data_CoTcCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.12
_cell_length_b   3.12
_cell_length_c   7.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   124.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTcCl2
_chemical_formula_sum   'Co1 Tc1 Cl2'
_cell_volume   62.81
_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
  Co  Co2  1  0.0  0.0  0.0  1.0
  Tc  Tc3  1  0.0  0.0  0.91  1.0
  Cl  Cl0  1  0.45  0.0  0.91  1.0
  Cl  Cl1  1  0.45  0.0  0.9  1.0

data_CoTcCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   3.12
_cell_length_c   7.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTcCl2
_chemical_formula_sum   'Co1 Tc1 Cl2'
_cell_volume   62.81
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.0  0.0  0.91  1.0
  Cl  Cl2  1  0.0  0.45  0.9  1.0
  Cl  Cl3  1  0.0  0.45  0.91  1.0

Co Tc Cl Cl