data_Fe2CuTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98
_cell_length_b   3.98
_cell_length_c   3.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CuTe
_chemical_formula_sum   'Fe2 Cu1 Te1'
_cell_volume   57.54
_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
  Fe  Fe1  1  0.38  0.43  0.82  1.0
  Fe  Fe2  1  0.38  0.57  0.82  1.0
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.76  0.0  0.0  1.0

data_Fe2CuTe
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.64
_cell_length_b   3.98
_cell_length_c   3.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Fe2CuTe
_chemical_formula_sum   'Fe2 Cu1 Te1'
_cell_volume   57.59
_cell_formula_units_Z   1
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
  Fe  Fe0  2  0.82  0.43  0.38  1.0
  Cu  Cu1  1  0.0  0.0  0.0  1.0
  Te  Te2  1  -0.0  0.0  0.76  1.0

Fe Fe Cu Te
Fe Fe Cu Te 0 1 o o o 2 3 - o o 