data_MnTc2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   4.36
_cell_angle_alpha   91.03
_cell_angle_beta   91.03
_cell_angle_gamma   34.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnTc2Cl
_chemical_formula_sum   'Mn1 Tc2 Cl1'
_cell_volume   58.41
_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
  Mn  Mn1  1  0.55  0.0  0.06  1.0
  Tc  Tc2  1  0.03  0.0  0.05  1.0
  Tc  Tc3  1  0.65  0.0  0.41  1.0
  Cl  Cl0  1  0.64  0.0  0.01  1.0

data_MnTc2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   4.36
_cell_length_c   4.88
_cell_angle_alpha   91.03
_cell_angle_beta   107.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnTc2Cl
_chemical_formula_sum   'Mn1 Tc2 Cl1'
_cell_volume   58.41
_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
  Mn  Mn0  1  0.0  0.06  0.55  1.0
  Tc  Tc1  1  0.0  0.05  0.03  1.0
  Tc  Tc2  1  0.0  0.41  0.65  1.0
  Cl  Cl3  1  0.0  0.01  0.64  1.0

Mn Tc Tc Cl