# generated using pymatgen
data_MnNiP2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.23257393
_cell_length_b   7.74396770
_cell_length_c   13.86968482
_cell_angle_alpha   90.05062430
_cell_angle_beta   89.81177250
_cell_angle_gamma   90.10046274
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnNiP2O9
_chemical_formula_sum   'Mn4 Ni4 P8 O36'
_cell_volume   669.41337458
_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
  Mn  Mn0  1  0.74971600  0.35245800  0.88012800  1.0
  Mn  Mn1  1  0.25028900  0.64767500  0.11984600  1.0
  Mn  Mn2  1  0.24950200  0.85388200  0.62021800  1.0
  Mn  Mn3  1  0.75049300  0.14625400  0.37986900  1.0
  Ni  Ni4  1  0.49983000  0.00025000  0.00020500  1.0
  Ni  Ni5  1  0.50017200  0.49968800  0.50000400  1.0
  Ni  Ni6  1  0.99987600  0.49968000  0.50001200  1.0
  Ni  Ni7  1  0.99991900  0.00019300  0.00014900  1.0
  P  P8  1  0.24929000  0.34981100  0.93795400  1.0
  P  P9  1  0.75068000  0.65058100  0.06187300  1.0
  P  P10  1  0.74979800  0.84941000  0.56169900  1.0
  P  P11  1  0.25021600  0.15030600  0.43799500  1.0
  P  P12  1  0.74975400  0.39097900  0.69159500  1.0
  P  P13  1  0.25036800  0.60889800  0.30849000  1.0
  P  P14  1  0.24955400  0.89273500  0.80881900  1.0
  P  P15  1  0.75040200  0.10724100  0.19151300  1.0
  O  O16  1  0.04595800  0.60113500  0.37015200  1.0
  O  O17  1  0.54593000  0.39845400  0.63033000  1.0
  O  O18  1  0.95519600  0.09924200  0.13007700  1.0
  O  O19  1  0.45347600  0.89978200  0.87006800  1.0
  O  O20  1  0.95412200  0.39845200  0.62997300  1.0
  O  O21  1  0.45424600  0.60124800  0.36979200  1.0
  O  O22  1  0.04497300  0.90019600  0.87048300  1.0
  O  O23  1  0.54644000  0.10075000  0.13034300  1.0
  O  O24  1  0.24991900  0.33604400  0.48123100  1.0
  O  O25  1  0.75013800  0.66352100  0.51871300  1.0
  O  O26  1  0.75102300  0.83622100  0.01859300  1.0
  O  O27  1  0.24867800  0.16423100  0.98137900  1.0
  O  O28  1  0.74892300  0.14859800  0.95256900  1.0
  O  O29  1  0.25091900  0.85182000  0.04766000  1.0
  O  O30  1  0.24993000  0.64923400  0.54827400  1.0
  O  O31  1  0.75006800  0.35054700  0.45167500  1.0
  O  O32  1  0.75007700  0.22590400  0.75797500  1.0
  O  O33  1  0.24990500  0.77406300  0.24216200  1.0
  O  O34  1  0.24801900  0.72754400  0.74236700  1.0
  O  O35  1  0.75211300  0.27247500  0.25787600  1.0
  O  O36  1  0.44672700  0.13411000  0.37062600  1.0
  O  O37  1  0.94553600  0.86694100  0.62885200  1.0
  O  O38  1  0.55370700  0.63514500  0.12917100  1.0
  O  O39  1  0.05375800  0.36577100  0.87059600  1.0
  O  O40  1  0.55333900  0.86644600  0.62900700  1.0
  O  O41  1  0.05439800  0.13369100  0.37078900  1.0
  O  O42  1  0.44628000  0.36510200  0.87070700  1.0
  O  O43  1  0.94632100  0.63453100  0.12918200  1.0
  O  O44  1  0.75006000  0.96625800  0.27280400  1.0
  O  O45  1  0.24984500  0.03366100  0.72750900  1.0
  O  O46  1  0.25030100  0.46773200  0.22695100  1.0
  O  O47  1  0.74983900  0.53205600  0.77296400  1.0
  O  O48  1  0.74988600  0.98583200  0.48319100  1.0
  O  O49  1  0.25007000  0.01270500  0.51583900  1.0
  O  O50  1  0.24978200  0.48744200  0.01597600  1.0
  O  O51  1  0.75023500  0.51307400  0.98377800  1.0