data_MnCrGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   4.91
_cell_angle_alpha   100.95
_cell_angle_beta   100.95
_cell_angle_gamma   38.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrGe2
_chemical_formula_sum   'Mn1 Cr1 Ge2'
_cell_volume   56.0
_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
  Mn  Mn3  1  0.6  0.0  0.4  1.0
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.31  0.0  0.61  1.0
  Ge  Ge2  1  0.89  0.0  0.2  1.0

data_MnCrGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.33
_cell_length_c   4.91
_cell_angle_alpha   100.95
_cell_angle_beta   90.0
_cell_angle_gamma   109.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrGe2
_chemical_formula_sum   'Mn1 Cr1 Ge2'
_cell_volume   56.0
_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
  Mn  Mn0  1  0.0  0.4  0.6  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Ge  Ge2  1  0.0  0.11  0.8  1.0
  Ge  Ge3  1  0.0  0.69  0.39  1.0

Mn Cr Ge Ge
Mn Cr Ge Ge 0 2 o o o 0 3 o o o 1 3 - o o 