data_YMn2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.03
_cell_length_b   3.63
_cell_length_c   6.04
_cell_angle_alpha   90.0
_cell_angle_beta   101.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMn2Tc
_chemical_formula_sum   'Y1 Mn2 Tc1'
_cell_volume   65.1
_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
  Y  Y3  1  0.76  0.0  0.51  1.0
  Mn  Mn0  1  0.35  0.81  0.4  1.0
  Mn  Mn1  1  0.96  0.0  0.4  1.0
  Tc  Tc2  1  0.24  0.81  0.58  1.0

data_YMn2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   3.63
_cell_length_c   6.04
_cell_angle_alpha   90.0
_cell_angle_beta   101.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMn2Tc
_chemical_formula_sum   'Y1 Mn2 Tc1'
_cell_volume   65.1
_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
  Y  Y0  1  0.76  0.0  0.51  1.0
  Mn  Mn1  1  0.35  0.81  0.4  1.0
  Mn  Mn2  1  0.96  0.0  0.4  1.0
  Tc  Tc3  1  0.24  0.81  0.58  1.0

Y Mn Mn Tc
Y Mn Mn Tc 0 2 o o o 0 1 o - o 1 3 o o o 1 2 - + o 2 3 + - o 