data_Li2Co2P2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84
_cell_length_b   7.17
_cell_length_c   7.18
_cell_angle_alpha   69.45
_cell_angle_beta   77.06
_cell_angle_gamma   76.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Co2P2O9
_chemical_formula_sum   'Li2 Co2 P2 O9'
_cell_volume   223.72
_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  0.93  0.17  0.39  1.0
  Li  Li1  1  0.2  1.0  0.25  1.0
  Co  Co2  1  0.89  0.89  0.64  1.0
  Co  Co3  1  0.25  0.28  0.0  1.0
  P  P4  1  0.31  0.47  0.96  1.0
  P  P5  1  0.82  0.7  0.68  1.0
  O  O6  1  0.04  0.68  0.06  1.0
  O  O7  1  0.46  0.91  0.5  1.0
  O  O8  1  0.28  0.18  0.04  1.0
  O  O9  1  0.0  0.0  0.0  1.0
  O  O10  1  0.01  0.94  0.12  1.0
  O  O11  1  0.12  0.23  0.52  1.0
  O  O12  1  0.85  0.99  0.6  1.0
  O  O13  1  0.68  0.26  0.13  1.0
  O  O14  1  0.09  0.49  0.58  1.0

data_Li2Co2P2O9
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.84
_cell_length_b   7.17
_cell_length_c   7.18
_cell_angle_alpha   69.45
_cell_angle_beta   77.06
_cell_angle_gamma   76.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Co2P2O9
_chemical_formula_sum   'Li2 Co2 P2 O9'
_cell_volume   223.72
_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  0.2  1.0  0.25  1.0
  Li  Li1  1  0.93  0.17  0.39  1.0
  Co  Co2  1  0.25  0.28  0.0  1.0
  Co  Co3  1  0.89  0.89  0.64  1.0
  P  P4  1  0.31  0.47  0.96  1.0
  P  P5  1  0.82  0.7  0.68  1.0
  O  O6  1  0.0  0.0  0.0  1.0
  O  O7  1  0.01  0.94  0.12  1.0
  O  O8  1  0.04  0.68  0.06  1.0
  O  O9  1  0.09  0.49  0.58  1.0
  O  O10  1  0.12  0.23  0.52  1.0
  O  O11  1  0.28  0.18  0.04  1.0
  O  O12  1  0.46  0.91  0.5  1.0
  O  O13  1  0.68  0.26  0.13  1.0
  O  O14  1  0.85  0.99  0.6  1.0

Li Li Co Co P P O O O O O O O O O