data_SmMnGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.37
_cell_length_b   8.37
_cell_length_c   4.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   149.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmMnGe2
_chemical_formula_sum   'Sm2 Mn2 Ge4'
_cell_volume   159.21
_cell_formula_units_Z   2
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
  Sm  Sm0  1  0.21  0.62  0.12  1.0
  Sm  Sm1  1  0.21  0.38  0.35  1.0
  Mn  Mn2  1  0.21  0.9  0.12  1.0
  Mn  Mn3  1  0.21  0.1  0.35  1.0
  Ge  Ge4  1  0.21  0.28  0.12  1.0
  Ge  Ge5  1  0.21  0.72  0.35  1.0
  Ge  Ge6  1  0.21  0.98  0.12  1.0
  Ge  Ge7  1  0.21  0.02  0.35  1.0

data_SmMnGe2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.41
_cell_length_b   4.47
_cell_length_c   8.37
_cell_angle_alpha   90.0
_cell_angle_beta   105.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SmMnGe2
_chemical_formula_sum   'Sm2 Mn2 Ge4'
_cell_volume   159.21
_cell_formula_units_Z   2
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
  Sm  Sm0  2  0.38  0.38  0.88  1.0
  Mn  Mn1  2  0.1  0.38  0.6  1.0
  Ge  Ge2  2  0.02  0.38  0.52  1.0
  Ge  Ge3  2  0.28  0.62  0.78  1.0

Sm Sm Mn Mn Ge Ge Ge Ge
Sm Sm Mn Mn Ge Ge Ge Ge 0 5 o o o 1 4 o o o 2 6 o o o 3 7 o o o 