data_YTc2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83
_cell_length_b   5.83
_cell_length_c   4.34
_cell_angle_alpha   94.39
_cell_angle_beta   94.39
_cell_angle_gamma   33.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTc2Cl
_chemical_formula_sum   'Y1 Tc2 Cl1'
_cell_volume   80.83
_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
  Y  Y3  1  0.41  0.0  0.16  1.0
  Tc  Tc1  1  0.33  0.0  0.38  1.0
  Tc  Tc2  1  0.48  0.0  0.94  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_YTc2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.34
_cell_length_c   5.83
_cell_angle_alpha   94.39
_cell_angle_beta   106.71
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTc2Cl
_chemical_formula_sum   'Y1 Tc2 Cl1'
_cell_volume   80.83
_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
  Y  Y0  1  0.0  0.16  0.41  1.0
  Tc  Tc1  1  0.0  0.38  0.33  1.0
  Tc  Tc2  1  0.0  0.94  0.48  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Y Tc Tc Cl