data_LaMnTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   2.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnTc2
_chemical_formula_sum   'La1 Mn1 Tc2'
_cell_volume   67.81
_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
  La  La0  1  0.97  0.0  0.0  1.0
  Mn  Mn1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.49  0.03  0.4  1.0
  Tc  Tc3  1  0.49  0.97  0.4  1.0

data_LaMnTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   107.64
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnTc2
_chemical_formula_sum   'La1 Mn1 Tc2'
_cell_volume   67.81
_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
  La  La0  1  -0.0  0.97  0.0  1.0
  Mn  Mn1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.4  0.49  0.97  1.0
  Tc  Tc3  1  0.4  0.49  0.03  1.0

La Mn Tc Tc