data_KAlMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   7.63
_cell_angle_alpha   91.85
_cell_angle_beta   91.85
_cell_angle_gamma   33.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlMo2
_chemical_formula_sum   'K1 Al1 Mo2'
_cell_volume   91.05
_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  0.62  0.0  0.92  1.0
  Al  Al0  1  0.34  0.0  0.51  1.0
  Mo  Mo2  1  0.55  0.0  0.92  1.0
  Mo  Mo3  1  0.96  0.0  0.73  1.0

data_KAlMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   4.62
_cell_length_c   7.63
_cell_angle_alpha   91.85
_cell_angle_beta   90.0
_cell_angle_gamma   106.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlMo2
_chemical_formula_sum   'K1 Al1 Mo2'
_cell_volume   91.05
_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  0.38  0.08  1.0
  Al  Al1  1  0.0  0.66  0.49  1.0
  Mo  Mo2  1  0.0  0.04  0.27  1.0
  Mo  Mo3  1  0.0  0.45  0.08  1.0

K Al Mo Mo