data_KTc2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.39
_cell_length_b   4.39
_cell_length_c   6.95
_cell_angle_alpha   97.37
_cell_angle_beta   97.37
_cell_angle_gamma   41.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTc2P
_chemical_formula_sum   'K1 Tc2 P1'
_cell_volume   87.69
_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
  K  K0  1  0.56  0.0  0.3  1.0
  Tc  Tc2  1  0.07  0.0  0.01  1.0
  Tc  Tc3  1  0.37  0.0  0.06  1.0
  P  P1  1  0.88  0.0  0.97  1.0

data_KTc2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   4.39
_cell_length_c   6.95
_cell_angle_alpha   97.37
_cell_angle_beta   90.0
_cell_angle_gamma   110.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTc2P
_chemical_formula_sum   'K1 Tc2 P1'
_cell_volume   87.69
_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
  K  K0  1  0.0  0.44  0.7  1.0
  Tc  Tc1  1  0.0  0.63  0.94  1.0
  Tc  Tc2  1  0.0  0.93  0.99  1.0
  P  P3  1  0.0  0.12  0.03  1.0

K Tc Tc P