# generated using pymatgen
data_Zr12AsSe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.95776379
_cell_length_b   10.97809872
_cell_length_c   5.50067992
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.02768850
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr12AsSe3
_chemical_formula_sum   'Zr24 As2 Se6'
_cell_volume   661.70648345
_cell_formula_units_Z   2
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  0.89577726  0.58700521  0.04069949  1.0
  Zr  Zr1  1  0.10422274  0.41299479  0.04069949  1.0
  Zr  Zr2  1  0.91467120  0.39463610  0.54692498  1.0
  Zr  Zr3  1  0.08532880  0.60536390  0.54692498  1.0
  Zr  Zr4  1  0.60420960  0.91411649  0.45691614  1.0
  Zr  Zr5  1  0.39579040  0.08588351  0.45691614  1.0
  Zr  Zr6  1  0.58566960  0.10417404  0.95576582  1.0
  Zr  Zr7  1  0.41433040  0.89582596  0.95576582  1.0
  Zr  Zr8  1  0.85944468  0.02629967  0.71498610  1.0
  Zr  Zr9  1  0.14055532  0.97370033  0.71498610  1.0
  Zr  Zr10  1  0.47358619  0.36006018  0.21452445  1.0
  Zr  Zr11  1  0.52641381  0.63993982  0.21452445  1.0
  Zr  Zr12  1  0.64018000  0.47383963  0.78478191  1.0
  Zr  Zr13  1  0.35982000  0.52616037  0.78478191  1.0
  Zr  Zr14  1  0.02680118  0.14052336  0.28566389  1.0
  Zr  Zr15  1  0.97319882  0.85947664  0.28566389  1.0
  Zr  Zr16  1  0.28445484  0.18206923  0.98197173  1.0
  Zr  Zr17  1  0.71554516  0.81793077  0.98197173  1.0
  Zr  Zr18  1  0.31903079  0.78484247  0.48330329  1.0
  Zr  Zr19  1  0.68096921  0.21515753  0.48330329  1.0
  Zr  Zr20  1  0.21416032  0.31819584  0.51704153  1.0
  Zr  Zr21  1  0.78583968  0.68180416  0.51704153  1.0
  Zr  Zr22  1  0.18176796  0.71533970  0.01706555  1.0
  Zr  Zr23  1  0.81823204  0.28466030  0.01706555  1.0
  As  As24  1  0.03768151  0.20429879  0.79040297  1.0
  As  As25  1  0.96231849  0.79570121  0.79040297  1.0
  Se  Se26  1  0.79347907  0.03823226  0.21053950  1.0
  Se  Se27  1  0.20652093  0.96176774  0.21053950  1.0
  Se  Se28  1  0.46205774  0.29381702  0.71001207  1.0
  Se  Se29  1  0.53794226  0.70618298  0.71001207  1.0
  Se  Se30  1  0.70707547  0.46232198  0.28940057  1.0
  Se  Se31  1  0.29292453  0.53767802  0.28940057  1.0