data_GaGe2H5CNO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.08
_cell_length_b   7.51
_cell_length_c   7.52
_cell_angle_alpha   114.05
_cell_angle_beta   99.92
_cell_angle_gamma   108.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaGe2H5CNO6
_chemical_formula_sum   'Ga2 Ge4 H10 C2 N2 O12'
_cell_volume   324.99
_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
  Ga  Ga2  1  0.67  0.1  0.75  1.0
  Ga  Ga3  1  0.73  0.37  0.69  1.0
  Ge  Ge4  1  0.46  0.29  0.27  1.0
  Ge  Ge5  1  0.4  0.63  0.03  1.0
  Ge  Ge6  1  0.01  0.83  0.4  1.0
  Ge  Ge7  1  0.95  0.17  0.17  1.0
  H  H8  1  0.98  0.16  0.13  1.0
  H  H9  1  0.02  0.95  0.13  1.0
  H  H10  1  0.14  0.63  0.59  1.0
  H  H11  1  0.34  0.73  0.81  1.0
  H  H12  1  0.17  0.06  0.37  1.0
  H  H13  1  0.23  0.4  0.07  1.0
  H  H14  1  0.07  0.73  0.62  1.0
  H  H15  1  0.27  0.83  0.85  1.0
  H  H16  1  0.38  0.51  0.31  1.0
  H  H17  1  0.43  0.3  0.31  1.0
  C  C0  1  0.99  0.08  0.71  1.0
  C  C1  1  0.42  0.38  0.73  1.0
  N  N18  1  0.06  0.99  0.55  1.0
  N  N19  1  0.35  0.47  0.89  1.0
  O  O20  1  0.71  0.97  0.81  1.0
  O  O21  1  0.59  0.64  0.44  1.0
  O  O22  1  0.03  0.0  0.06  1.0
  O  O23  1  0.27  0.39  0.17  1.0
  O  O24  1  0.76  0.08  0.65  1.0
  O  O25  1  0.03  0.35  0.53  1.0
  O  O26  1  0.38  0.11  0.91  1.0
  O  O27  1  0.65  0.38  0.79  1.0
  O  O28  1  0.14  0.07  0.27  1.0
  O  O29  1  0.37  0.46  0.38  1.0
  O  O30  1  0.81  0.82  0.99  1.0
  O  O31  1  0.69  0.49  0.62  1.0

data_GaGe2H5CNO6
_symmetry_space_group_name_H-M   P-1
_cell_length_a   7.08
_cell_length_b   7.51
_cell_length_c   7.52
_cell_angle_alpha   114.05
_cell_angle_beta   99.92
_cell_angle_gamma   108.48
_symmetry_Int_Tables_number   2
_chemical_formula_structural   GaGe2H5CNO6
_chemical_formula_sum   'Ga2 Ge4 H10 C2 N2 O12'
_cell_volume   324.99
_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
  Ga  Ga0  2  0.47  0.86  0.53  1.0
  Ge  Ge1  2  0.2  0.4  0.81  1.0
  Ge  Ge2  2  0.26  0.06  0.05  1.0
  H  H3  2  0.03  0.17  0.85  1.0
  H  H4  2  0.07  0.6  0.63  1.0
  H  H5  2  0.13  0.5  0.6  1.0
  H  H6  2  0.18  0.28  0.09  1.0
  H  H7  2  0.23  0.07  0.09  1.0
  C  C8  2  0.22  0.15  0.51  1.0
  N  N9  2  0.14  0.24  0.67  1.0
  O  O10  2  0.07  0.16  0.95  1.0
  O  O11  2  0.17  0.23  0.16  1.0
  O  O12  2  0.18  0.88  0.69  1.0
  O  O13  2  0.39  0.41  0.23  1.0
  O  O14  2  0.45  0.15  0.57  1.0
  O  O15  2  0.49  0.26  0.4  1.0

Ga Ga Ge Ge Ge Ge H H H H H H H H H H C C N N O O O O O O O O O O O O