data_LaNiSnH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.31
_cell_length_b   4.45
_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   LaNiSnH
_chemical_formula_sum   'La4 Ni4 Sn4 H4'
_cell_volume   282.45
_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
  La  La0  1  0.09  0.34  0.7  1.0
  La  La1  1  0.22  0.11  0.98  1.0
  La  La2  1  0.57  0.11  0.04  1.0
  La  La3  1  0.74  0.34  0.64  1.0
  Ni  Ni4  1  0.71  0.34  0.84  1.0
  Ni  Ni5  1  0.6  0.11  0.84  1.0
  Ni  Ni6  1  0.25  0.11  0.5  1.0
  Ni  Ni7  1  0.06  0.34  0.18  1.0
  Sn  Sn8  1  0.79  0.34  0.91  1.0
  Sn  Sn9  1  0.52  0.11  0.77  1.0
  Sn  Sn10  1  0.17  0.11  0.57  1.0
  Sn  Sn11  1  0.14  0.34  0.11  1.0
  H  H12  1  0.19  0.11  0.7  1.0
  H  H13  1  0.11  0.34  0.98  1.0
  H  H14  1  0.46  0.34  0.04  1.0
  H  H15  1  0.85  0.11  0.64  1.0

data_LaNiSnH
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.45
_cell_length_b   7.31
_cell_length_c   8.68
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   LaNiSnH
_chemical_formula_sum   'La4 Ni4 Sn4 H4'
_cell_volume   282.45
_cell_formula_units_Z   4
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
  La  La0  2  0.39  0.57  0.14  1.0
  La  La1  2  0.39  0.91  0.2  1.0
  Ni  Ni2  2  0.39  0.6  0.66  1.0
  Ni  Ni3  2  0.39  0.94  1.0  1.0
  Sn  Sn4  2  0.39  0.52  0.73  1.0
  Sn  Sn5  2  0.39  0.86  0.93  1.0
  H  H6  2  0.39  0.19  0.8  1.0
  H  H7  2  0.39  0.54  0.86  1.0

La La La La Ni Ni Ni Ni Sn Sn Sn Sn H H H H
La La La La Ni Ni Ni Ni Sn Sn Sn Sn H H H H 0 12 o o o 1 13 o o o 2 14 o o o 3 15 o o o 4 8 o o o 5 9 o o o 6 10 o o o 7 11 o o o 10 12 o o o 11 13 o o - 