# generated using pymatgen
data_LiNi3P2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19974900
_cell_length_b   8.98882700
_cell_length_c   15.57716500
_cell_angle_alpha   89.99937839
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi3P2
_chemical_formula_sum   'Li14 Ni42 P28'
_cell_volume   1008.11203248
_cell_formula_units_Z   14
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  0.24357000  0.50008800  0.83408700  1
  Li  Li1  1  0.75643000  0.50008800  0.83408700  1
  Li  Li2  1  0.50000000  0.32941700  0.55160200  1
  Li  Li3  1  0.00000000  0.00842000  0.88791200  1
  Li  Li4  1  0.50000000  0.99882600  0.66853600  1
  Li  Li5  1  0.00000000  0.00025800  0.66379400  1
  Li  Li6  1  0.25352900  0.99858600  0.33411300  1
  Li  Li7  1  0.74647100  0.99858600  0.33411300  1
  Li  Li8  1  0.50000000  0.83230900  0.05006500  1
  Li  Li9  1  0.00000000  0.66069600  0.55737200  1
  Li  Li10  1  0.00000000  0.51021500  0.38860300  1
  Li  Li11  1  0.50000000  0.49871700  0.16769400  1
  Li  Li12  1  0.00000000  0.49958900  0.16706600  1
  Li  Li13  1  0.50000000  0.16373200  0.06033100  1
  Ni  Ni14  1  0.25828500  0.80179900  0.91760200  1
  Ni  Ni15  1  0.74171500  0.80179900  0.91760200  1
  Ni  Ni16  1  0.50000000  0.75650000  0.80496600  1
  Ni  Ni17  1  0.00000000  0.75857900  0.80455500  1
  Ni  Ni18  1  0.24603200  0.47527500  0.64095800  1
  Ni  Ni19  1  0.75396800  0.47527500  0.64095800  1
  Ni  Ni20  1  0.00000000  0.41526900  0.97491800  1
  Ni  Ni21  1  0.50000000  0.41138300  0.97811700  1
  Ni  Ni22  1  0.50000000  0.32573900  0.71924800  1
  Ni  Ni23  1  0.00000000  0.32782700  0.71531500  1
  Ni  Ni24  1  0.00000000  0.35221700  0.53849300  1
  Ni  Ni25  1  0.25554500  0.29943200  0.41893800  1
  Ni  Ni26  1  0.74445500  0.29943200  0.41893800  1
  Ni  Ni27  1  0.00000000  0.25891900  0.30703400  1
  Ni  Ni28  1  0.50000000  0.25390300  0.30610900  1
  Ni  Ni29  1  0.24287300  0.22358500  0.94142500  1
  Ni  Ni30  1  0.75712700  0.22358500  0.94142500  1
  Ni  Ni31  1  0.25021900  0.15575000  0.78575900  1
  Ni  Ni32  1  0.74978100  0.15575000  0.78575900  1
  Ni  Ni33  1  0.25126400  0.09832800  0.52967100  1
  Ni  Ni34  1  0.74873600  0.09832800  0.52967100  1
  Ni  Ni35  1  0.50000000  0.01924400  0.90411600  1
  Ni  Ni36  1  0.24703500  0.97764400  0.14192800  1
  Ni  Ni37  1  0.75296500  0.97764400  0.14192800  1
  Ni  Ni38  1  0.50000000  0.90753200  0.47684000  1
  Ni  Ni39  1  0.00000000  0.91482300  0.47749500  1
  Ni  Ni40  1  0.50000000  0.82697600  0.21625200  1
  Ni  Ni41  1  0.00000000  0.82775900  0.21731400  1
  Ni  Ni42  1  0.00000000  0.83901600  0.04071200  1
  Ni  Ni43  1  0.25381900  0.74279400  0.68496600  1
  Ni  Ni44  1  0.74618100  0.74279400  0.68496600  1
  Ni  Ni45  1  0.25098600  0.72449300  0.43937500  1
  Ni  Ni46  1  0.74901400  0.72449300  0.43937500  1
  Ni  Ni47  1  0.25028000  0.65522800  0.28410300  1
  Ni  Ni48  1  0.74972000  0.65522800  0.28410300  1
  Ni  Ni49  1  0.50000000  0.64632600  0.56183700  1
  Ni  Ni50  1  0.24654400  0.59997400  0.02855800  1
  Ni  Ni51  1  0.75345600  0.59997400  0.02855800  1
  Ni  Ni52  1  0.50000000  0.51339200  0.39237000  1
  Ni  Ni53  1  0.24919000  0.24408500  0.18655500  1
  Ni  Ni54  1  0.75081000  0.24408500  0.18655500  1
  Ni  Ni55  1  0.00000000  0.15444400  0.06285600  1
  P  P56  1  0.50000000  0.64325300  0.93669600  1
  P  P57  1  0.00000000  0.65555900  0.93810000  1
  P  P58  1  0.50000000  0.57865900  0.70409400  1
  P  P59  1  0.00000000  0.58263600  0.70832600  1
  P  P60  1  0.25745800  0.50272300  0.49928000  1
  P  P61  1  0.74254200  0.50272300  0.49928000  1
  P  P62  1  0.50000000  0.26431000  0.85823300  1
  P  P63  1  0.00000000  0.27315300  0.85302100  1
  P  P64  1  0.24969200  0.22551200  0.65009900  1
  P  P65  1  0.75030800  0.22551200  0.65009900  1
  P  P66  1  0.50000000  0.14167500  0.43744100  1
  P  P67  1  0.00000000  0.15554100  0.44078300  1
  P  P68  1  0.50000000  0.07870200  0.20749700  1
  P  P69  1  0.00000000  0.08528300  0.20725500  1
  P  P70  1  0.24336400  0.00091700  0.00158800  1
  P  P71  1  0.75663600  0.00091700  0.00158800  1
  P  P72  1  0.25258600  0.91080300  0.78826600  1
  P  P73  1  0.74741400  0.91080300  0.78826600  1
  P  P74  1  0.25179100  0.85969200  0.56113100  1
  P  P75  1  0.74820900  0.85969200  0.56113100  1
  P  P76  1  0.50000000  0.76395800  0.35346000  1
  P  P77  1  0.00000000  0.77280100  0.35582400  1
  P  P78  1  0.24737000  0.72747600  0.14885800  1
  P  P79  1  0.75263000  0.72747600  0.14885800  1
  P  P80  1  0.25324200  0.41072100  0.28960900  1
  P  P81  1  0.74675800  0.41072100  0.28960900  1
  P  P82  1  0.24566900  0.36131600  0.06200700  1
  P  P83  1  0.75433100  0.36131600  0.06200700  1
