data_SnMoO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.1
_cell_length_b   7.1
_cell_length_c   7.1
_cell_angle_alpha   40.96
_cell_angle_beta   40.96
_cell_angle_gamma   40.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnMoO3
_chemical_formula_sum   'Sn2 Mo2 O6'
_cell_volume   138.68
_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
  Sn  Sn8  1  0.0  0.0  0.47  1.0
  Sn  Sn9  1  0.0  0.0  0.01  1.0
  Mo  Mo0  1  0.0  0.0  0.99  1.0
  Mo  Mo1  1  0.0  0.0  0.48  1.0
  O  O2  1  0.19  0.43  0.68  1.0
  O  O3  1  0.64  0.98  0.68  1.0
  O  O4  1  0.17  0.59  0.68  1.0
  O  O5  1  0.83  0.41  0.79  1.0
  O  O6  1  0.36  0.02  0.79  1.0
  O  O7  1  0.81  0.57  0.79  1.0

data_SnMoO3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   7.1
_cell_angle_alpha   69.52
_cell_angle_beta   69.52
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SnMoO3
_chemical_formula_sum   'Sn2 Mo2 O6'
_cell_volume   138.68
_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
  Sn  Sn0  2  0.0  0.27  0.23  1.0
  Mo  Mo1  2  0.0  0.25  0.25  1.0
  O  O2  2  0.02  0.06  0.07  1.0
  O  O3  2  0.41  0.06  0.2  1.0
  O  O4  2  0.43  0.94  0.94  1.0

Sn Sn Mo Mo O O O O O O