data_K2TcMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85
_cell_length_b   6.85
_cell_length_c   6.85
_cell_angle_alpha   151.24
_cell_angle_beta   125.18
_cell_angle_gamma   63.08
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2TcMo
_chemical_formula_sum   'K2 Tc1 Mo1'
_cell_volume   125.53
_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  0.0  0.43  1.0
  K  K1  1  0.7  0.0  0.1  1.0
  Tc  Tc3  1  0.0  0.16  0.26  1.0
  Mo  Mo2  1  0.0  0.0  0.58  1.0

data_K2TcMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   6.31
_cell_length_c   6.85
_cell_angle_alpha   117.41
_cell_angle_beta   104.38
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2TcMo
_chemical_formula_sum   'K2 Tc1 Mo1'
_cell_volume   125.53
_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  0.1  0.4  1.0
  K  K1  1  0.0  0.43  0.43  1.0
  Tc  Tc2  1  0.84  0.1  0.1  1.0
  Mo  Mo3  1  0.0  0.58  0.58  1.0

K K Tc Mo