# generated using pymatgen
data_LiCrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.12415500
_cell_length_b   5.01099200
_cell_length_c   13.70880627
_cell_angle_alpha   72.86415648
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrP2O7
_chemical_formula_sum   'Li4 Cr4 P8 O28'
_cell_volume   533.31245431
_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  0.20432900  0.45399200  0.24421900  1
  Li  Li1  1  0.29567100  0.45399200  0.74421900  1
  Li  Li2  1  0.70432900  0.54600800  0.25578100  1
  Li  Li3  1  0.79567100  0.54600800  0.75578100  1
  Cr  Cr4  1  0.14631700  0.85843400  0.87030300  1
  Cr  Cr5  1  0.64631700  0.14156600  0.62969700  1
  Cr  Cr6  1  0.85368300  0.14156600  0.12969700  1
  Cr  Cr7  1  0.35368300  0.85843400  0.37030300  1
  P  P8  1  0.20474400  0.22401600  0.02205500  1
  P  P9  1  0.95827300  0.96019700  0.31929600  1
  P  P10  1  0.79525600  0.77598400  0.97794500  1
  P  P11  1  0.70474400  0.77598400  0.47794500  1
  P  P12  1  0.04172700  0.03980300  0.68070400  1
  P  P13  1  0.45827300  0.03980300  0.18070400  1
  P  P14  1  0.54172700  0.96019700  0.81929600  1
  P  P15  1  0.29525600  0.22401600  0.52205500  1
  O  O16  1  0.59030700  0.72579700  0.39585800  1
  O  O17  1  0.64736900  0.22013100  0.76903000  1
  O  O18  1  0.16943900  0.94693100  0.00138700  1
  O  O19  1  0.36626400  0.04626800  0.83499500  1
  O  O20  1  0.40969300  0.27420300  0.60414200  1
  O  O21  1  0.44246100  0.21926200  0.25495200  1
  O  O22  1  0.85263100  0.22013100  0.26903000  1
  O  O23  1  0.83056100  0.05306900  0.99861300  1
  O  O24  1  0.72255200  0.53219600  0.57508300  1
  O  O25  1  0.14736900  0.77986900  0.73097000  1
  O  O26  1  0.22255200  0.46780400  0.92491700  1
  O  O27  1  0.10981700  0.20362600  0.57043300  1
  O  O28  1  0.13373600  0.04626800  0.33499500  1
  O  O29  1  0.09030700  0.27420300  0.10414200  1
  O  O30  1  0.94246100  0.78073800  0.24504800  1
  O  O31  1  0.05753900  0.21926200  0.75495200  1
  O  O32  1  0.55753900  0.78073800  0.74504800  1
  O  O33  1  0.86626400  0.95373200  0.66500500  1
  O  O34  1  0.60981700  0.79637400  0.92956700  1
  O  O35  1  0.66943900  0.05306900  0.49861300  1
  O  O36  1  0.77744800  0.53219600  0.07508300  1
  O  O37  1  0.90969300  0.72579700  0.89585800  1
  O  O38  1  0.33056100  0.94693100  0.50138700  1
  O  O39  1  0.63373600  0.95373200  0.16500500  1
  O  O40  1  0.27744800  0.46780400  0.42491700  1
  O  O41  1  0.89018300  0.79637400  0.42956700  1
  O  O42  1  0.39018300  0.20362600  0.07043300  1
  O  O43  1  0.35263100  0.77986900  0.23097000  1
