data_Be2TcPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   4.23
_cell_angle_alpha   106.56
_cell_angle_beta   106.56
_cell_angle_gamma   33.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2TcPt
_chemical_formula_sum   'Be2 Tc1 Pt1'
_cell_volume   46.71
_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  0.6  0.0  0.16  1.0
  Be  Be1  1  0.41  0.0  0.86  1.0
  Tc  Tc3  1  0.28  0.0  0.73  1.0
  Pt  Pt2  1  0.76  0.0  0.3  1.0

data_Be2TcPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.64
_cell_length_b   4.23
_cell_length_c   4.58
_cell_angle_alpha   106.56
_cell_angle_beta   106.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2TcPt
_chemical_formula_sum   'Be2 Tc1 Pt1'
_cell_volume   46.71
_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  0.16  0.6  1.0
  Be  Be1  1  0.0  0.86  0.41  1.0
  Tc  Tc2  1  0.0  0.73  0.28  1.0
  Pt  Pt3  1  0.0  0.3  0.76  1.0

Be Be Tc Pt
Be Be Tc Pt 0 3 o o o 1 2 o o o 