# generated using pymatgen
data_Zr20C17N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.80248450
_cell_length_b   8.80429793
_cell_length_c   11.03581600
_cell_angle_alpha   62.95305873
_cell_angle_beta   62.95284744
_cell_angle_gamma   44.53076760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr20C17N
_chemical_formula_sum   'Zr20 C17 N1'
_cell_volume   522.39672092
_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  0.22397044  0.47920738  0.94662691  1.0
  Zr  Zr1  1  0.72126631  0.96730679  0.95595619  1.0
  Zr  Zr2  1  0.56381063  0.33122348  0.64820783  1.0
  Zr  Zr3  1  0.43617280  0.66812666  0.35171822  1.0
  Zr  Zr4  1  0.27856349  0.03363347  0.04359074  1.0
  Zr  Zr5  1  0.08236798  0.81364060  0.64476517  1.0
  Zr  Zr6  1  0.12361256  0.37245788  0.75012671  1.0
  Zr  Zr7  1  0.91746912  0.18635069  0.35533914  1.0
  Zr  Zr8  1  0.96702282  0.72106721  0.45619245  1.0
  Zr  Zr9  1  0.77652552  0.52099955  0.05267931  1.0
  Zr  Zr10  1  0.62783598  0.87654327  0.74943497  1.0
  Zr  Zr11  1  0.81330323  0.08233923  0.14496413  1.0
  Zr  Zr12  1  0.47881639  0.22311203  0.44737968  1.0
  Zr  Zr13  1  0.66872666  0.43674323  0.85164841  1.0
  Zr  Zr14  1  0.52124639  0.77652694  0.55297477  1.0
  Zr  Zr15  1  0.33135484  0.56372944  0.14836709  1.0
  Zr  Zr16  1  0.37196891  0.12336140  0.25062233  1.0
  Zr  Zr17  1  0.18672904  0.91780465  0.85526935  1.0
  Zr  Zr18  1  0.03269702  0.27884888  0.54405497  1.0
  Zr  Zr19  1  0.87601629  0.62867190  0.24985331  1.0
  C  C20  1  0.92467578  0.67775545  0.85086177  1.0
  C  C21  1  0.57505679  0.82773505  0.14730422  1.0
  C  C22  1  0.77655596  0.02570107  0.54998157  1.0
  C  C23  1  0.42345328  0.17283238  0.85384605  1.0
  C  C24  1  0.62573985  0.37555004  0.24952687  1.0
  C  C25  1  0.27564780  0.52850621  0.55081942  1.0
  C  C26  1  0.47187981  0.72493197  0.95000117  1.0
  C  C27  1  0.32139409  0.07553769  0.65013795  1.0
  C  C28  1  0.17222991  0.42457361  0.35188870  1.0
  C  C29  1  0.97518168  0.22403883  0.95045031  1.0
  C  C30  1  0.82724921  0.57541564  0.64739081  1.0
  C  C31  1  0.02526661  0.77462038  0.05114444  1.0
  C  C32  1  0.67829723  0.92372096  0.34897902  1.0
  C  C33  1  0.72539976  0.47092848  0.44799346  1.0
  C  C34  1  0.52726725  0.27593820  0.05135341  1.0
  C  C35  1  0.37553692  0.62364906  0.75063239  1.0
  C  C36  1  0.22354680  0.97617141  0.44795686  1.0
  N  N37  1  0.07614482  0.32070088  0.14996291  1.0