# generated using pymatgen
data_LiCu(PO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.27506200
_cell_length_b   14.20953300
_cell_length_c   14.46321042
_cell_angle_alpha   73.25707940
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCu(PO3)2
_chemical_formula_sum   'Li8 Cu8 P16 O48'
_cell_volume   1038.14824268
_cell_formula_units_Z   8
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  0.21863300  0.15394900  0.08379900  1
  Li  Li1  1  0.85701700  0.16186500  0.62054600  1
  Li  Li2  1  0.35701700  0.33813500  0.37945400  1
  Li  Li3  1  0.71863300  0.34605100  0.91620100  1
  Li  Li4  1  0.28136700  0.65394900  0.08379900  1
  Li  Li5  1  0.64298300  0.66186500  0.62054600  1
  Li  Li6  1  0.14298300  0.83813500  0.37945400  1
  Li  Li7  1  0.78136700  0.84605100  0.91620100  1
  Cu  Cu8  1  0.31325300  0.11303500  0.44699900  1
  Cu  Cu9  1  0.67380000  0.09861900  0.94630200  1
  Cu  Cu10  1  0.17380000  0.40138100  0.05369800  1
  Cu  Cu11  1  0.81325300  0.38696500  0.55300100  1
  Cu  Cu12  1  0.18674700  0.61303500  0.44699900  1
  Cu  Cu13  1  0.82620000  0.59861900  0.94630200  1
  Cu  Cu14  1  0.32620000  0.90138100  0.05369800  1
  Cu  Cu15  1  0.68674700  0.88696500  0.55300100  1
  P  P16  1  0.71706400  0.00642500  0.35841100  1
  P  P17  1  0.26332400  0.00027800  0.85112700  1
  P  P18  1  0.82536300  0.21343200  0.34124300  1
  P  P19  1  0.65856700  0.29735000  0.13671400  1
  P  P20  1  0.15856700  0.20265000  0.86328600  1
  P  P21  1  0.32536300  0.28656800  0.65875700  1
  P  P22  1  0.76332400  0.49972200  0.14887300  1
  P  P23  1  0.78293600  0.50642500  0.35841100  1
  P  P24  1  0.21706400  0.49357500  0.64158900  1
  P  P25  1  0.23667600  0.50027800  0.85112700  1
  P  P26  1  0.67463700  0.71343200  0.34124300  1
  P  P27  1  0.84143300  0.79735000  0.13671400  1
  P  P28  1  0.34143300  0.70265000  0.86328600  1
  P  P29  1  0.17463700  0.78656800  0.65875700  1
  P  P30  1  0.73667600  0.99972200  0.14887300  1
  P  P31  1  0.28293600  0.99357500  0.64158900  1
  O  O32  1  0.87646100  0.07876000  0.07242500  1
  O  O33  1  0.80339800  0.02167100  0.24810700  1
  O  O34  1  0.43681400  0.02080000  0.36502700  1
  O  O35  1  0.87985400  0.09618300  0.37654600  1
  O  O36  1  0.15602900  0.08623200  0.57993900  1
  O  O37  1  0.54379800  0.01292400  0.86289100  1
  O  O38  1  0.82580500  0.23241000  0.22515900  1
  O  O39  1  0.40340600  0.25310500  0.13218200  1
  O  O40  1  0.05007000  0.26209800  0.36980400  1
  O  O41  1  0.56485500  0.22919600  0.37577000  1
  O  O42  1  0.11080400  0.10311400  0.83176100  1
  O  O43  1  0.83162600  0.31875900  0.04988400  1
  O  O44  1  0.33162600  0.18124100  0.95011600  1
  O  O45  1  0.61080400  0.39688600  0.16823900  1
  O  O46  1  0.06485500  0.27080400  0.62423000  1
  O  O47  1  0.55007000  0.23790200  0.63019600  1
  O  O48  1  0.90340600  0.24689500  0.86781800  1
  O  O49  1  0.32580500  0.26759000  0.77484100  1
  O  O50  1  0.04379800  0.48707600  0.13710900  1
  O  O51  1  0.65602900  0.41376800  0.42006100  1
  O  O52  1  0.62353900  0.57876000  0.07242500  1
  O  O53  1  0.37985400  0.40381700  0.62345400  1
  O  O54  1  0.69660200  0.52167100  0.24810700  1
  O  O55  1  0.93681400  0.47920000  0.63497300  1
  O  O56  1  0.06318600  0.52080000  0.36502700  1
  O  O57  1  0.30339800  0.47832900  0.75189300  1
  O  O58  1  0.62014600  0.59618300  0.37654600  1
  O  O59  1  0.37646100  0.42124000  0.92757500  1
  O  O60  1  0.34397100  0.58623200  0.57993900  1
  O  O61  1  0.95620200  0.51292400  0.86289100  1
  O  O62  1  0.67419500  0.73241000  0.22515900  1
  O  O63  1  0.09659400  0.75310500  0.13218200  1
  O  O64  1  0.44993000  0.76209800  0.36980400  1
  O  O65  1  0.93514500  0.72919600  0.37577000  1
  O  O66  1  0.38919600  0.60311400  0.83176100  1
  O  O67  1  0.66837400  0.81875900  0.04988400  1
  O  O68  1  0.16837400  0.68124100  0.95011600  1
  O  O69  1  0.88919600  0.89688600  0.16823900  1
  O  O70  1  0.43514500  0.77080400  0.62423000  1
  O  O71  1  0.94993000  0.73790200  0.63019600  1
  O  O72  1  0.59659400  0.74689500  0.86781800  1
  O  O73  1  0.17419500  0.76759000  0.77484100  1
  O  O74  1  0.45620200  0.98707600  0.13710900  1
  O  O75  1  0.84397100  0.91376800  0.42006100  1
  O  O76  1  0.12014600  0.90381700  0.62345400  1
  O  O77  1  0.56318600  0.97920000  0.63497300  1
  O  O78  1  0.19660200  0.97832900  0.75189300  1
  O  O79  1  0.12353900  0.92124000  0.92757500  1
