data_GaTc2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79
_cell_length_b   4.11
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTc2Mo
_chemical_formula_sum   'Ga1 Tc2 Mo1'
_cell_volume   59.62
_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
  Ga  Ga0  1  0.0  0.0  0.58  1.0
  Tc  Tc2  1  0.0  0.0  0.01  1.0
  Tc  Tc3  1  0.4  0.05  0.33  1.0
  Mo  Mo1  1  0.4  0.05  0.88  1.0

data_GaTc2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.11
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTc2Mo
_chemical_formula_sum   'Ga1 Tc2 Mo1'
_cell_volume   59.62
_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
  Ga  Ga0  1  0.0  0.0  0.58  1.0
  Tc  Tc1  1  0.0  0.0  0.01  1.0
  Tc  Tc2  1  0.4  0.05  0.33  1.0
  Mo  Mo3  1  0.4  0.05  0.88  1.0

Ga Tc Tc Mo
Ga Tc Tc Mo 0 2 - o o 0 2 o o o 0 3 o o o 1 3 o o - 1 2 o o o 