# generated using pymatgen
data_LiMnP2HO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.91549900
_cell_length_b   5.23237900
_cell_length_c   8.98202707
_cell_angle_alpha   64.50829208
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP2HO7
_chemical_formula_sum   'Li4 Mn4 P8 H4 O28'
_cell_volume   547.90210118
_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  0.51452100  0.68702500  0.12304500  1
  Li  Li1  1  0.01452100  0.31297500  0.37695500  1
  Li  Li2  1  0.98547900  0.68702500  0.62304500  1
  Li  Li3  1  0.48547900  0.31297500  0.87695500  1
  Mn  Mn4  1  0.87410300  0.37886100  0.01371700  1
  Mn  Mn5  1  0.37410300  0.62113900  0.48628300  1
  Mn  Mn6  1  0.62589700  0.37886100  0.51371700  1
  Mn  Mn7  1  0.12589700  0.62113900  0.98628300  1
  P  P8  1  0.54427000  0.09292000  0.24931500  1
  P  P9  1  0.04427000  0.90708000  0.25068500  1
  P  P10  1  0.83185800  0.69688000  0.27223200  1
  P  P11  1  0.33185800  0.30312000  0.22776800  1
  P  P12  1  0.66814200  0.69688000  0.77223200  1
  P  P13  1  0.16814200  0.30312000  0.72776800  1
  P  P14  1  0.95573000  0.09292000  0.74931500  1
  P  P15  1  0.45573000  0.90708000  0.75068500  1
  H  H16  1  0.68100100  0.01297200  0.11197900  1
  H  H17  1  0.18100100  0.98702800  0.38802100  1
  H  H18  1  0.81899900  0.01297200  0.61197900  1
  H  H19  1  0.31899900  0.98702800  0.88802100  1
  O  O20  1  0.02621000  0.18676800  0.10052000  1
  O  O21  1  0.59894700  0.03309200  0.10813400  1
  O  O22  1  0.79502000  0.96721900  0.12374700  1
  O  O23  1  0.43530000  0.20126800  0.15063100  1
  O  O24  1  0.25759200  0.40029500  0.08539800  1
  O  O25  1  0.09223000  0.66427000  0.22641200  1
  O  O26  1  0.87795600  0.46662300  0.23072600  1
  O  O27  1  0.37795600  0.53337700  0.26927400  1
  O  O28  1  0.93530000  0.79873200  0.34936900  1
  O  O29  1  0.29502000  0.03278100  0.37625300  1
  O  O30  1  0.59223000  0.33573000  0.27358800  1
  O  O31  1  0.09894700  0.96690800  0.39186600  1
  O  O32  1  0.52621000  0.81323200  0.39948000  1
  O  O33  1  0.75759200  0.59970500  0.41460200  1
  O  O34  1  0.24240800  0.40029500  0.58539800  1
  O  O35  1  0.47379000  0.18676800  0.60052000  1
  O  O36  1  0.90105300  0.03309200  0.60813400  1
  O  O37  1  0.40777000  0.66427000  0.72641200  1
  O  O38  1  0.70498000  0.96721900  0.62374700  1
  O  O39  1  0.06470000  0.20126800  0.65063100  1
  O  O40  1  0.62204400  0.46662300  0.73072600  1
  O  O41  1  0.12204400  0.53337700  0.76927400  1
  O  O42  1  0.90777000  0.33573000  0.77358800  1
  O  O43  1  0.74240800  0.59970500  0.91460200  1
  O  O44  1  0.56470000  0.79873200  0.84936900  1
  O  O45  1  0.20498000  0.03278100  0.87625300  1
  O  O46  1  0.40105300  0.96690800  0.89186600  1
  O  O47  1  0.97379000  0.81323200  0.89948000  1
