data_CoTcAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   3.01
_cell_angle_alpha   107.7
_cell_angle_beta   107.7
_cell_angle_gamma   105.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTcAs2
_chemical_formula_sum   'Co1 Tc1 As2'
_cell_volume   59.69
_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
  Co  Co2  1  0.0  0.0  0.0  1.0
  Tc  Tc3  1  0.95  0.0  0.0  1.0
  As  As0  1  0.72  0.05  0.3  1.0
  As  As1  1  0.72  0.95  0.3  1.0

data_CoTcAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.01
_cell_length_b   4.88
_cell_length_c   4.88
_cell_angle_alpha   105.68
_cell_angle_beta   107.7
_cell_angle_gamma   107.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoTcAs2
_chemical_formula_sum   'Co1 Tc1 As2'
_cell_volume   59.69
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.0  0.95  0.0  1.0
  As  As2  1  0.3  0.72  0.95  1.0
  As  As3  1  0.3  0.72  0.05  1.0

Co Tc As As