# generated using pymatgen
data_CaTb(Si2Ni9)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.49947918
_cell_length_b   7.49947874
_cell_length_c   7.49947867
_cell_angle_alpha   99.55522396
_cell_angle_beta   99.55522617
_cell_angle_gamma   131.91317769
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTb(Si2Ni9)2
_chemical_formula_sum   'Ca1 Tb1 Si4 Ni18'
_cell_volume   286.64334532
_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  0.50000000  0.50000000  0.00000000  1.0
  Tb  Tb1  1  0.75000000  0.25000000  0.50000000  1.0
  Si  Si2  1  0.62453337  0.87432706  0.75020631  1.0
  Si  Si3  1  0.12567294  0.37546663  0.24979369  1.0
  Si  Si4  1  0.12567294  0.87588025  0.75020631  1.0
  Si  Si5  1  0.12411975  0.87432706  0.24979369  1.0
  Ni  Ni6  1  0.25000000  0.75000000  0.50000000  1.0
  Ni  Ni7  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni8  1  0.68729626  0.01516458  0.07891793  1.0
  Ni  Ni9  1  0.68729626  0.60837933  0.67213169  1.0
  Ni  Ni10  1  0.26333609  0.43639498  0.57786674  1.0
  Ni  Ni11  1  0.26333609  0.68546936  0.82694111  1.0
  Ni  Ni12  1  0.93624564  0.01516458  0.32786831  1.0
  Ni  Ni13  1  0.93624564  0.60837933  0.92108207  1.0
  Ni  Ni14  1  0.85853024  0.43639498  0.17305889  1.0
  Ni  Ni15  1  0.85853024  0.68546936  0.42213326  1.0
  Ni  Ni16  1  0.56360502  0.73666391  0.42213326  1.0
  Ni  Ni17  1  0.56360502  0.14146976  0.82694111  1.0
  Ni  Ni18  1  0.98483542  0.31270374  0.92108207  1.0
  Ni  Ni19  1  0.98483542  0.06375436  0.67213169  1.0
  Ni  Ni20  1  0.31453064  0.73666391  0.17305889  1.0
  Ni  Ni21  1  0.31453064  0.14146976  0.57786674  1.0
  Ni  Ni22  1  0.39162067  0.31270374  0.32786831  1.0
  Ni  Ni23  1  0.39162067  0.06375436  0.07891793  1.0