# generated using pymatgen
data_CaNi3SnGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97454916
_cell_length_b   9.22502263
_cell_length_c   9.22502286
_cell_angle_alpha   60.00278732
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNi3SnGe
_chemical_formula_sum   'Ca3 Ni9 Sn3 Ge3'
_cell_volume   292.93117415
_cell_formula_units_Z   3
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  0.33333023  0.33332447  1.0
  Ca  Ca1  1  0.50000000  0.66667553  0.66666977  1.0
  Ca  Ca2  1  0.00000000  0.99999973  0.00000027  1.0
  Ni  Ni3  1  0.00000000  0.21361173  0.15371877  1.0
  Ni  Ni4  1  0.00000000  0.15376710  0.63264921  1.0
  Ni  Ni5  1  0.00000000  0.63262435  0.21365217  1.0
  Ni  Ni6  1  0.00000000  0.84628123  0.78638827  1.0
  Ni  Ni7  1  0.00000000  0.36735079  0.84623290  1.0
  Ni  Ni8  1  0.00000000  0.78634783  0.36737565  1.0
  Ni  Ni9  1  0.50000000  0.27168729  0.72831271  1.0
  Ni  Ni10  1  0.50000000  0.72827901  0.00002731  1.0
  Ni  Ni11  1  0.50000000  0.99997269  0.27172099  1.0
  Sn  Sn12  1  0.00000000  0.46011785  0.53988215  1.0
  Sn  Sn13  1  0.00000000  0.53985578  0.00000899  1.0
  Sn  Sn14  1  0.00000000  0.99999101  0.46014422  1.0
  Ge  Ge15  1  0.50000000  0.74967611  0.25032389  1.0
  Ge  Ge16  1  0.50000000  0.25032786  0.00000013  1.0
  Ge  Ge17  1  0.50000000  0.99999987  0.74967214  1.0