# generated using pymatgen
data_LiNi4(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.51123724
_cell_length_b   8.51123724
_cell_length_c   6.42161334
_cell_angle_alpha   72.75747298
_cell_angle_beta   72.75747298
_cell_angle_gamma   93.95658068
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi4(PO4)3
_chemical_formula_sum   'Li2 Ni8 P6 O24'
_cell_volume   417.99452824
_cell_formula_units_Z   2
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  0.98349500  0.02097300  0.74879400  1
  Li  Li1  1  0.02097300  0.98349500  0.24879400  1
  Ni  Ni2  1  0.94503000  0.62522300  0.63075900  1
  Ni  Ni3  1  0.62522300  0.94503000  0.13075900  1
  Ni  Ni4  1  0.26157000  0.73635700  0.75252400  1
  Ni  Ni5  1  0.50124600  0.51733800  0.52312700  1
  Ni  Ni6  1  0.73635700  0.26157000  0.25252400  1
  Ni  Ni7  1  0.51733800  0.50124600  0.02312700  1
  Ni  Ni8  1  0.37572400  0.05831500  0.86532700  1
  Ni  Ni9  1  0.05831500  0.37572400  0.36532700  1
  P  P10  1  0.66529300  0.87721800  0.62786500  1
  P  P11  1  0.87721800  0.66529300  0.12786500  1
  P  P12  1  0.70262100  0.29909900  0.75078700  1
  P  P13  1  0.29909900  0.70262100  0.25078700  1
  P  P14  1  0.12159600  0.33803200  0.86934600  1
  P  P15  1  0.33803200  0.12159600  0.36934600  1
  O  O16  1  0.60065700  0.95421800  0.81971300  1
  O  O17  1  0.84616200  0.84532700  0.60034600  1
  O  O18  1  0.95421800  0.60065700  0.31971300  1
  O  O19  1  0.84532700  0.84616200  0.10034600  1
  O  O20  1  0.33128700  0.99489800  0.60439500  1
  O  O21  1  0.53579400  0.71042400  0.69605200  1
  O  O22  1  0.72187700  0.47708100  0.77368500  1
  O  O23  1  0.99489800  0.33128700  0.10439500  1
  O  O24  1  0.73362000  0.18517700  0.96703900  1
  O  O25  1  0.81409700  0.26816800  0.53265900  1
  O  O26  1  0.71042400  0.53579400  0.19605200  1
  O  O27  1  0.47708100  0.72187700  0.27368500  1
  O  O28  1  0.52348900  0.28598700  0.73220400  1
  O  O29  1  0.28215900  0.47182700  0.80470200  1
  O  O30  1  0.18517700  0.73362000  0.46703900  1
  O  O31  1  0.26816800  0.81409700  0.03265900  1
  O  O32  1  0.00327400  0.66977300  0.89450800  1
  O  O33  1  0.28598700  0.52348900  0.23220400  1
  O  O34  1  0.47182700  0.28215900  0.30470200  1
  O  O35  1  0.66977300  0.00327400  0.39450800  1
  O  O36  1  0.15677100  0.15778500  0.89714500  1
  O  O37  1  0.04288900  0.39806700  0.67824600  1
  O  O38  1  0.15778400  0.15677100  0.39714500  1
  O  O39  1  0.39806700  0.04288900  0.17824600  1
