# generated using pymatgen
data_Li3MnPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33059772
_cell_length_b   9.58781764
_cell_length_c   9.44607094
_cell_angle_alpha   63.64535972
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnPCO7
_chemical_formula_sum   'Li12 Mn4 P4 C4 O28'
_cell_volume   513.75311227
_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  0.26021304  0.11381749  0.30217177  1
  Li  Li1  1  0.23978696  0.11381749  0.80217177  1
  Li  Li2  1  0.01485793  0.28509749  0.48146703  1
  Li  Li3  1  0.48514207  0.28509749  0.98146703  1
  Li  Li4  1  0.74855668  0.37152528  0.67561736  1
  Li  Li5  1  0.75144332  0.37152528  0.17561736  1
  Li  Li6  1  0.25144332  0.62847472  0.32438264  1
  Li  Li7  1  0.24855668  0.62847472  0.82438264  1
  Li  Li8  1  0.98514207  0.71490251  0.51853297  1
  Li  Li9  1  0.51485793  0.71490251  0.01853297  1
  Li  Li10  1  0.73978696  0.88618251  0.69782823  1
  Li  Li11  1  0.76021304  0.88618251  0.19782823  1
  Mn  Mn12  1  0.51778356  0.25070853  0.50016009  1
  Mn  Mn13  1  0.98221644  0.25070853  0.00016009  1
  Mn  Mn14  1  0.48221644  0.74929147  0.49983991  1
  Mn  Mn15  1  0.01778356  0.74929147  0.99983991  1
  P  P16  1  0.24066860  0.40825488  0.68854631  1
  P  P17  1  0.25933140  0.40825488  0.18854631  1
  P  P18  1  0.75933140  0.59174512  0.31145369  1
  P  P19  1  0.74066860  0.59174512  0.81145369  1
  C  C20  1  0.77357676  0.04786389  0.36908193  1
  C  C21  1  0.72642324  0.04786389  0.86908193  1
  C  C22  1  0.22642324  0.95213611  0.63091807  1
  C  C23  1  0.27357676  0.95213611  0.13091807  1
  O  O24  1  0.68339633  0.06505983  0.72937611  1
  O  O25  1  0.81660367  0.06505983  0.22937611  1
  O  O26  1  0.26336315  0.09286809  0.51932030  1
  O  O27  1  0.76670079  0.16334170  0.40284886  1
  O  O28  1  0.23663685  0.09286809  0.01932030  1
  O  O29  1  0.73329921  0.16334170  0.90284886  1
  O  O30  1  0.05268611  0.30926548  0.68373650  1
  O  O31  1  0.43747044  0.31917761  0.67852478  1
  O  O32  1  0.06252956  0.31917761  0.17852478  1
  O  O33  1  0.44731389  0.30926548  0.18373650  1
  O  O34  1  0.76237164  0.42364014  0.44129345  1
  O  O35  1  0.26080500  0.41219065  0.35055594  1
  O  O36  1  0.73762836  0.42364014  0.94129345  1
  O  O37  1  0.23919500  0.41219065  0.85055594  1
  O  O38  1  0.73919500  0.58780935  0.64944406  1
  O  O39  1  0.23762836  0.57635986  0.55870655  1
  O  O40  1  0.76080500  0.58780935  0.14944406  1
  O  O41  1  0.26237164  0.57635986  0.05870655  1
  O  O42  1  0.94731389  0.69073452  0.31626350  1
  O  O43  1  0.56252956  0.68082239  0.32147522  1
  O  O44  1  0.93747044  0.68082239  0.82147522  1
  O  O45  1  0.55268611  0.69073452  0.81626350  1
  O  O46  1  0.23329921  0.83665830  0.59715114  1
  O  O47  1  0.73663685  0.90713191  0.48067970  1
  O  O48  1  0.26670079  0.83665830  0.09715114  1
  O  O49  1  0.76336315  0.90713191  0.98067970  1
  O  O50  1  0.31660367  0.93494017  0.27062389  1
  O  O51  1  0.18339633  0.93494017  0.77062389  1
