data_Nb2CoGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   3.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2CoGe
_chemical_formula_sum   'Nb2 Co1 Ge1'
_cell_volume   61.63
_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
  Nb  Nb2  1  0.38  0.14  0.51  1.0
  Nb  Nb3  1  0.38  0.86  0.51  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.75  0.0  0.0  1.0

data_Nb2CoGe
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.62
_cell_length_b   3.02
_cell_length_c   4.62
_cell_angle_alpha   90.0
_cell_angle_beta   106.92
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Nb2CoGe
_chemical_formula_sum   'Nb2 Co1 Ge1'
_cell_volume   61.63
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Nb  Nb0  1  0.38  0.5  0.14  1.0
  Nb  Nb1  1  0.38  0.5  0.86  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Ge  Ge3  1  0.75  0.0  0.0  1.0

Nb Nb Co Ge