data_YSi2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.46
_cell_length_b   4.46
_cell_length_c   5.34
_cell_angle_alpha   108.25
_cell_angle_beta   108.25
_cell_angle_gamma   47.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YSi2Mo
_chemical_formula_sum   'Y1 Si2 Mo1'
_cell_volume   74.19
_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  0.0  1.0
  Si  Si1  1  0.7  0.0  0.26  1.0
  Si  Si2  1  0.62  0.0  0.76  1.0
  Mo  Mo0  1  0.16  0.0  0.51  1.0

data_YSi2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.62
_cell_length_b   4.46
_cell_length_c   5.34
_cell_angle_alpha   108.25
_cell_angle_beta   90.0
_cell_angle_gamma   113.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YSi2Mo
_chemical_formula_sum   'Y1 Si2 Mo1'
_cell_volume   74.19
_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  0.0  1.0
  Si  Si1  1  0.0  0.3  0.74  1.0
  Si  Si2  1  0.0  0.38  0.24  1.0
  Mo  Mo3  1  0.0  0.84  0.49  1.0

Y Si Si Mo