# generated using pymatgen
data_MgCo4(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01004462
_cell_length_b   8.20324462
_cell_length_c   9.52176951
_cell_angle_alpha   90.88376842
_cell_angle_beta   108.67885249
_cell_angle_gamma   90.22187162
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCo4(P2O7)4
_chemical_formula_sum   'Mg1 Co4 P8 O28'
_cell_volume   518.62598707
_cell_formula_units_Z   1
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
  Mg  Mg0  1  0.08408100  0.06505200  0.58063600  1.0
  Co  Co1  1  0.73319100  0.77677500  0.01574200  1.0
  Co  Co2  1  0.70955700  0.72738200  0.50946700  1.0
  Co  Co3  1  0.29306200  0.31169100  0.47520600  1.0
  Co  Co4  1  0.28266800  0.22992800  0.99749500  1.0
  P  P5  1  0.52569600  0.06919200  0.80470500  1.0
  P  P6  1  0.46896200  0.92289400  0.22291600  1.0
  P  P7  1  0.53895700  0.42391700  0.28324900  1.0
  P  P8  1  0.92370900  0.96661500  0.79977000  1.0
  P  P9  1  0.07808100  0.45917700  0.70408200  1.0
  P  P10  1  0.07353400  0.04568900  0.21308100  1.0
  P  P11  1  0.48251200  0.57373800  0.71504300  1.0
  P  P12  1  0.93161800  0.55227900  0.30072900  1.0
  O  O13  1  0.51980900  0.59177900  0.35007500  1.0
  O  O14  1  0.88509500  0.61860000  0.14460200  1.0
  O  O15  1  0.87096100  0.96062000  0.16086400  1.0
  O  O16  1  0.91416500  0.68516700  0.41138400  1.0
  O  O17  1  0.11492800  0.39950100  0.86128700  1.0
  O  O18  1  0.11892400  0.06710300  0.83510200  1.0
  O  O19  1  0.09261300  0.31645000  0.59788200  1.0
  O  O20  1  0.24558500  0.59423900  0.69957300  1.0
  O  O21  1  0.11461700  0.11576100  0.37454500  1.0
  O  O22  1  0.13776100  0.47102100  0.34701000  1.0
  O  O23  1  0.10272100  0.17932800  0.11032900  1.0
  O  O24  1  0.48233400  0.21263300  0.89621100  1.0
  O  O25  1  0.38195500  0.06575300  0.64568500  1.0
  O  O26  1  0.52923700  0.90556500  0.88093500  1.0
  O  O27  1  0.24000800  0.90537100  0.22412700  1.0
  O  O28  1  0.48908100  0.40602100  0.63944500  1.0
  O  O29  1  0.60786600  0.58247200  0.87578800  1.0
  O  O30  1  0.89441500  0.91131000  0.63629700  1.0
  O  O31  1  0.49342600  0.28479400  0.37484400  1.0
  O  O32  1  0.41035000  0.41519600  0.12043600  1.0
  O  O33  1  0.77391500  0.40562900  0.29545000  1.0
  O  O34  1  0.74956900  0.09819400  0.79596500  1.0
  O  O35  1  0.48296200  0.08642800  0.14978300  1.0
  O  O36  1  0.60547100  0.91558900  0.38323900  1.0
  O  O37  1  0.50576500  0.78581600  0.12250200  1.0
  O  O38  1  0.91722600  0.82866400  0.90066800  1.0
  O  O39  1  0.87744000  0.54615400  0.65166700  1.0
  O  O40  1  0.52913400  0.71218100  0.62075200  1.0