data_MnGe2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   3.05
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   106.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe2As
_chemical_formula_sum   'Mn1 Ge2 As1'
_cell_volume   69.8
_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  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.46  0.04  0.52  1.0
  Ge  Ge2  1  0.46  0.96  0.52  1.0
  As  As0  1  0.93  0.0  0.0  1.0

data_MnGe2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   4.89
_cell_length_c   4.89
_cell_angle_alpha   106.43
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe2As
_chemical_formula_sum   'Mn1 Ge2 As1'
_cell_volume   69.8
_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  0.0  0.0  1.0
  Ge  Ge1  1  0.52  0.46  0.04  1.0
  Ge  Ge2  1  0.52  0.46  0.96  1.0
  As  As3  1  -0.0  0.93  0.0  1.0

Mn Ge Ge As