data_YGeP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.34
_cell_length_b   4.34
_cell_length_c   15.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGeP
_chemical_formula_sum   'Y4 Ge4 P4'
_cell_volume   247.02
_cell_formula_units_Z   4
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  Y8  1  0.0  0.0  0.58  1.0
  Y  Y9  1  0.0  0.0  0.0  1.0
  Y  Y10  1  0.0  0.0  0.37  1.0
  Y  Y11  1  0.0  0.0  0.79  1.0
  Ge  Ge0  1  0.17  0.25  0.46  1.0
  Ge  Ge1  1  0.0  0.5  0.88  1.0
  Ge  Ge2  1  0.0  0.5  0.7  1.0
  Ge  Ge3  1  0.17  0.25  0.27  1.0
  P  P4  1  0.17  0.25  0.92  1.0
  P  P5  1  0.0  0.5  0.49  1.0
  P  P6  1  0.0  0.5  0.24  1.0
  P  P7  1  0.17  0.25  0.66  1.0

data_YGeP
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.34
_cell_length_b   4.34
_cell_length_c   15.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGeP
_chemical_formula_sum   'Y4 Ge4 P4'
_cell_volume   247.02
_cell_formula_units_Z   4
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
  Y  Y1  1  0.0  0.0  0.37  1.0
  Y  Y2  1  0.0  0.0  0.58  1.0
  Y  Y3  1  0.0  0.0  0.79  1.0
  Ge  Ge4  1  -0.0  0.5  0.7  1.0
  Ge  Ge5  1  -0.0  0.5  0.88  1.0
  Ge  Ge6  1  0.17  0.25  0.27  1.0
  Ge  Ge7  1  0.17  0.25  0.46  1.0
  P  P8  1  -0.0  0.5  0.24  1.0
  P  P9  1  -0.0  0.5  0.49  1.0
  P  P10  1  0.17  0.25  0.66  1.0
  P  P11  1  0.17  0.25  0.92  1.0

Y Y Y Y Ge Ge Ge Ge P P P P