data_Ga2Sn3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.4
_cell_length_b   10.83
_cell_length_c   8.68
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2Sn3N4
_chemical_formula_sum   'Ga8 Sn12 N16'
_cell_volume   602.19
_cell_formula_units_Z   4
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  Ga0  1  0.8  0.42  0.85  1.0
  Ga  Ga1  1  0.8  0.0  0.17  1.0
  Ga  Ga2  1  0.6  0.42  0.83  1.0
  Ga  Ga3  1  0.6  0.0  0.51  1.0
  Ga  Ga4  1  0.05  0.71  0.51  1.0
  Ga  Ga5  1  0.55  0.13  0.51  1.0
  Ga  Ga6  1  0.35  0.13  0.17  1.0
  Ga  Ga7  1  0.85  0.71  0.17  1.0
  Sn  Sn8  1  0.07  0.53  0.2  1.0
  Sn  Sn9  1  0.53  0.3  0.2  1.0
  Sn  Sn10  1  0.07  0.88  0.14  1.0
  Sn  Sn11  1  0.53  0.95  0.14  1.0
  Sn  Sn12  1  0.33  0.3  0.48  1.0
  Sn  Sn13  1  0.87  0.53  0.48  1.0
  Sn  Sn14  1  0.33  0.95  0.54  1.0
  Sn  Sn15  1  0.87  0.88  0.54  1.0
  Sn  Sn16  1  0.8  0.42  0.92  1.0
  Sn  Sn17  1  0.8  0.0  0.42  1.0
  Sn  Sn18  1  0.6  0.42  0.76  1.0
  Sn  Sn19  1  0.6  0.0  0.26  1.0
  N  N20  1  0.8  0.29  0.57  1.0
  N  N21  1  0.8  0.54  0.57  1.0
  N  N22  1  0.8  0.13  0.45  1.0
  N  N23  1  0.8  0.71  0.45  1.0
  N  N24  1  0.6  0.54  0.11  1.0
  N  N25  1  0.6  0.29  0.11  1.0
  N  N26  1  0.6  0.71  0.23  1.0
  N  N27  1  0.6  0.13  0.23  1.0
  N  N28  1  0.07  0.86  0.85  1.0
  N  N29  1  0.53  0.97  0.85  1.0
  N  N30  1  0.07  0.55  0.18  1.0
  N  N31  1  0.53  0.28  0.18  1.0
  N  N32  1  0.33  0.97  0.84  1.0
  N  N33  1  0.87  0.86  0.84  1.0
  N  N34  1  0.33  0.28  0.5  1.0
  N  N35  1  0.87  0.55  0.5  1.0

data_Ga2Sn3N4
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.4
_cell_length_b   8.68
_cell_length_c   10.83
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2Sn3N4
_chemical_formula_sum   'Ga8 Sn12 N16'
_cell_volume   602.19
_cell_formula_units_Z   4
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  Ga0  1  0.15  0.83  0.29  1.0
  Ga  Ga1  1  0.2  0.15  0.58  1.0
  Ga  Ga2  1  0.2  0.83  0.0  1.0
  Ga  Ga3  1  0.4  0.17  0.58  1.0
  Ga  Ga4  1  0.4  0.49  0.0  1.0
  Ga  Ga5  1  0.45  0.49  0.87  1.0
  Ga  Ga6  1  0.65  0.83  0.87  1.0
  Ga  Ga7  1  0.95  0.49  0.29  1.0
  Sn  Sn8  1  0.13  0.46  0.12  1.0
  Sn  Sn9  1  0.13  0.52  0.47  1.0
  Sn  Sn10  1  0.2  0.08  0.58  1.0
  Sn  Sn11  1  0.2  0.58  0.0  1.0
  Sn  Sn12  1  0.4  0.24  0.58  1.0
  Sn  Sn13  1  0.4  0.74  0.0  1.0
  Sn  Sn14  1  0.47  0.8  0.7  1.0
  Sn  Sn15  1  0.47  0.86  0.05  1.0
  Sn  Sn16  1  0.67  0.46  0.05  1.0
  Sn  Sn17  1  0.67  0.52  0.7  1.0
  Sn  Sn18  1  0.93  0.8  0.47  1.0
  Sn  Sn19  1  0.93  0.86  0.12  1.0
  N  N20  1  0.13  0.16  0.14  1.0
  N  N21  1  0.13  0.5  0.45  1.0
  N  N22  1  0.2  0.43  0.71  1.0
  N  N23  1  0.2  0.55  0.87  1.0
  N  N24  1  0.2  0.43  0.46  1.0
  N  N25  1  0.2  0.55  0.29  1.0
  N  N26  1  0.4  0.77  0.87  1.0
  N  N27  1  0.4  0.89  0.71  1.0
  N  N28  1  0.4  0.77  0.29  1.0
  N  N29  1  0.4  0.89  0.46  1.0
  N  N30  1  0.47  0.15  0.03  1.0
  N  N31  1  0.47  0.82  0.72  1.0
  N  N32  1  0.67  0.16  0.03  1.0
  N  N33  1  0.67  0.5  0.72  1.0
  N  N34  1  0.93  0.15  0.14  1.0
  N  N35  1  0.93  0.82  0.45  1.0

Ga Ga Ga Ga Ga Ga Ga Ga Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn N N N N N N N N N N N N N N N N
Ga Ga Ga Ga Ga Ga Ga Ga Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn N N N N N N N N N N N N N N N N 0 16 o o o 1 19 o o o 1 10 + - o 2 18 o o o 3 5 o o o 3 17 o o o 3 14 o - o 4 35 - o o 4 23 - o o 5 22 o o o 5 20 o o o 6 31 o o o 6 27 o o o 7 26 o o o 7 10 + o o 7 24 o o o 8 30 o o o 9 31 o o o 10 28 o o - 11 19 o + o 12 34 o o o 13 35 o o o 13 23 o o o 15 23 o o o 15 17 o + o 16 24 o o + 17 22 o o o 18 20 o o o 19 27 o o o 20 22 o o o 21 35 o o o 21 23 o o o 23 35 o o o 24 26 o o o 25 31 o o o 27 31 o o o 28 33 - o o 29 32 o o o 