# generated using pymatgen
data_LiCrPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04002600
_cell_length_b   7.60206400
_cell_length_c   7.76738100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrPO5
_chemical_formula_sum   'Li4 Cr4 P4 O20'
_cell_volume   356.65222520
_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  0.64006700  0.16413500  1
  Li  Li1  1  0.25000000  0.85993300  0.66413500  1
  Li  Li2  1  0.75000000  0.14006700  0.33586500  1
  Li  Li3  1  0.25000000  0.35993300  0.83586500  1
  Cr  Cr4  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr5  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr6  1  0.50000000  0.00000000  0.00000000  1
  Cr  Cr7  1  0.00000000  0.00000000  0.00000000  1
  P  P8  1  0.25000000  0.63991000  0.16579000  1
  P  P9  1  0.75000000  0.86009000  0.66579000  1
  P  P10  1  0.25000000  0.13991000  0.33421000  1
  P  P11  1  0.75000000  0.36009000  0.83421000  1
  O  O12  1  0.75000000  0.49914700  0.96941800  1
  O  O13  1  0.25000000  0.61299400  0.58912400  1
  O  O14  1  0.03924700  0.63337300  0.28300400  1
  O  O15  1  0.46075300  0.63337300  0.28300400  1
  O  O16  1  0.75000000  0.66876100  0.57990500  1
  O  O17  1  0.25000000  0.83123900  0.07990500  1
  O  O18  1  0.53924700  0.86662700  0.78300400  1
  O  O19  1  0.96075300  0.86662700  0.78300400  1
  O  O20  1  0.75000000  0.88700600  0.08912400  1
  O  O21  1  0.25000000  0.00085300  0.46941800  1
  O  O22  1  0.75000000  0.99914700  0.53058200  1
  O  O23  1  0.25000000  0.11299400  0.91087600  1
  O  O24  1  0.03924700  0.13337300  0.21699600  1
  O  O25  1  0.46075300  0.13337300  0.21699600  1
  O  O26  1  0.75000000  0.16876100  0.92009500  1
  O  O27  1  0.25000000  0.33123900  0.42009500  1
  O  O28  1  0.53924700  0.36662700  0.71699600  1
  O  O29  1  0.96075300  0.36662700  0.71699600  1
  O  O30  1  0.75000000  0.38700600  0.41087600  1
  O  O31  1  0.25000000  0.50085300  0.03058200  1
