  0.87752553  0.00800129  0.13083358  1.0
  Ti  Ti10  1  0.37716771  0.00800129  0.63047676  1.0
  Ti  Ti11  1  0.62345369  0.25347490  0.63138216  1.0
  Zn  Zn12  1  0.25039561  0.25329898  0.50290437  1.0
  As  As13  1  0.74977438  0.25415356  0.00437918  1.0
  As  As14  1  0.33270124  0.58642902  0.25244668  1.0
  As  As15  1  0.66607434  0.91988038  0.25253679  1.0
  As  As16  1  0.16734459  0.91988038  0.75380704  1.0
  As  As17  1  0.83398234  0.58642902  0.75372778  1.0