# generated using pymatgen
data_MgTi3P3O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41640800
_cell_length_b   7.73099300
_cell_length_c   10.24189869
_cell_angle_alpha   80.26440294
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi3P3O13
_chemical_formula_sum   'Mg2 Ti6 P6 O26'
_cell_volume   500.73483432
_cell_formula_units_Z   2
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  0.75000000  0.38514200  0.17009700  1.0
  Mg  Mg1  1  0.25000000  0.61485800  0.82990300  1.0
  Ti  Ti2  1  0.25000000  0.64780100  0.20313900  1.0
  Ti  Ti3  1  0.75000000  0.35219900  0.79686100  1.0
  Ti  Ti4  1  0.25000000  0.20841900  0.43156900  1.0
  Ti  Ti5  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti6  1  0.75000000  0.79158100  0.56843100  1.0
  Ti  Ti7  1  0.00000000  0.00000000  0.00000000  1.0
  P  P8  1  0.25000000  0.77708000  0.49898400  1.0
  P  P9  1  0.75000000  0.22292000  0.50101600  1.0
  P  P10  1  0.25000000  0.27333100  0.75997900  1.0
  P  P11  1  0.75000000  0.72666900  0.24002100  1.0
  P  P12  1  0.75000000  0.67903800  0.88756200  1.0
  P  P13  1  0.25000000  0.32096200  0.11243800  1.0
  O  O14  1  0.75000000  0.63104900  0.74490200  1.0
  O  O15  1  0.56011800  0.25372200  0.40724300  1.0
  O  O16  1  0.25000000  0.22776700  0.62079000  1.0
  O  O17  1  0.54532900  0.78096800  0.90157800  1.0
  O  O18  1  0.75000000  0.34372800  0.60480100  1.0
  O  O19  1  0.75000000  0.13169400  0.90116900  1.0
  O  O20  1  0.25000000  0.65627200  0.39519900  1.0
  O  O21  1  0.04532900  0.21903200  0.09842200  1.0
  O  O22  1  0.25000000  0.97108200  0.42203400  1.0
  O  O23  1  0.75000000  0.02891800  0.57796600  1.0
  O  O24  1  0.06516600  0.39373300  0.78601400  1.0
  O  O25  1  0.25000000  0.86830600  0.09883100  1.0
  O  O26  1  0.56516600  0.60626700  0.21398600  1.0
  O  O27  1  0.75000000  0.49243200  0.97292500  1.0
  O  O28  1  0.75000000  0.77223300  0.37921000  1.0
  O  O29  1  0.45467100  0.21903200  0.09842200  1.0
  O  O30  1  0.93988200  0.25372200  0.40724300  1.0
  O  O31  1  0.43988200  0.74627800  0.59275700  1.0
  O  O32  1  0.43483400  0.39373300  0.78601400  1.0
  O  O33  1  0.25000000  0.36895100  0.25509800  1.0
  O  O34  1  0.75000000  0.89875400  0.13570700  1.0
  O  O35  1  0.25000000  0.10124600  0.86429300  1.0
  O  O36  1  0.93483400  0.60626700  0.21398600  1.0
  O  O37  1  0.95467100  0.78096800  0.90157800  1.0
  O  O38  1  0.06011800  0.74627800  0.59275700  1.0
  O  O39  1  0.25000000  0.50756800  0.02707500  1.0