data_TcAsRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05
_cell_length_b   5.05
_cell_length_c   2.86
_cell_angle_alpha   102.73
_cell_angle_beta   102.73
_cell_angle_gamma   116.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcAsRu2
_chemical_formula_sum   'Tc1 As1 Ru2'
_cell_volume   58.96
_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
  Tc  Tc3  1  0.65  0.0  0.0  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.72  0.15  0.3  1.0
  Ru  Ru2  1  0.72  0.85  0.3  1.0

data_TcAsRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   4.84
_cell_length_c   5.05
_cell_angle_alpha   116.27
_cell_angle_beta   102.73
_cell_angle_gamma   97.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcAsRu2
_chemical_formula_sum   'Tc1 As1 Ru2'
_cell_volume   58.96
_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
  Tc  Tc0  1  0.0  0.0  0.65  1.0
  As  As1  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.15  0.85  0.57  1.0
  Ru  Ru3  1  0.45  0.15  0.87  1.0

Tc As Ru Ru