# generated using pymatgen
data_LiMoPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55102392
_cell_length_b   7.35472717
_cell_length_c   7.36296028
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMoPO5
_chemical_formula_sum   'Li4 Mo4 P4 O20'
_cell_volume   354.75474224
_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  0.50000000  -0.00000000  -0.00000000  1
  Li  Li1  1  0.00000000  -0.00000000  -0.00000000  1
  Li  Li2  1  0.00000000  0.50000000  0.50000000  1
  Li  Li3  1  0.50000000  0.50000000  0.50000000  1
  Mo  Mo4  1  0.75000000  0.35822133  0.23042633  1
  Mo  Mo5  1  0.25000000  0.14177867  0.73042633  1
  Mo  Mo6  1  0.25000000  0.64177867  0.76957367  1
  Mo  Mo7  1  0.75000000  0.85822133  0.26957367  1
  P  P8  1  0.75000000  0.12940039  0.63663320  1
  P  P9  1  0.75000000  0.62940039  0.86336680  1
  P  P10  1  0.25000000  0.37059961  0.13663320  1
  P  P11  1  0.25000000  0.87059961  0.36336680  1
  O  O12  1  0.56298182  0.63180632  0.73830815  1
  O  O13  1  0.25000000  0.19968925  0.01513787  1
  O  O14  1  0.25000000  0.89532294  0.82550237  1
  O  O15  1  0.93701818  0.13180632  0.76169185  1
  O  O16  1  0.43701818  0.86819368  0.23830815  1
  O  O17  1  0.75000000  0.60467706  0.32550237  1
  O  O18  1  0.25000000  0.54429664  0.02321084  1
  O  O19  1  0.25000000  0.69968925  0.48486213  1
  O  O20  1  0.93701818  0.63180632  0.73830815  1
  O  O21  1  0.75000000  0.30031075  0.51513787  1
  O  O22  1  0.06298182  0.86819368  0.23830815  1
  O  O23  1  0.56298182  0.13180632  0.76169185  1
  O  O24  1  0.43701818  0.36819368  0.26169185  1
  O  O25  1  0.25000000  0.04429664  0.47678916  1
  O  O26  1  0.75000000  0.10467706  0.17449763  1
  O  O27  1  0.75000000  0.45570336  0.97678916  1
  O  O28  1  0.75000000  0.95570336  0.52321084  1
  O  O29  1  0.75000000  0.80031075  0.98486213  1
  O  O30  1  0.25000000  0.39532294  0.67449763  1
  O  O31  1  0.06298182  0.36819368  0.26169185  1
