# generated using pymatgen
data_Li3V2(CO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76585800
_cell_length_b   9.58908800
_cell_length_c   11.90259000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3V2(CO5)2
_chemical_formula_sum   'Li12 V8 C8 O40'
_cell_volume   658.08610445
_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  0.74556500  0.75288100  0.49654300  1
  Li  Li1  1  0.25443500  0.75288100  0.49654300  1
  Li  Li2  1  0.50000000  0.74789900  0.00155700  1
  Li  Li3  1  0.00000000  0.75338000  0.27912900  1
  Li  Li4  1  0.00000000  0.24662000  0.77912900  1
  Li  Li5  1  0.50000000  0.25210100  0.50155700  1
  Li  Li6  1  0.74556500  0.24711900  0.99654300  1
  Li  Li7  1  0.25443500  0.24711900  0.99654300  1
  Li  Li8  1  0.00000000  0.25221800  0.22017500  1
  Li  Li9  1  0.50000000  0.25233000  0.21816800  1
  Li  Li10  1  0.00000000  0.74778200  0.72017500  1
  Li  Li11  1  0.50000000  0.74767000  0.71816800  1
  V  V12  1  0.25011100  0.98973200  0.11148800  1
  V  V13  1  0.74988900  0.98973200  0.11148800  1
  V  V14  1  0.74988900  0.01026800  0.61148800  1
  V  V15  1  0.25011100  0.01026800  0.61148800  1
  V  V16  1  0.75031500  0.49367900  0.38820500  1
  V  V17  1  0.24968500  0.49367900  0.38820500  1
  V  V18  1  0.75031500  0.50632100  0.88820500  1
  V  V19  1  0.24968500  0.50632100  0.88820500  1
  C  C20  1  0.24948700  0.98761600  0.86222100  1
  C  C21  1  0.75051300  0.98761600  0.86222100  1
  C  C22  1  0.75051300  0.01238400  0.36222100  1
  C  C23  1  0.24948700  0.01238400  0.36222100  1
  C  C24  1  0.75006100  0.49059700  0.63897400  1
  C  C25  1  0.24993900  0.49059700  0.63897400  1
  C  C26  1  0.75006100  0.50940300  0.13897400  1
  C  C27  1  0.24993900  0.50940300  0.13897400  1
  O  O28  1  0.00000000  0.87683600  0.14766500  1
  O  O29  1  0.50000000  0.87421000  0.14333100  1
  O  O30  1  0.00000000  0.88178800  0.57599400  1
  O  O31  1  0.50000000  0.87962600  0.57785900  1
  O  O32  1  0.76193200  0.88173700  0.36317100  1
  O  O33  1  0.23806800  0.88173700  0.36317100  1
  O  O34  1  0.26010100  0.91148100  0.95443000  1
  O  O35  1  0.73989900  0.91148100  0.95443000  1
  O  O36  1  0.74873900  0.91481300  0.76706700  1
  O  O37  1  0.25126100  0.91481300  0.76706700  1
  O  O38  1  0.74873900  0.08518700  0.26706700  1
  O  O39  1  0.25126100  0.08518700  0.26706700  1
  O  O40  1  0.73989900  0.08851900  0.45443000  1
  O  O41  1  0.26010100  0.08851900  0.45443000  1
  O  O42  1  0.76193200  0.11826300  0.86317100  1
  O  O43  1  0.23806800  0.11826300  0.86317100  1
  O  O44  1  0.00000000  0.11821200  0.07599400  1
  O  O45  1  0.50000000  0.12037400  0.07785900  1
  O  O46  1  0.00000000  0.12316400  0.64766500  1
  O  O47  1  0.50000000  0.12579000  0.64333100  1
  O  O48  1  0.00000000  0.37673900  0.35265600  1
  O  O49  1  0.50000000  0.37172200  0.35457300  1
  O  O50  1  0.00000000  0.38052100  0.92395800  1
  O  O51  1  0.50000000  0.38529600  0.92550800  1
  O  O52  1  0.75024500  0.37660600  0.13761100  1
  O  O53  1  0.24975500  0.37660600  0.13761100  1
  O  O54  1  0.74396500  0.41545400  0.54664800  1
  O  O55  1  0.25603500  0.41545400  0.54664800  1
  O  O56  1  0.75619200  0.41960300  0.73301800  1
  O  O57  1  0.24380800  0.41960300  0.73301800  1
  O  O58  1  0.24380800  0.58039700  0.23301800  1
  O  O59  1  0.75619200  0.58039700  0.23301800  1
  O  O60  1  0.74396500  0.58454600  0.04664800  1
  O  O61  1  0.25603500  0.58454600  0.04664800  1
  O  O62  1  0.75024500  0.62339400  0.63761100  1
  O  O63  1  0.24975500  0.62339400  0.63761100  1
  O  O64  1  0.00000000  0.61947900  0.42395800  1
  O  O65  1  0.50000000  0.61470400  0.42550800  1
  O  O66  1  0.00000000  0.62326100  0.85265600  1
  O  O67  1  0.50000000  0.62827800  0.85457300  1
