# generated using pymatgen
data_LiNiPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37505000
_cell_length_b   8.41401900
_cell_length_c   16.82235803
_cell_angle_alpha   60.26315166
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiPO4
_chemical_formula_sum   'Li12 Ni12 P12 O48'
_cell_volume   906.42417234
_cell_formula_units_Z   12
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  0.66442500  0.66419600  0.40611400  1
  Li  Li1  1  0.82453000  0.31735400  0.75896000  1
  Li  Li2  1  0.66970300  0.01523800  0.08288300  1
  Li  Li3  1  0.16970300  0.98476200  0.41711700  1
  Li  Li4  1  0.32453000  0.68264600  0.74104000  1
  Li  Li5  1  0.16442500  0.33580400  0.09388600  1
  Li  Li6  1  0.83557500  0.66419600  0.90611400  1
  Li  Li7  1  0.67547000  0.31735400  0.25896000  1
  Li  Li8  1  0.83029700  0.01523800  0.58288300  1
  Li  Li9  1  0.33029700  0.98476200  0.91711700  1
  Li  Li10  1  0.17547000  0.68264600  0.24104000  1
  Li  Li11  1  0.33557500  0.33580400  0.59388600  1
  Ni  Ni12  1  0.94988600  0.31908700  0.92321600  1
  Ni  Ni13  1  0.04673600  0.65741600  0.58625200  1
  Ni  Ni14  1  0.91576200  0.99829400  0.24808800  1
  Ni  Ni15  1  0.41576200  0.00170600  0.25191200  1
  Ni  Ni16  1  0.54673600  0.34258400  0.91374800  1
  Ni  Ni17  1  0.44988600  0.68091300  0.57678400  1
  Ni  Ni18  1  0.55011400  0.31908700  0.42321600  1
  Ni  Ni19  1  0.45326400  0.65741600  0.08625200  1
  Ni  Ni20  1  0.58423800  0.99829400  0.74808800  1
  Ni  Ni21  1  0.08423800  0.00170600  0.75191200  1
  Ni  Ni22  1  0.95326400  0.34258400  0.41374800  1
  Ni  Ni23  1  0.05011400  0.68091300  0.07678400  1
  P  P24  1  0.25762500  0.63748200  0.41210600  1
  P  P25  1  0.23534600  0.31941700  0.77125900  1
  P  P26  1  0.26216000  0.03746700  0.07091500  1
  P  P27  1  0.76216000  0.96253300  0.42908500  1
  P  P28  1  0.73534600  0.68058300  0.72874100  1
  P  P29  1  0.75762500  0.36251800  0.08789400  1
  P  P30  1  0.24237500  0.63748200  0.91210600  1
  P  P31  1  0.26465400  0.31941700  0.27125900  1
  P  P32  1  0.23784000  0.03746700  0.57091500  1
  P  P33  1  0.73784000  0.96253300  0.92908500  1
  P  P34  1  0.76465400  0.68058300  0.22874100  1
  P  P35  1  0.74237500  0.36251800  0.58789400  1
  O  O36  1  0.56454700  0.43752000  0.60508000  1
  O  O37  1  0.90340600  0.42209100  0.62524300  1
  O  O38  1  0.76034700  0.11160600  0.95828500  1
  O  O39  1  0.05425200  0.26805000  0.82471900  1
  O  O40  1  0.39289200  0.26053800  0.83975700  1
  O  O41  1  0.74999400  0.79439500  0.27992100  1
  O  O42  1  0.23883300  0.58206700  0.51546600  1
  O  O43  1  0.27163100  0.93016300  0.17826000  1
  O  O44  1  0.44170700  0.14273400  0.03521400  1
  O  O45  1  0.23965500  0.52556200  0.69532500  1
  O  O46  1  0.26669300  0.85187700  0.35831100  1
  O  O47  1  0.10294400  0.17403600  0.03965200  1
  O  O48  1  0.60294400  0.82596400  0.46034800  1
  O  O49  1  0.76669300  0.14812300  0.14168900  1
  O  O50  1  0.73965500  0.47443800  0.80467500  1
  O  O51  1  0.94170700  0.85726600  0.46478600  1
  O  O52  1  0.77163100  0.06983700  0.32174000  1
  O  O53  1  0.73883300  0.41793300  0.98453400  1
  O  O54  1  0.89289200  0.73946200  0.66024300  1
  O  O55  1  0.24999400  0.20560500  0.22007900  1
  O  O56  1  0.55425200  0.73195000  0.67528100  1
  O  O57  1  0.26034700  0.88839400  0.54171500  1
  O  O58  1  0.40340600  0.57790900  0.87475700  1
  O  O59  1  0.06454700  0.56248000  0.89492000  1
  O  O60  1  0.93545300  0.43752000  0.10508000  1
  O  O61  1  0.59659400  0.42209100  0.12524300  1
  O  O62  1  0.73965300  0.11160600  0.45828500  1
  O  O63  1  0.44574800  0.26805000  0.32471900  1
  O  O64  1  0.75000600  0.79439500  0.77992100  1
  O  O65  1  0.10710800  0.26053800  0.33975700  1
  O  O66  1  0.26116700  0.58206700  0.01546600  1
  O  O67  1  0.22836900  0.93016300  0.67826000  1
  O  O68  1  0.05829300  0.14273400  0.53521400  1
  O  O69  1  0.26034500  0.52556200  0.19532500  1
  O  O70  1  0.23330700  0.85187700  0.85831100  1
  O  O71  1  0.39705600  0.17403600  0.53965200  1
  O  O72  1  0.89705600  0.82596400  0.96034800  1
  O  O73  1  0.73330700  0.14812300  0.64168900  1
  O  O74  1  0.76034500  0.47443800  0.30467500  1
  O  O75  1  0.55829300  0.85726600  0.96478600  1
  O  O76  1  0.72836900  0.06983700  0.82174000  1
  O  O77  1  0.76116700  0.41793300  0.48453400  1
  O  O78  1  0.25000600  0.20560500  0.72007900  1
  O  O79  1  0.60710800  0.73946200  0.16024300  1
  O  O80  1  0.94574800  0.73195000  0.17528100  1
  O  O81  1  0.23965300  0.88839400  0.04171500  1
  O  O82  1  0.09659400  0.57790900  0.37475700  1
  O  O83  1  0.43545300  0.56248000  0.39492000  1
