# generated using pymatgen
data_LiMoP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.50276500
_cell_length_b   7.14758800
_cell_length_c   9.03851871
_cell_angle_alpha   67.48927777
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMoP2O7
_chemical_formula_sum   'Li4 Mo4 P8 O28'
_cell_volume   507.45626776
_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  0.95438400  0.87898700  0.83379400  1
  Li  Li1  1  0.45438400  0.62101300  0.66620600  1
  Li  Li2  1  0.54561600  0.37898700  0.33379400  1
  Li  Li3  1  0.04561600  0.12101300  0.16620600  1
  Mo  Mo4  1  0.57981300  0.87295200  0.88679000  1
  Mo  Mo5  1  0.07981300  0.62704800  0.61321000  1
  Mo  Mo6  1  0.92018700  0.37295200  0.38679000  1
  Mo  Mo7  1  0.42018700  0.12704800  0.11321000  1
  P  P8  1  0.27179600  0.07084300  0.46921200  1
  P  P9  1  0.77179600  0.42915700  0.03078800  1
  P  P10  1  0.27055500  0.18656500  0.75244400  1
  P  P11  1  0.77055500  0.31343500  0.74755600  1
  P  P12  1  0.72820400  0.92915700  0.53078800  1
  P  P13  1  0.22820400  0.57084300  0.96921200  1
  P  P14  1  0.72944500  0.81343500  0.24755600  1
  P  P15  1  0.22944500  0.68656500  0.25244400  1
  O  O16  1  0.40300900  0.14040500  0.34223600  1
  O  O17  1  0.11120200  0.16521700  0.40989700  1
  O  O18  1  0.23596100  0.33783500  0.04877700  1
  O  O19  1  0.73596100  0.16216500  0.45122300  1
  O  O20  1  0.59699100  0.85959500  0.65776400  1
  O  O21  1  0.88879800  0.83478300  0.59010300  1
  O  O22  1  0.76403900  0.66216500  0.95122300  1
  O  O23  1  0.26403900  0.83783500  0.54877700  1
  O  O24  1  0.38879800  0.66521700  0.90989700  1
  O  O25  1  0.65832500  0.84994000  0.40019300  1
  O  O26  1  0.09699100  0.64040500  0.84223600  1
  O  O27  1  0.87977400  0.92407300  0.19171300  1
  O  O28  1  0.23356000  0.91982800  0.19599200  1
  O  O29  1  0.59020000  0.89445500  0.12333000  1
  O  O30  1  0.84167500  0.34994000  0.90019300  1
  O  O31  1  0.09020000  0.60554500  0.37667000  1
  O  O32  1  0.62022600  0.42407300  0.69171300  1
  O  O33  1  0.26644000  0.41982800  0.69599200  1
  O  O34  1  0.73356000  0.58017200  0.30400800  1
  O  O35  1  0.37977400  0.57592700  0.30828700  1
  O  O36  1  0.90980000  0.39445500  0.62333000  1
  O  O37  1  0.15832500  0.65006000  0.09980700  1
  O  O38  1  0.40980000  0.10554500  0.87667000  1
  O  O39  1  0.76644000  0.08017200  0.80400800  1
  O  O40  1  0.12022600  0.07592700  0.80828700  1
  O  O41  1  0.90300900  0.35959500  0.15776400  1
  O  O42  1  0.34167500  0.15006000  0.59980700  1
  O  O43  1  0.61120200  0.33478300  0.09010300  1
