data_MoOs13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62
_cell_length_b   8.62
_cell_length_c   8.62
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoOs13
_chemical_formula_sum   'Mo2 Os26'
_cell_volume   452.86
_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
  Mo  Mo0  1  0.14  0.14  0.14  1.0
  Mo  Mo1  1  0.05  0.05  0.05  1.0
  Os  Os2  1  0.59  0.24  0.1  1.0
  Os  Os3  1  0.6  0.24  0.1  1.0
  Os  Os4  1  0.59  0.95  0.1  1.0
  Os  Os5  1  0.6  0.95  0.1  1.0
  Os  Os6  1  0.1  0.6  0.95  1.0
  Os  Os7  1  0.1  0.59  0.95  1.0
  Os  Os8  1  0.1  0.6  0.24  1.0
  Os  Os9  1  0.1  0.59  0.24  1.0
  Os  Os10  1  0.95  0.1  0.59  1.0
  Os  Os11  1  0.95  0.1  0.6  1.0
  Os  Os12  1  0.24  0.1  0.59  1.0
  Os  Os13  1  0.24  0.1  0.6  1.0
  Os  Os14  1  0.1  0.05  0.59  1.0
  Os  Os15  1  0.1  0.05  0.6  1.0
  Os  Os16  1  0.1  0.15  0.59  1.0
  Os  Os17  1  0.1  0.15  0.6  1.0
  Os  Os18  1  0.05  0.59  0.1  1.0
  Os  Os19  1  0.05  0.6  0.1  1.0
  Os  Os20  1  0.15  0.59  0.1  1.0
  Os  Os21  1  0.15  0.6  0.1  1.0
  Os  Os22  1  0.59  0.1  0.05  1.0
  Os  Os23  1  0.6  0.1  0.05  1.0
  Os  Os24  1  0.59  0.1  0.15  1.0
  Os  Os25  1  0.6  0.1  0.15  1.0
  Os  Os26  1  0.1  0.1  0.1  1.0
  Os  Os27  1  0.0  0.0  0.0  1.0

data_MoOs13
_symmetry_space_group_name_H-M   R3
_cell_length_a   8.62
_cell_length_b   8.62
_cell_length_c   21.11
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   146
_chemical_formula_structural   MoOs13
_chemical_formula_sum   'Mo6 Os78'
_cell_volume   1358.59
_cell_formula_units_Z   6
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  'x+1/3, y+2/3, z+2/3'
  5  '-y+1/3, x-y+2/3, z+2/3'
  6  '-x+y+1/3, -x+2/3, z+2/3'
  7  'x+2/3, y+1/3, z+1/3'
  8  '-y+2/3, x-y+1/3, z+1/3'
  9  '-x+y+2/3, -x+1/3, z+1/3'
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
  Mo  Mo0  3  0.0  0.0  0.86  1.0
  Mo  Mo1  3  0.0  0.0  0.95  1.0
  Os  Os2  9  0.01  0.48  0.39  1.0
  Os  Os3  9  0.02  0.49  0.39  1.0
  Os  Os4  9  0.04  0.59  0.35  1.0
  Os  Os5  9  0.05  0.6  0.36  1.0
  Os  Os6  9  0.12  0.38  0.79  1.0
  Os  Os7  9  0.12  0.39  0.78  1.0
  Os  Os8  9  0.15  0.8  0.76  1.0
  Os  Os9  9  0.15  0.8  0.75  1.0
  Os  Os10  3  0.0  0.0  0.0  1.0
  Os  Os11  3  0.0  0.0  0.9  1.0

Mo Mo Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os