# generated using pymatgen
data_LiCu4(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40294500
_cell_length_b   8.93328800
_cell_length_c   14.89811217
_cell_angle_alpha   89.89261250
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCu4(PO4)3
_chemical_formula_sum   'Li4 Cu16 P12 O48'
_cell_volume   852.16086126
_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  0.00000000  0.16058100  0.48360600  1
  Li  Li1  1  0.50000000  0.33896000  0.32061000  1
  Li  Li2  1  0.50000000  0.33338000  0.98711700  1
  Li  Li3  1  0.00000000  0.64339500  0.01604800  1
  Cu  Cu4  1  0.75092500  0.01797500  0.66391400  1
  Cu  Cu5  1  0.24204300  0.00816700  0.00220200  1
  Cu  Cu6  1  0.24382200  0.00332600  0.33133800  1
  Cu  Cu7  1  0.24907500  0.01797500  0.66391400  1
  Cu  Cu8  1  0.75795700  0.00816700  0.00220200  1
  Cu  Cu9  1  0.75617800  0.00332600  0.33133800  1
  Cu  Cu10  1  0.24355200  0.49131100  0.16433000  1
  Cu  Cu11  1  0.24473500  0.48103100  0.82955400  1
  Cu  Cu12  1  0.75644800  0.49131100  0.16433000  1
  Cu  Cu13  1  0.75526500  0.48103100  0.82955400  1
  Cu  Cu14  1  0.24492100  0.49015000  0.49321600  1
  Cu  Cu15  1  0.75507900  0.49015000  0.49321600  1
  Cu  Cu16  1  0.00000000  0.64061000  0.68181200  1
  Cu  Cu17  1  0.50000000  0.86287800  0.85413100  1
  Cu  Cu18  1  0.50000000  0.85094000  0.18544800  1
  Cu  Cu19  1  0.50000000  0.85938300  0.51717200  1
  P  P20  1  0.50000000  0.18001100  0.15250800  1
  P  P21  1  0.50000000  0.17764000  0.48556500  1
  P  P22  1  0.50000000  0.17949400  0.81641000  1
  P  P23  1  0.00000000  0.31915700  0.31814900  1
  P  P24  1  0.00000000  0.32680700  0.64782000  1
  P  P25  1  0.00000000  0.31707000  0.98711600  1
  P  P26  1  0.50000000  0.68350400  0.35384000  1
  P  P27  1  0.50000000  0.68462200  0.68229500  1
  P  P28  1  0.50000000  0.68526700  0.01744200  1
  P  P29  1  0.00000000  0.81278400  0.17515900  1
  P  P30  1  0.00000000  0.81204500  0.84696000  1
  P  P31  1  0.00000000  0.81884900  0.51047500  1
  O  O32  1  0.29989500  0.12192900  0.10825900  1
  O  O33  1  0.29881300  0.12056900  0.77316000  1
  O  O34  1  0.29837600  0.11772300  0.44076100  1
  O  O35  1  0.70118700  0.12056900  0.77316000  1
  O  O36  1  0.70162400  0.11772300  0.44076100  1
  O  O37  1  0.70010500  0.12192900  0.10825900  1
  O  O38  1  0.50000000  0.13994100  0.25386500  1
  O  O39  1  0.50000000  0.12603500  0.58414300  1
  O  O40  1  0.50000000  0.13076700  0.91728300  1
  O  O41  1  0.00000000  0.14189700  0.97416000  1
  O  O42  1  0.00000000  0.14202500  0.30660800  1
  O  O43  1  0.00000000  0.14919400  0.63275800  1
  O  O44  1  0.50000000  0.35828500  0.13676000  1
  O  O45  1  0.50000000  0.35222600  0.46591600  1
  O  O46  1  0.50000000  0.35664800  0.80940400  1
  O  O47  1  0.00000000  0.37196000  0.08452600  1
  O  O48  1  0.00000000  0.35592000  0.41964300  1
  O  O49  1  0.00000000  0.37770200  0.74651400  1
  O  O50  1  0.20208300  0.37930900  0.27482600  1
  O  O51  1  0.20035400  0.38246900  0.60183800  1
  O  O52  1  0.20196000  0.37648300  0.94172000  1
  O  O53  1  0.79964600  0.38246900  0.60183800  1
  O  O54  1  0.79804000  0.37648300  0.94172000  1
  O  O55  1  0.79791700  0.37930900  0.27482600  1
  O  O56  1  0.30169200  0.61602900  0.05773400  1
  O  O57  1  0.30068700  0.61938200  0.39451700  1
  O  O58  1  0.69830800  0.61602900  0.05773400  1
  O  O59  1  0.69931300  0.61938200  0.39451700  1
  O  O60  1  0.30146900  0.61376500  0.72428900  1
  O  O61  1  0.69853100  0.61376500  0.72428900  1
  O  O62  1  0.50000000  0.65972000  0.24995200  1
  O  O63  1  0.50000000  0.66522600  0.91409300  1
  O  O64  1  0.50000000  0.66344300  0.57971100  1
  O  O65  1  0.00000000  0.63843200  0.19000700  1
  O  O66  1  0.00000000  0.63932600  0.86957000  1
  O  O67  1  0.00000000  0.64523900  0.53426400  1
  O  O68  1  0.50000000  0.85751700  0.70699800  1
  O  O69  1  0.50000000  0.86142600  0.03936400  1
  O  O70  1  0.50000000  0.86206700  0.37114800  1
  O  O71  1  0.00000000  0.86244800  0.41243300  1
  O  O72  1  0.00000000  0.85040900  0.07447100  1
  O  O73  1  0.00000000  0.83684500  0.74403300  1
  O  O74  1  0.80138200  0.87915300  0.22158200  1
  O  O75  1  0.80311800  0.88387900  0.89027400  1
  O  O76  1  0.19861800  0.87915300  0.22158200  1
  O  O77  1  0.19688200  0.88387900  0.89027400  1
  O  O78  1  0.80223300  0.88467300  0.55928600  1
  O  O79  1  0.19776700  0.88467300  0.55928600  1
