data_CdSnAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   4.95
_cell_length_c   4.95
_cell_angle_alpha   116.16
_cell_angle_beta   116.16
_cell_angle_gamma   96.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdSnAs2
_chemical_formula_sum   'Cd1 Sn1 As2'
_cell_volume   90.02
_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
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.0  0.0  0.29  1.0
  As  As0  1  0.0  0.62  0.64  1.0
  As  As1  1  0.62  0.0  0.64  1.0

data_CdSnAs2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.57
_cell_length_b   7.4
_cell_length_c   4.95
_cell_angle_alpha   90.0
_cell_angle_beta   131.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CdSnAs2
_chemical_formula_sum   'Cd2 Sn2 As4'
_cell_volume   180.05
_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
  Cd  Cd0  2  0.0  0.0  0.0  1.0
  Sn  Sn1  2  0.0  0.0  0.71  1.0
  As  As2  4  0.19  0.19  0.36  1.0

Cd Sn As As
Cd Sn As As 0 1 o o o 0 2 o - - 0 3 - o - 