# generated using pymatgen
data_LiMnPHO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78969664
_cell_length_b   7.29927723
_cell_length_c   8.31155703
_cell_angle_alpha   93.98011540
_cell_angle_beta   94.08948198
_cell_angle_gamma   61.89843955
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPHO5
_chemical_formula_sum   'Li4 Mn4 P4 H4 O20'
_cell_volume   362.13459821
_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
  Li  Li0  1  0.74279400  0.82428400  0.18110400  1
  Li  Li1  1  0.24277600  0.82422200  0.68118700  1
  Li  Li2  1  0.25719700  0.17569200  0.81887100  1
  Li  Li3  1  0.75717200  0.17563600  0.31896100  1
  Mn  Mn4  1  0.99968900  0.50024300  0.49991400  1
  Mn  Mn5  1  0.49968700  0.99984700  0.49990500  1
  Mn  Mn6  1  0.50040900  0.50020900  0.00004400  1
  Mn  Mn7  1  0.99984400  0.99993200  0.00009600  1
  P  P8  1  0.28742800  0.23456300  0.14922500  1
  P  P9  1  0.78731800  0.23448200  0.64931700  1
  P  P10  1  0.71275900  0.76545900  0.85058400  1
  P  P11  1  0.21266100  0.76537900  0.35069400  1
  H  H12  1  0.87653500  0.34396000  0.14036100  1
  H  H13  1  0.37640400  0.34399800  0.64018900  1
  H  H14  1  0.12379900  0.65586400  0.85994400  1
  H  H15  1  0.62366600  0.65591400  0.35977700  1
  O  O16  1  0.71774600  0.72335800  0.40195400  1
  O  O17  1  0.21795600  0.72334400  0.90210200  1
  O  O18  1  0.28195400  0.27672800  0.59794200  1
  O  O19  1  0.78213400  0.27671200  0.09808200  1
  O  O20  1  0.08095500  0.38640400  0.24187300  1
  O  O21  1  0.58102300  0.38631600  0.74188500  1
  O  O22  1  0.91908500  0.61371700  0.75815600  1
  O  O23  1  0.41913300  0.61364000  0.25816000  1
  O  O24  1  0.66254400  0.66008100  0.98949100  1
  O  O25  1  0.16236900  0.66002600  0.48946600  1
  O  O26  1  0.33786300  0.34008200  0.01053600  1
  O  O27  1  0.83768000  0.34000800  0.51054300  1
  O  O28  1  0.23934600  0.06737400  0.05030200  1
  O  O29  1  0.73921400  0.06738400  0.55030700  1
  O  O30  1  0.76048800  0.93270600  0.94955700  1
  O  O31  1  0.26034700  0.93269700  0.44954900  1
  O  O32  1  0.49703900  0.11978800  0.26062100  1
  O  O33  1  0.99699900  0.11978400  0.76061700  1
  O  O34  1  0.50302300  0.88008000  0.73934800  1
  O  O35  1  0.00296700  0.88008700  0.23933400  1
