data_TcTe2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55
_cell_length_b   4.59
_cell_length_c   4.59
_cell_angle_alpha   71.35
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcTe2As
_chemical_formula_sum   'Tc1 Te2 As1'
_cell_volume   90.73
_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  Tc1  1  0.27  0.0  0.28  1.0
  Te  Te2  1  0.0  0.0  0.94  1.0
  Te  Te3  1  0.27  0.0  0.16  1.0
  As  As0  1  0.0  0.0  0.15  1.0

data_TcTe2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.55
_cell_length_b   4.59
_cell_length_c   4.59
_cell_angle_alpha   108.65
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcTe2As
_chemical_formula_sum   'Tc1 Te2 As1'
_cell_volume   90.73
_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  0.73  0.0  0.72  1.0
  Te  Te1  1  0.0  0.0  0.06  1.0
  Te  Te2  1  0.73  0.0  0.84  1.0
  As  As3  1  0.0  0.0  0.85  1.0

Tc Te Te As