data_SrSc2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.38
_cell_length_b   3.38
_cell_length_c   9.15
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSc2Tc
_chemical_formula_sum   'Sr1 Sc2 Tc1'
_cell_volume   104.18
_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
  Sr  Sr2  1  0.0  0.0  0.0  1.0
  Sc  Sc0  1  0.32  0.0  0.05  1.0
  Sc  Sc1  1  0.32  0.0  0.09  1.0
  Tc  Tc3  1  0.0  0.0  0.57  1.0

data_SrSc2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.38
_cell_length_b   3.38
_cell_length_c   9.15
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSc2Tc
_chemical_formula_sum   'Sr1 Sc2 Tc1'
_cell_volume   104.18
_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
  Sr  Sr0  1  0.0  0.0  0.0  1.0
  Sc  Sc1  1  0.32  0.0  0.05  1.0
  Sc  Sc2  1  0.32  0.0  0.09  1.0
  Tc  Tc3  1  0.0  0.0  0.57  1.0

Sr Sc Sc Tc