data_Be2GaTc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.65
_cell_length_b   4.65
_cell_length_c   4.65
_cell_angle_alpha   137.85
_cell_angle_beta   137.4
_cell_angle_gamma   61.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2GaTc
_chemical_formula_sum   'Be2 Ga1 Tc1'
_cell_volume   45.05
_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  0.97  1.0
  Be  Be1  1  0.67  0.0  0.06  1.0
  Ga  Ga2  1  0.0  0.0  0.98  1.0
  Tc  Tc3  1  0.0  0.69  0.97  1.0

data_Be2GaTc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.34
_cell_length_b   3.38
_cell_length_c   4.65
_cell_angle_alpha   111.3
_cell_angle_beta   111.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be2GaTc
_chemical_formula_sum   'Be2 Ga1 Tc1'
_cell_volume   45.05
_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  0.06  0.39  1.0
  Be  Be1  1  0.0  0.97  0.97  1.0
  Ga  Ga2  1  0.0  0.98  0.98  1.0
  Tc  Tc3  1  0.31  0.28  0.28  1.0

Be Be Ga Tc