# generated using pymatgen
data_LiMnPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21420100
_cell_length_b   9.69868775
_cell_length_c   10.17809815
_cell_angle_alpha   117.62344765
_cell_angle_beta   89.48313127
_cell_angle_gamma   91.17798367
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPCO7
_chemical_formula_sum   'Li4 Mn4 P4 C4 O28'
_cell_volume   543.39242475
_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  0.01765300  0.76571900  0.76356700  1
  Li  Li1  1  0.48945100  0.75995600  0.25960900  1
  Li  Li2  1  0.51216300  0.23123400  0.73723200  1
  Li  Li3  1  0.52029100  0.24055800  0.24171600  1
  Mn  Mn4  1  0.75140600  0.66061000  0.93259600  1
  Mn  Mn5  1  0.74478100  0.66187200  0.43448500  1
  Mn  Mn6  1  0.24432000  0.33820400  0.56785300  1
  Mn  Mn7  1  0.25397600  0.33875500  0.06694800  1
  P  P8  1  0.25485300  0.57168000  0.92425700  1
  P  P9  1  0.24944000  0.57072800  0.42457500  1
  P  P10  1  0.75470400  0.42717400  0.57567100  1
  P  P11  1  0.74358200  0.42923000  0.07579500  1
  C  C12  1  0.74499900  0.93485000  0.60957300  1
  C  C13  1  0.73631100  0.93363800  0.10652500  1
  C  C14  1  0.23961100  0.06653600  0.88988600  1
  C  C15  1  0.28517700  0.06731100  0.39297700  1
  O  O16  1  0.77130000  0.87739800  0.96273700  1
  O  O17  1  0.74316300  0.87836800  0.46384900  1
  O  O18  1  0.22310800  0.92854600  0.79775700  1
  O  O19  1  0.77022100  0.81925900  0.64401300  1
  O  O20  1  0.30379500  0.92978900  0.30199100  1
  O  O21  1  0.72305000  0.81699100  0.14118300  1
  O  O22  1  0.06109900  0.67812500  0.94722700  1
  O  O23  1  0.44850500  0.66969500  0.91467500  1
  O  O24  1  0.04853400  0.65761300  0.41943800  1
  O  O25  1  0.43640100  0.68725800  0.44136600  1
  O  O26  1  0.79998500  0.58107200  0.71787400  1
  O  O27  1  0.24267500  0.53620100  0.55941200  1
  O  O28  1  0.71534300  0.58371900  0.21941200  1
  O  O29  1  0.28325300  0.53712800  0.05831200  1
  O  O30  1  0.72538200  0.46265800  0.94069600  1
  O  O31  1  0.23155800  0.41508000  0.78188400  1
  O  O32  1  0.71391200  0.46365300  0.44414000  1
  O  O33  1  0.27771500  0.41595400  0.28137700  1
  O  O34  1  0.94179100  0.31250600  0.53930700  1
  O  O35  1  0.55686600  0.33885400  0.59645900  1
  O  O36  1  0.56186800  0.31070000  0.06581300  1
  O  O37  1  0.95000400  0.34542700  0.07304600  1
  O  O38  1  0.26346800  0.18339900  0.85620000  1
  O  O39  1  0.72263700  0.07224600  0.70053700  1
  O  O40  1  0.28957700  0.18476600  0.35945700  1
  O  O41  1  0.71557000  0.07162800  0.19589200  1
  O  O42  1  0.25640900  0.12182100  0.53738800  1
  O  O43  1  0.23246000  0.12209000  0.03529800  1
