data_MoOsPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.51
_cell_length_b   4.51
_cell_length_c   7.06
_cell_angle_alpha   98.84
_cell_angle_beta   98.84
_cell_angle_gamma   42.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoOsPb2
_chemical_formula_sum   'Mo1 Os1 Pb2'
_cell_volume   94.86
_cell_formula_units_Z   1
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  0.61  0.0  0.97  1.0
  Os  Os1  1  0.04  0.0  0.26  1.0
  Pb  Pb2  1  0.02  0.0  0.41  1.0
  Pb  Pb3  1  0.22  0.0  0.81  1.0

data_MoOsPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   4.51
_cell_length_c   7.06
_cell_angle_alpha   98.84
_cell_angle_beta   90.0
_cell_angle_gamma   111.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoOsPb2
_chemical_formula_sum   'Mo1 Os1 Pb2'
_cell_volume   94.86
_cell_formula_units_Z   1
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  0.0  0.39  0.03  1.0
  Os  Os1  1  0.0  0.96  0.74  1.0
  Pb  Pb2  1  0.0  0.78  0.19  1.0
  Pb  Pb3  1  0.0  0.98  0.59  1.0

Mo Os Pb Pb
Mo Os Pb Pb 0 3 o o o 1 2 o o o 