data_YMo2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.92
_cell_length_b   2.92
_cell_length_c   8.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMo2Pt
_chemical_formula_sum   'Y1 Mo2 Pt1'
_cell_volume   72.67
_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  0.0  0.0  0.29  1.0
  Mo  Mo0  1  0.72  0.0  0.69  1.0
  Mo  Mo1  1  0.0  0.0  0.72  1.0
  Pt  Pt2  1  0.72  0.0  0.62  1.0

data_YMo2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.92
_cell_length_b   2.92
_cell_length_c   8.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YMo2Pt
_chemical_formula_sum   'Y1 Mo2 Pt1'
_cell_volume   72.67
_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  0.0  0.0  0.29  1.0
  Mo  Mo1  1  0.0  0.0  0.72  1.0
  Mo  Mo2  1  0.72  0.0  0.69  1.0
  Pt  Pt3  1  0.72  0.0  0.62  1.0

Y Mo Mo Pt
Y Mo Mo Pt 0 0 + + o 0 0 o + o 0 0 + o o 0 3 - o o 1 3 o o o 1 2 + o o 