# generated using pymatgen
data_NiSnP2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43853700
_cell_length_b   7.94293100
_cell_length_c   14.16812300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiSnP2O9
_chemical_formula_sum   'Ni4 Sn4 P8 O36'
_cell_volume   724.56992583
_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  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni1  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni2  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni3  1  0.00000000  0.50000000  0.50000000  1.0
  Sn  Sn4  1  0.75000000  0.84941400  0.37840300  1.0
  Sn  Sn5  1  0.25000000  0.15058600  0.62159700  1.0
  Sn  Sn6  1  0.25000000  0.34941400  0.12159700  1.0
  Sn  Sn7  1  0.75000000  0.65058600  0.87840300  1.0
  P  P8  1  0.25000000  0.84636000  0.43661200  1.0
  P  P9  1  0.75000000  0.15364000  0.56338800  1.0
  P  P10  1  0.75000000  0.34636000  0.06338800  1.0
  P  P11  1  0.25000000  0.65364000  0.93661200  1.0
  P  P12  1  0.75000000  0.89325400  0.18278400  1.0
  P  P13  1  0.25000000  0.10674600  0.81721600  1.0
  P  P14  1  0.25000000  0.39325400  0.31721600  1.0
  P  P15  1  0.75000000  0.60674600  0.68278400  1.0
  O  O16  1  0.04837000  0.09604900  0.87662100  1.0
  O  O17  1  0.54837000  0.90395100  0.12337900  1.0
  O  O18  1  0.95163000  0.59604900  0.62337900  1.0
  O  O19  1  0.45163000  0.40395100  0.37662100  1.0
  O  O20  1  0.95163000  0.90395100  0.12337900  1.0
  O  O21  1  0.45163000  0.09604900  0.87662100  1.0
  O  O22  1  0.04837000  0.40395100  0.37662100  1.0
  O  O23  1  0.54837000  0.59604900  0.62337900  1.0
  O  O24  1  0.25000000  0.83425800  0.97806400  1.0
  O  O25  1  0.75000000  0.16574200  0.02193600  1.0
  O  O26  1  0.75000000  0.33425800  0.52193600  1.0
  O  O27  1  0.25000000  0.66574200  0.47806400  1.0
  O  O28  1  0.75000000  0.63145800  0.45553100  1.0
  O  O29  1  0.25000000  0.36854200  0.54446900  1.0
  O  O30  1  0.25000000  0.13145800  0.04446900  1.0
  O  O31  1  0.75000000  0.86854200  0.95553100  1.0
  O  O32  1  0.75000000  0.72658800  0.24134000  1.0
  O  O33  1  0.25000000  0.27341200  0.75866000  1.0
  O  O34  1  0.25000000  0.22658800  0.25866000  1.0
  O  O35  1  0.75000000  0.77341200  0.74134000  1.0
  O  O36  1  0.43898700  0.63216800  0.87048800  1.0
  O  O37  1  0.93898700  0.36783200  0.12951200  1.0
  O  O38  1  0.56101300  0.13216800  0.62951200  1.0
  O  O39  1  0.06101300  0.86783200  0.37048800  1.0
  O  O40  1  0.56101300  0.36783200  0.12951200  1.0
  O  O41  1  0.06101300  0.63216800  0.87048800  1.0
  O  O42  1  0.43898700  0.86783200  0.37048800  1.0
  O  O43  1  0.93898700  0.13216800  0.62951200  1.0
  O  O44  1  0.75000000  0.46866800  0.76205000  1.0
  O  O45  1  0.25000000  0.53133200  0.23795000  1.0
  O  O46  1  0.25000000  0.96866800  0.73795000  1.0
  O  O47  1  0.75000000  0.03133200  0.26205000  1.0
  O  O48  1  0.75000000  0.47783600  0.98493000  1.0
  O  O49  1  0.25000000  0.52216400  0.01507000  1.0
  O  O50  1  0.25000000  0.97783600  0.51507000  1.0
  O  O51  1  0.75000000  0.02216400  0.48493000  1.0