# generated using pymatgen
data_LiCO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.59126836
_cell_length_b   15.59124378
_cell_length_c   5.57409680
_cell_angle_alpha   89.99966623
_cell_angle_beta   90.00049948
_cell_angle_gamma   120.00031907
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCO2
_chemical_formula_sum   'Li18 C18 O36'
_cell_volume   1173.45367850
_cell_formula_units_Z   18
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  0.19666546  0.53557360  0.27099013  1
  Li  Li1  1  0.33890915  0.80333723  0.27099274  1
  Li  Li2  1  0.46442698  0.66108889  0.27100063  1
  Li  Li3  1  0.80333486  0.46442667  0.77099472  1
  Li  Li4  1  0.66109219  0.19666604  0.77098261  1
  Li  Li5  1  0.53557247  0.33890610  0.77099424  1
  Li  Li6  1  0.02178490  0.29659085  0.55339748  1
  Li  Li7  1  0.27480073  0.97821180  0.55338787  1
  Li  Li8  1  0.70341311  0.72519584  0.55341434  1
  Li  Li9  1  0.97821478  0.70341134  0.05342035  1
  Li  Li10  1  0.72519658  0.02178484  0.05339146  1
  Li  Li11  1  0.29658944  0.27480378  0.05340655  1
  Li  Li12  1  0.85982196  0.66518576  0.52243913  1
  Li  Li13  1  0.80536385  0.14018159  0.52243460  1
  Li  Li14  1  0.33481548  0.19463608  0.52244995  1
  Li  Li15  1  0.14017904  0.33481649  0.02244907  1
  Li  Li16  1  0.19463022  0.85982019  0.02244083  1
  Li  Li17  1  0.66517900  0.80535828  0.02244632  1
  C  C18  1  0.14618484  0.49328938  0.75074152  1
  C  C19  1  0.34710602  0.85382165  0.75074630  1
  C  C20  1  0.50671164  0.65288919  0.75074016  1
  C  C21  1  0.85381666  0.50671107  0.25074653  1
  C  C22  1  0.65289403  0.14618351  0.25072640  1
  C  C23  1  0.49328845  0.34710605  0.25074196  1
  C  C24  1  0.86779007  0.33835517  0.71364080  1
  C  C25  1  0.47056353  0.13220988  0.71364444  1
  C  C26  1  0.66164735  0.52943358  0.71364152  1
  C  C27  1  0.13221177  0.66164449  0.21363990  1
  C  C28  1  0.52943426  0.86778664  0.21363693  1
  C  C29  1  0.33835263  0.47056435  0.21364983  1
  C  C30  1  0.97714735  0.20173004  0.04097122  1
  C  C31  1  0.22457686  0.02285133  0.04096529  1
  C  C32  1  0.79826877  0.77541644  0.04098607  1
  C  C33  1  0.02285694  0.79826803  0.54099623  1
  C  C34  1  0.77542366  0.97715290  0.54097418  1
  C  C35  1  0.20173225  0.22458612  0.54098094  1
  O  O36  1  0.12397083  0.44841352  0.55380691  1
  O  O37  1  0.32444465  0.87603105  0.55381090  1
  O  O38  1  0.55159145  0.67555798  0.55380958  1
  O  O39  1  0.87602832  0.55158618  0.05381570  1
  O  O40  1  0.67555708  0.12397046  0.05379889  1
  O  O41  1  0.44841179  0.32444205  0.05380785  1
  O  O42  1  0.85919277  0.53745531  0.46106440  1
  O  O43  1  0.67826275  0.14080998  0.46104920  1
  O  O44  1  0.46254604  0.32173828  0.46105934  1
  O  O45  1  0.14080945  0.46254595  0.96105575  1
  O  O46  1  0.32173220  0.85919432  0.96106203  1
  O  O47  1  0.53745004  0.67825571  0.96105963  1
  O  O48  1  0.78753542  0.33053483  0.77936075  1
  O  O49  1  0.54299983  0.21246512  0.77936196  1
  O  O50  1  0.66946682  0.45699857  0.77936289  1
  O  O51  1  0.21246739  0.66946559  0.27935641  1
  O  O52  1  0.45699910  0.78753055  0.27935664  1
  O  O53  1  0.33053212  0.54299907  0.27936874  1
  O  O54  1  0.88862486  0.27730145  0.62457629  1
  O  O55  1  0.38867312  0.11137429  0.62458579  1
  O  O56  1  0.72270310  0.61132411  0.62458580  1
  O  O57  1  0.11137427  0.72269979  0.12459403  1
  O  O58  1  0.61132395  0.88862237  0.12457734  1
  O  O59  1  0.27729943  0.38867429  0.12458701  1
  O  O60  1  0.79876010  0.02215805  0.34436341  1
  O  O61  1  0.22340033  0.20124090  0.34436943  1
  O  O62  1  0.97784923  0.77660577  0.34438313  1
  O  O63  1  0.20123886  0.97784622  0.84435361  1
  O  O64  1  0.77659600  0.79875819  0.84437963  1
  O  O65  1  0.02215261  0.22339617  0.84436911  1
  O  O66  1  0.00908505  0.23913060  0.24351744  1
  O  O67  1  0.23004145  0.99091430  0.24350084  1
  O  O68  1  0.76087860  0.76995413  0.24352519  1
  O  O69  1  0.99091728  0.76087510  0.74353003  1
  O  O70  1  0.76995926  0.00908977  0.74351271  1
  O  O71  1  0.23912314  0.23004481  0.74351743  1
