# generated using pymatgen
data_Ni2PO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.18161401
_cell_length_b   6.35960200
_cell_length_c   7.48946801
_cell_angle_alpha   89.99951056
_cell_angle_beta   90.00639230
_cell_angle_gamma   90.00098116
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2PO5
_chemical_formula_sum   'Ni8 P4 O20'
_cell_volume   342.06052991
_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
  Ni  Ni0  1  0.00000500  0.99999400  0.00000200  1.0
  Ni  Ni1  1  0.00000500  0.50000600  0.00000200  1.0
  Ni  Ni2  1  0.14455700  0.25000600  0.72363800  1.0
  Ni  Ni3  1  0.35554400  0.74999500  0.22351400  1.0
  Ni  Ni4  1  0.49998700  0.00000500  0.50000600  1.0
  Ni  Ni5  1  0.49998600  0.49999500  0.50000300  1.0
  Ni  Ni6  1  0.64451100  0.25000600  0.77647300  1.0
  Ni  Ni7  1  0.85544600  0.74999200  0.27637000  1.0
  P  P8  1  0.11910000  0.75000200  0.63805600  1.0
  P  P9  1  0.38089200  0.24999900  0.13804900  1.0
  P  P10  1  0.61911300  0.75000000  0.86194000  1.0
  P  P11  1  0.88089500  0.24999600  0.36194800  1.0
  O  O12  1  0.05508300  0.25000400  0.47453000  1.0
  O  O13  1  0.09881600  0.74998200  0.13877500  1.0
  O  O14  1  0.13166600  0.94281100  0.76672100  1.0
  O  O15  1  0.13166800  0.55719700  0.76672900  1.0
  O  O16  1  0.19900300  0.25000300  0.02098400  1.0
  O  O17  1  0.30105700  0.74999600  0.52100300  1.0
  O  O18  1  0.36835300  0.05713800  0.26670100  1.0
  O  O19  1  0.36836200  0.44285700  0.26670400  1.0
  O  O20  1  0.40113600  0.25000700  0.63871300  1.0
  O  O21  1  0.44487100  0.74999700  0.97450400  1.0
  O  O22  1  0.55513400  0.25000300  0.02548600  1.0
  O  O23  1  0.59883200  0.74999600  0.36128400  1.0
  O  O24  1  0.63163400  0.55714400  0.73328900  1.0
  O  O25  1  0.63164300  0.94286200  0.73329200  1.0
  O  O26  1  0.69892800  0.25000400  0.47899400  1.0
  O  O27  1  0.80099700  0.74999800  0.97901500  1.0
  O  O28  1  0.86833200  0.05718700  0.23328500  1.0
  O  O29  1  0.86833000  0.44280300  0.23327800  1.0
  O  O30  1  0.90121700  0.25001900  0.86121600  1.0
  O  O31  1  0.94489800  0.74999500  0.52549400  1.0