data_GeSbMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   4.77
_cell_angle_alpha   106.67
_cell_angle_beta   106.67
_cell_angle_gamma   37.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeSbMo2
_chemical_formula_sum   'Ge1 Sb1 Mo2'
_cell_volume   68.95
_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
  Ge  Ge0  1  0.27  0.0  0.7  1.0
  Sb  Sb3  1  0.99  0.0  0.06  1.0
  Mo  Mo1  1  0.04  0.0  0.28  1.0
  Mo  Mo2  1  0.59  0.0  0.31  1.0

data_GeSbMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   4.77
_cell_length_c   4.97
_cell_angle_alpha   106.67
_cell_angle_beta   108.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeSbMo2
_chemical_formula_sum   'Ge1 Sb1 Mo2'
_cell_volume   68.95
_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
  Ge  Ge0  1  0.0  0.7  0.27  1.0
  Sb  Sb1  1  0.0  0.06  0.99  1.0
  Mo  Mo2  1  0.0  0.28  0.04  1.0
  Mo  Mo3  1  0.0  0.31  0.59  1.0

Ge Sb Mo Mo