data_LiMo(PO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.98
_cell_length_b   5.05
_cell_length_c   8.48
_cell_angle_alpha   94.02
_cell_angle_beta   90.94
_cell_angle_gamma   119.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMo(PO4)2
_chemical_formula_sum   'Li1 Mo1 P2 O8'
_cell_volume   185.97
_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
  Li  Li0  1  0.12  0.64  0.81  1.0
  Mo  Mo1  1  0.43  0.38  0.07  1.0
  P  P2  1  0.84  0.88  0.81  1.0
  P  P3  1  0.34  0.75  0.78  1.0
  O  O4  1  0.09  0.33  0.94  1.0
  O  O5  1  0.06  0.26  0.59  1.0
  O  O6  1  0.74  0.96  0.53  1.0
  O  O7  1  0.34  0.56  0.15  1.0
  O  O8  1  0.99  0.03  0.35  1.0
  O  O9  1  0.41  0.61  0.94  1.0
  O  O10  1  0.88  0.01  0.51  1.0
  O  O11  1  0.19  0.78  0.24  1.0

data_LiMo(PO4)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.98
_cell_length_b   5.05
_cell_length_c   8.48
_cell_angle_alpha   94.02
_cell_angle_beta   90.94
_cell_angle_gamma   119.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMo(PO4)2
_chemical_formula_sum   'Li1 Mo1 P2 O8'
_cell_volume   185.97
_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
  Li  Li0  1  0.12  0.64  0.81  1.0
  Mo  Mo1  1  0.43  0.38  0.07  1.0
  P  P2  1  0.34  0.75  0.78  1.0
  P  P3  1  0.84  0.88  0.81  1.0
  O  O4  1  0.06  0.26  0.59  1.0
  O  O5  1  0.09  0.33  0.94  1.0
  O  O6  1  0.19  0.78  0.24  1.0
  O  O7  1  0.34  0.56  0.15  1.0
  O  O8  1  0.41  0.61  0.94  1.0
  O  O9  1  0.74  0.96  0.53  1.0
  O  O10  1  0.88  0.01  0.51  1.0
  O  O11  1  0.99  0.03  0.35  1.0

Li Mo P P O O O O O O O O