# generated using pymatgen
data_Ca6YbZrBi6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.14200749
_cell_length_b   8.29650967
_cell_length_c   8.30289945
_cell_angle_alpha   109.87723140
_cell_angle_beta   109.06573374
_cell_angle_gamma   109.06263231
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca6YbZrBi6
_chemical_formula_sum   'Ca6 Yb1 Zr1 Bi6'
_cell_volume   433.89123041
_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  0.64207839  0.50001690  0.99993755  1.0
  Ca  Ca1  1  0.50154968  0.00397677  0.65297975  1.0
  Ca  Ca2  1  0.36179045  0.35787730  0.35744514  1.0
  Ca  Ca3  1  0.50482953  0.99940751  0.14242549  1.0
  Ca  Ca4  1  0.99760661  0.64918959  0.49609793  1.0
  Ca  Ca5  1  0.84860225  0.84712988  0.85114249  1.0
  Yb  Yb6  1  0.00500602  0.14277526  0.50107636  1.0
  Zr  Zr7  1  0.13219273  0.49961356  0.99935194  1.0
  Bi  Bi8  1  0.36279132  0.61758054  0.75476834  1.0
  Bi  Bi9  1  0.89044709  0.25956006  0.12204396  1.0
  Bi  Bi10  1  0.60975021  0.74594512  0.36392643  1.0
  Bi  Bi11  1  0.12987548  0.86225559  0.24112292  1.0
  Bi  Bi12  1  0.24409672  0.13650262  0.87964751  1.0
  Bi  Bi13  1  0.76938151  0.37816832  0.63803620  1.0