data_CrSi2Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73
_cell_length_b   4.73
_cell_length_c   4.73
_cell_angle_alpha   139.9
_cell_angle_beta   125.09
_cell_angle_gamma   70.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSi2Ge
_chemical_formula_sum   'Cr1 Si2 Ge1'
_cell_volume   54.65
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Si  Si2  1  0.62  0.0  0.93  1.0
  Si  Si3  1  0.0  0.18  0.93  1.0
  Ge  Ge1  1  0.0  0.0  0.87  1.0

data_CrSi2Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   4.36
_cell_length_c   4.73
_cell_angle_alpha   117.45
_cell_angle_beta   110.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrSi2Ge
_chemical_formula_sum   'Cr1 Si2 Ge1'
_cell_volume   54.65
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Si  Si1  1  0.0  0.93  0.31  1.0
  Si  Si2  1  0.82  0.76  0.76  1.0
  Ge  Ge3  1  0.0  0.87  0.87  1.0

Cr Si Si Ge