# generated using pymatgen
data_NiPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.34686772
_cell_length_b   7.34686772
_cell_length_c   9.37397300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999746
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiPO4
_chemical_formula_sum   'Ni6 P6 O24'
_cell_volume   438.18628650
_cell_formula_units_Z   6
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
  Ni  Ni0  1  0.93259400  0.54275000  0.96465200  1.0
  Ni  Ni1  1  0.61015600  0.06740600  0.96465200  1.0
  Ni  Ni2  1  0.45725000  0.38984400  0.96465200  1.0
  Ni  Ni3  1  0.38984400  0.45725000  0.46465200  1.0
  Ni  Ni4  1  0.54275000  0.93259400  0.46465200  1.0
  Ni  Ni5  1  0.06740600  0.61015600  0.46465200  1.0
  P  P6  1  0.00000000  0.00000000  0.01440800  1.0
  P  P7  1  0.33333300  0.66666700  0.77474900  1.0
  P  P8  1  0.33333300  0.66666700  0.16376900  1.0
  P  P9  1  0.66666700  0.33333300  0.27474900  1.0
  P  P10  1  0.66666700  0.33333300  0.66376900  1.0
  P  P11  1  0.00000000  0.00000000  0.51440800  1.0
  O  O12  1  0.46913200  0.33785100  0.61599400  1.0
  O  O13  1  0.89411200  0.41983700  0.32509600  1.0
  O  O14  1  0.66214900  0.13128100  0.61599400  1.0
  O  O15  1  0.86871900  0.53086800  0.61599400  1.0
  O  O16  1  0.88087700  0.76915100  0.95734900  1.0
  O  O17  1  0.00000000  0.00000000  0.17645300  1.0
  O  O18  1  0.11912300  0.88827300  0.45734900  1.0
  O  O19  1  0.13128100  0.66214900  0.11599400  1.0
  O  O20  1  0.10588800  0.52572500  0.82509600  1.0
  O  O21  1  0.41983700  0.89411200  0.82509600  1.0
  O  O22  1  0.33333300  0.66666700  0.60400900  1.0
  O  O23  1  0.00000000  0.00000000  0.67645300  1.0
  O  O24  1  0.33333300  0.66666700  0.33642400  1.0
  O  O25  1  0.11172700  0.23084900  0.45734900  1.0
  O  O26  1  0.66666700  0.33333300  0.83642400  1.0
  O  O27  1  0.53086800  0.86871900  0.11599400  1.0
  O  O28  1  0.23084900  0.11172700  0.95734900  1.0
  O  O29  1  0.47427500  0.58016300  0.82509600  1.0
  O  O30  1  0.33785100  0.46913200  0.11599400  1.0
  O  O31  1  0.76915100  0.88087700  0.45734900  1.0
  O  O32  1  0.58016300  0.47427500  0.32509600  1.0
  O  O33  1  0.52572500  0.10588800  0.32509600  1.0
  O  O34  1  0.66666700  0.33333300  0.10400900  1.0
  O  O35  1  0.88827300  0.11912300  0.95734900  1.0