data_BeCoTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11
_cell_length_b   3.66
_cell_length_c   5.35
_cell_angle_alpha   90.0
_cell_angle_beta   100.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCoTe2
_chemical_formula_sum   'Be1 Co1 Te2'
_cell_volume   79.11
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.55  0.0  0.63  1.0
  Te  Te2  1  0.76  0.83  0.33  1.0
  Te  Te3  1  0.34  0.83  0.93  1.0

data_BeCoTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.66
_cell_length_b   4.11
_cell_length_c   5.35
_cell_angle_alpha   100.87
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeCoTe2
_chemical_formula_sum   'Be1 Co1 Te2'
_cell_volume   79.11
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.45  0.37  1.0
  Te  Te2  1  0.17  0.24  0.67  1.0
  Te  Te3  1  0.17  0.66  0.07  1.0

Be Co Te Te
Be Co Te Te 0 3 o - - 0 2 - - o 1 3 o - o 1 2 o - o 2 3 o o - 