data_KGaP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07
_cell_length_b   6.07
_cell_length_c   6.07
_cell_angle_alpha   148.33
_cell_angle_beta   126.15
_cell_angle_gamma   63.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KGaP2
_chemical_formula_sum   'K1 Ga1 P2'
_cell_volume   94.03
_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
  K  K1  1  0.0  0.0  0.34  1.0
  Ga  Ga0  1  0.0  0.75  0.3  1.0
  P  P2  1  0.0  0.75  0.57  1.0
  P  P3  1  0.0  0.0  0.25  1.0

data_KGaP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   5.5
_cell_length_c   6.07
_cell_angle_alpha   116.93
_cell_angle_beta   105.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KGaP2
_chemical_formula_sum   'K1 Ga1 P2'
_cell_volume   94.03
_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
  K  K0  1  0.0  0.34  0.34  1.0
  Ga  Ga1  1  0.25  0.55  0.55  1.0
  P  P2  1  0.0  0.25  0.25  1.0
  P  P3  1  0.25  0.82  0.82  1.0

K Ga P P