# generated using pymatgen
data_LiCrP2HO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02729274
_cell_length_b   6.43953488
_cell_length_c   6.58828591
_cell_angle_alpha   69.96418052
_cell_angle_beta   88.23692002
_cell_angle_gamma   97.37432295
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrP2HO7
_chemical_formula_sum   'Li2 Cr2 P4 H2 O14'
_cell_volume   276.88085062
_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
  Li  Li0  1  0.14152000  0.21045800  0.85809300  1
  Li  Li1  1  0.85848300  0.78955000  0.14190300  1
  Cr  Cr2  1  0.35186400  0.10211000  0.28497000  1
  Cr  Cr3  1  0.64814300  0.89789500  0.71503900  1
  P  P4  1  0.16083700  0.78123200  0.77239400  1
  P  P5  1  0.38921600  0.64763000  0.16950100  1
  P  P6  1  0.61078100  0.35237000  0.83049800  1
  P  P7  1  0.83916400  0.21876700  0.22760500  1
  H  H8  1  0.16668000  0.65375100  0.50833800  1
  H  H9  1  0.83332000  0.34624700  0.49166300  1
  O  O10  1  0.09305200  0.60505400  0.65913300  1
  O  O11  1  0.00354100  0.12654100  0.14896500  1
  O  O12  1  0.25353100  0.62573500  0.97751600  1
  O  O13  1  0.28571400  0.77822700  0.28486800  1
  O  O14  1  0.31450200  0.96363900  0.62465400  1
  O  O15  1  0.39093100  0.40902300  0.31520600  1
  O  O16  1  0.41445200  0.22593400  0.94576700  1
  O  O17  1  0.58554300  0.77406800  0.05422400  1
  O  O18  1  0.60907300  0.59097900  0.68479300  1
  O  O19  1  0.68549600  0.03636000  0.37534500  1
  O  O20  1  0.71428600  0.22177500  0.71513200  1
  O  O21  1  0.74646600  0.37426000  0.02248700  1
  O  O22  1  0.99645400  0.87345400  0.85103300  1
  O  O23  1  0.90695200  0.39494300  0.34087100  1
