# generated using pymatgen
data_Li12VFe3P4(CO7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53275700
_cell_length_b   8.49464400
_cell_length_c   10.05787686
_cell_angle_alpha   84.81626407
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li12VFe3P4(CO7)4
_chemical_formula_sum   'Li12 V1 Fe3 P4 C4 O28'
_cell_volume   555.86346630
_cell_formula_units_Z   1
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  0.00000000  0.90768300  0.61823900  1
  Li  Li1  1  0.00000000  0.90422100  0.11807700  1
  Li  Li2  1  0.22798300  0.72510000  0.87526300  1
  Li  Li3  1  0.77201700  0.72510000  0.87526300  1
  Li  Li4  1  0.22930900  0.72398700  0.37618700  1
  Li  Li5  1  0.77069100  0.72398700  0.37618700  1
  Li  Li6  1  0.72377100  0.27584200  0.62376100  1
  Li  Li7  1  0.27622900  0.27584200  0.62376100  1
  Li  Li8  1  0.72545300  0.27595900  0.12516200  1
  Li  Li9  1  0.27454700  0.27595900  0.12516200  1
  Li  Li10  1  0.50000000  0.09369300  0.88121400  1
  Li  Li11  1  0.50000000  0.09559200  0.38095300  1
  V  V12  1  0.00000000  0.33087700  0.39580500  1
  Fe  Fe13  1  0.50000000  0.66558800  0.60575200  1
  Fe  Fe14  1  0.50000000  0.66559200  0.10657900  1
  Fe  Fe15  1  0.00000000  0.33355900  0.89429000  1
  P  P16  1  0.00000000  0.58858300  0.63886400  1
  P  P17  1  0.00000000  0.58762800  0.14117300  1
  P  P18  1  0.50000000  0.41187100  0.85995100  1
  P  P19  1  0.50000000  0.41093500  0.36072800  1
  C  C20  1  0.50000000  0.96555100  0.64930000  1
  C  C21  1  0.50000000  0.96560600  0.14966800  1
  C  C22  1  0.00000000  0.03368800  0.85008100  1
  C  C23  1  0.00000000  0.03568600  0.34956300  1
  O  O24  1  0.50000000  0.93005100  0.52711200  1
  O  O25  1  0.00000000  0.88782900  0.82096000  1
  O  O26  1  0.50000000  0.92959600  0.02730100  1
  O  O27  1  0.50000000  0.85135900  0.74522600  1
  O  O28  1  0.00000000  0.88995000  0.32217500  1
  O  O29  1  0.50000000  0.85180600  0.24558400  1
  O  O30  1  0.18653800  0.69074900  0.58643400  1
  O  O31  1  0.81346200  0.69074900  0.58643400  1
  O  O32  1  0.18673700  0.68942800  0.08853700  1
  O  O33  1  0.81326300  0.68942800  0.08853700  1
  O  O34  1  0.50000000  0.57861800  0.90949900  1
  O  O35  1  0.00000000  0.56972600  0.79496000  1
  O  O36  1  0.50000000  0.57874100  0.40971700  1
  O  O37  1  0.00000000  0.57109200  0.29674400  1
  O  O38  1  0.50000000  0.42863700  0.70389900  1
  O  O39  1  0.00000000  0.42224800  0.58888600  1
  O  O40  1  0.50000000  0.42936500  0.20389700  1
  O  O41  1  0.00000000  0.42125300  0.09015500  1
  O  O42  1  0.31332900  0.31009200  0.91281100  1
  O  O43  1  0.68667100  0.31009200  0.91281100  1
  O  O44  1  0.68292000  0.30775900  0.41408000  1
  O  O45  1  0.31708000  0.30775900  0.41408000  1
  O  O46  1  0.00000000  0.14809500  0.75392500  1
  O  O47  1  0.50000000  0.11169600  0.67920600  1
  O  O48  1  0.00000000  0.14937500  0.25320300  1
  O  O49  1  0.00000000  0.07003500  0.97233100  1
  O  O50  1  0.50000000  0.11201000  0.17867800  1
  O  O51  1  0.00000000  0.07432800  0.47183700  1
