# generated using pymatgen
data_LiCr2P2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.32555000
_cell_length_b   7.60937100
_cell_length_c   13.89254400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCr2P2O9
_chemical_formula_sum   'Li4 Cr8 P8 O36'
_cell_volume   668.69616548
_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
  Li  Li0  1  0.75000000  0.94651600  0.77064700  1
  Li  Li1  1  0.75000000  0.55348400  0.27064700  1
  Li  Li2  1  0.25000100  0.44651500  0.72935300  1
  Li  Li3  1  0.25000100  0.05348400  0.22935300  1
  Cr  Cr4  1  0.75000000  0.35136100  0.88155300  1
  Cr  Cr5  1  0.25000100  0.64863900  0.11844700  1
  Cr  Cr6  1  0.25000100  0.85136100  0.61844700  1
  Cr  Cr7  1  0.75000000  0.14863900  0.38155300  1
  Cr  Cr8  1  0.50000000  0.00000000  0.00000000  1
  Cr  Cr9  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr10  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr11  1  0.00000000  0.00000000  0.00000000  1
  P  P12  1  0.25000100  0.35140200  0.93532100  1
  P  P13  1  0.75000000  0.64859800  0.06468000  1
  P  P14  1  0.75000000  0.85140200  0.56467900  1
  P  P15  1  0.25000100  0.14859900  0.43532100  1
  P  P16  1  0.75000000  0.39071700  0.69397400  1
  P  P17  1  0.75000000  0.10928300  0.19397400  1
  P  P18  1  0.25000100  0.89071700  0.80602600  1
  P  P19  1  0.25000100  0.60928200  0.30602600  1
  O  O20  1  0.04566000  0.59388200  0.36699100  1
  O  O21  1  0.54565900  0.40611700  0.63300900  1
  O  O22  1  0.95434000  0.09388200  0.13300900  1
  O  O23  1  0.45434000  0.90611800  0.86699100  1
  O  O24  1  0.95434000  0.40611700  0.63300900  1
  O  O25  1  0.45434000  0.59388200  0.36699100  1
  O  O26  1  0.04566000  0.90611800  0.86699100  1
  O  O27  1  0.54565900  0.09388200  0.13300900  1
  O  O28  1  0.25000100  0.33489800  0.48512000  1
  O  O29  1  0.75000000  0.66510300  0.51488000  1
  O  O30  1  0.75000000  0.83489700  0.01487900  1
  O  O31  1  0.25000100  0.16510300  0.98512000  1
  O  O32  1  0.75000000  0.14417900  0.95140600  1
  O  O33  1  0.25000100  0.85582100  0.04859300  1
  O  O34  1  0.25000100  0.64417900  0.54859300  1
  O  O35  1  0.75000000  0.35582200  0.45140700  1
  O  O36  1  0.75000000  0.21701100  0.75522400  1
  O  O37  1  0.25000100  0.78298900  0.24477700  1
  O  O38  1  0.25000100  0.71701100  0.74477600  1
  O  O39  1  0.75000000  0.28299000  0.25522300  1
  O  O40  1  0.44064900  0.13588200  0.36814800  1
  O  O41  1  0.94064900  0.86411800  0.63185200  1
  O  O42  1  0.55935100  0.63588100  0.13185200  1
  O  O43  1  0.05935100  0.36411800  0.86814800  1
  O  O44  1  0.55935100  0.86411800  0.63185200  1
  O  O45  1  0.05935100  0.13588200  0.36814800  1
  O  O46  1  0.44064900  0.36411800  0.86814800  1
  O  O47  1  0.94064900  0.63588100  0.13185200  1
  O  O48  1  0.75000000  0.51141200  0.98480200  1
  O  O49  1  0.25000100  0.02836200  0.72285900  1
  O  O50  1  0.25000100  0.47163700  0.22285900  1
  O  O51  1  0.75000000  0.52836200  0.77714100  1
  O  O52  1  0.75000000  0.98858800  0.48480200  1
  O  O53  1  0.25000100  0.01141200  0.51519800  1
  O  O54  1  0.25000100  0.48858700  0.01519700  1
  O  O55  1  0.75000000  0.97163800  0.27714100  1
