# generated using pymatgen
data_Zr3Al3C5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.34749413
_cell_length_b   3.34749395
_cell_length_c   27.62244087
_cell_angle_alpha   89.99998572
_cell_angle_beta   90.00003226
_cell_angle_gamma   119.99999367
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Al3C5
_chemical_formula_sum   'Zr6 Al6 C10'
_cell_volume   268.06019971
_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  0.33333291  0.66666683  0.90442233  1.0
  Zr  Zr1  1  0.66666694  0.33333368  0.09557677  1.0
  Zr  Zr2  1  1.00000045  -0.00000018  0.99999159  1.0
  Zr  Zr3  1  0.33333368  0.66666662  0.59562439  1.0
  Zr  Zr4  1  0.99999997  -0.00000002  0.49997134  1.0
  Zr  Zr5  1  0.66666648  0.33333328  0.40435346  1.0
  Al  Al6  1  0.99999953  0.00000029  0.24998311  1.0
  Al  Al7  1  0.66666657  0.33333322  0.82256348  1.0
  Al  Al8  1  0.33333321  0.66666693  0.17744800  1.0
  Al  Al9  1  0.33333309  0.66666682  0.32249758  1.0
  Al  Al10  1  0.66666786  0.33333212  0.67752388  1.0
  Al  Al11  1  0.00000047  0.99999954  0.75006327  1.0
  C  C12  1  0.66666650  0.33333359  0.94977861  1.0
  C  C13  1  0.66666699  0.33333349  0.55022903  1.0
  C  C14  1  0.99999977  0.00000012  0.34735294  1.0
  C  C15  1  0.00000100  0.99999908  0.65265706  1.0
  C  C16  1  0.66666711  0.33333286  0.75004692  1.0
  C  C17  1  0.33333352  0.66666697  0.05019875  1.0
  C  C18  1  0.33333312  0.66666661  0.44974576  1.0
  C  C19  1  0.99999990  0.00000022  0.15259575  1.0
  C  C20  1  0.33333302  0.66666697  0.24997578  1.0
  C  C21  1  0.99999990  -0.00000003  0.84739722  1.0