# generated using pymatgen
data_Li3MnPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97262900
_cell_length_b   8.58176565
_cell_length_c   13.19028767
_cell_angle_alpha   90.55544290
_cell_angle_beta   90.07959555
_cell_angle_gamma   94.53964408
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnPCO7
_chemical_formula_sum   'Li12 Mn4 P4 C4 O28'
_cell_volume   561.08795453
_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  0.23628400  0.09392600  0.12799400  1
  Li  Li1  1  0.23564200  0.09779100  0.62817800  1
  Li  Li2  1  0.75429100  0.27435800  0.51938600  1
  Li  Li3  1  0.75246100  0.27302300  0.24355900  1
  Li  Li4  1  0.76512500  0.27918900  0.73637100  1
  Li  Li5  1  0.22291700  0.35232400  0.86524200  1
  Li  Li6  1  0.24364500  0.71953900  0.97743800  1
  Li  Li7  1  0.24532800  0.72439200  0.26777700  1
  Li  Li8  1  0.24794700  0.72736400  0.48926800  1
  Li  Li9  1  0.24563700  0.72052700  0.76601200  1
  Li  Li10  1  0.76304500  0.90540300  0.37810400  1
  Li  Li11  1  0.76503100  0.90115900  0.86996300  1
  Mn  Mn12  1  0.74771600  0.25860600  0.99351400  1
  Mn  Mn13  1  0.22398100  0.34062700  0.37669500  1
  Mn  Mn14  1  0.77920200  0.65871400  0.12454800  1
  Mn  Mn15  1  0.77670600  0.65848900  0.62536200  1
  P  P16  1  0.27578800  0.40852600  0.12366600  1
  P  P17  1  0.27614000  0.40884500  0.62781100  1
  P  P18  1  0.72269900  0.59030000  0.37388700  1
  P  P19  1  0.71823300  0.58959900  0.87519100  1
  C  C20  1  0.29701100  0.03333700  0.37353800  1
  C  C21  1  0.29219900  0.03790600  0.88035400  1
  C  C22  1  0.70331400  0.96681300  0.62466000  1
  C  C23  1  0.70289300  0.96563900  0.12544400  1
  O  O24  1  0.04395800  0.06998700  0.88125000  1
  O  O25  1  0.04977800  0.06805700  0.37344900  1
  O  O26  1  0.64089200  0.11250400  0.12316700  1
  O  O27  1  0.64028100  0.11100000  0.62549000  1
  O  O28  1  0.49037000  0.14550800  0.37254600  1
  O  O29  1  0.48591000  0.15024300  0.88258200  1
  O  O30  1  0.16528600  0.31004800  0.53437800  1
  O  O31  1  0.17273400  0.31113400  0.02965200  1
  O  O32  1  0.16960100  0.31044700  0.21607900  1
  O  O33  1  0.17343200  0.31297800  0.71977400  1
  O  O34  1  0.81216100  0.42149100  0.37306900  1
  O  O35  1  0.82183600  0.42379400  0.87306500  1
  O  O36  1  0.59307200  0.42309600  0.62499900  1
  O  O37  1  0.59421400  0.41965300  0.12301800  1
  O  O38  1  0.40690400  0.57736100  0.37366100  1
  O  O39  1  0.40621300  0.57515100  0.87586000  1
  O  O40  1  0.19037600  0.57800900  0.12597800  1
  O  O41  1  0.18742400  0.57890000  0.62597600  1
  O  O42  1  0.83237000  0.68947100  0.46635100  1
  O  O43  1  0.83110700  0.68895000  0.28216000  1
  O  O44  1  0.82883200  0.68999600  0.78399700  1
  O  O45  1  0.83027200  0.68959000  0.96794800  1
  O  O46  1  0.50849700  0.85622700  0.12757400  1
  O  O47  1  0.51104500  0.85354900  0.62373400  1
  O  O48  1  0.35972900  0.88825700  0.37470600  1
  O  O49  1  0.35866800  0.89336500  0.87516200  1
  O  O50  1  0.95008000  0.93270100  0.12537700  1
  O  O51  1  0.95172100  0.93214000  0.62503300  1
