data_Zn2InMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.51
_cell_length_b   9.51
_cell_length_c   9.51
_cell_angle_alpha   17.93
_cell_angle_beta   17.93
_cell_angle_gamma   17.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2InMo
_chemical_formula_sum   'Zn2 In1 Mo1'
_cell_volume   71.17
_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
  Zn  Zn2  1  0.0  0.0  0.84  1.0
  Zn  Zn3  1  0.0  0.0  0.22  1.0
  In  In0  1  0.0  0.0  0.03  1.0
  Mo  Mo1  1  0.0  0.0  0.0  1.0

data_Zn2InMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.13
_cell_length_b   2.96
_cell_length_c   9.51
_cell_angle_alpha   90.0
_cell_angle_beta   100.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Zn2InMo
_chemical_formula_sum   'Zn4 In2 Mo2'
_cell_volume   142.34
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zn  Zn0  2  0.0  0.0  0.16  1.0
  Zn  Zn1  2  0.0  0.0  0.78  1.0
  In  In2  2  0.0  0.0  0.97  1.0
  Mo  Mo3  2  0.0  0.0  0.0  1.0

Zn Zn In Mo