# generated using pymatgen
data_Li4TiCr5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.90131800
_cell_length_b   8.91148359
_cell_length_c   10.26040097
_cell_angle_alpha   90.41271252
_cell_angle_beta   89.82330555
_cell_angle_gamma   119.94349073
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4TiCr5O12
_chemical_formula_sum   'Li12 Ti3 Cr15 O36'
_cell_volume   705.23680153
_cell_formula_units_Z   3
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  0.94224400  0.56342800  0.27280500  1
  Li  Li1  1  0.44259800  0.56058400  0.23002100  1
  Li  Li2  1  0.55740200  0.43941600  0.76997900  1
  Li  Li3  1  0.05775600  0.43657200  0.72719500  1
  Li  Li4  1  0.26571400  0.20630300  0.27753500  1
  Li  Li5  1  0.76292100  0.20443200  0.22550900  1
  Li  Li6  1  0.21536700  0.11916600  0.77062200  1
  Li  Li7  1  0.71349800  0.11599900  0.72631600  1
  Li  Li8  1  0.28650200  0.88400100  0.27368400  1
  Li  Li9  1  0.78463300  0.88083400  0.22937800  1
  Li  Li10  1  0.23707900  0.79556800  0.77449100  1
  Li  Li11  1  0.73428600  0.79369700  0.72246500  1
  Ti  Ti12  1  0.66175200  0.33461700  0.00202700  1
  Ti  Ti13  1  0.00000000  0.00000000  0.00000000  1
  Ti  Ti14  1  0.33824800  0.66538300  0.99797300  1
  Cr  Cr15  1  0.50138000  0.33288600  0.49670500  1
  Cr  Cr16  1  0.16514600  0.33335200  0.49887700  1
  Cr  Cr17  1  0.83382800  0.33522800  0.50020200  1
  Cr  Cr18  1  0.00080300  0.33284100  0.00233400  1
  Cr  Cr19  1  0.33233700  0.33422600  0.00007100  1
  Cr  Cr20  1  0.83524500  0.00266800  0.49840700  1
  Cr  Cr21  1  0.50000000  0.00000000  0.50000000  1
  Cr  Cr22  1  0.16475500  0.99733200  0.50159300  1
  Cr  Cr23  1  0.33543200  0.00202600  0.00290900  1
  Cr  Cr24  1  0.66456800  0.99797400  0.99709100  1
  Cr  Cr25  1  0.16617200  0.66477200  0.49979800  1
  Cr  Cr26  1  0.83485400  0.66664800  0.50112300  1
  Cr  Cr27  1  0.49862000  0.66711400  0.50329500  1
  Cr  Cr28  1  0.99919700  0.66715900  0.99766600  1
  Cr  Cr29  1  0.66766300  0.66577400  0.99992900  1
  O  O30  1  0.95207400  0.55403900  0.60034600  1
  O  O31  1  0.61374300  0.55967200  0.60324300  1
  O  O32  1  0.11598100  0.55869200  0.89610900  1
  O  O33  1  0.44672200  0.55602600  0.89693500  1
  O  O34  1  0.76995700  0.54715000  0.89856200  1
  O  O35  1  0.26775000  0.55565900  0.59934300  1
  O  O36  1  0.73225000  0.44434100  0.40065700  1
  O  O37  1  0.23004300  0.45285000  0.10143800  1
  O  O38  1  0.55327800  0.44397400  0.10306500  1
  O  O39  1  0.88401900  0.44130800  0.10389100  1
  O  O40  1  0.04792600  0.44596100  0.39965400  1
  O  O41  1  0.38625700  0.44032800  0.39675700  1
  O  O42  1  0.27854600  0.22158400  0.59882900  1
  O  O43  1  0.93868400  0.22755300  0.60315400  1
  O  O44  1  0.44550900  0.22626600  0.89476700  1
  O  O45  1  0.77730900  0.22298100  0.90003000  1
  O  O46  1  0.10894700  0.21597200  0.89919500  1
  O  O47  1  0.61947000  0.22566500  0.59763500  1
  O  O48  1  0.05799200  0.10966200  0.40291000  1
  O  O49  1  0.56177500  0.11668500  0.10134900  1
  O  O50  1  0.88364100  0.10505900  0.10449200  1
  O  O51  1  0.21869600  0.11129800  0.10242400  1
  O  O52  1  0.72681000  0.11597300  0.39968600  1
  O  O53  1  0.38012100  0.10437500  0.39618100  1
  O  O54  1  0.27319000  0.88402700  0.60031400  1
  O  O55  1  0.61987900  0.89562500  0.60381900  1
  O  O56  1  0.78130400  0.88870200  0.89757600  1
  O  O57  1  0.11635900  0.89494100  0.89550800  1
  O  O58  1  0.43822500  0.88331500  0.89865100  1
  O  O59  1  0.94200800  0.89033800  0.59709000  1
  O  O60  1  0.38053000  0.77433500  0.40236500  1
  O  O61  1  0.89105300  0.78402800  0.10080500  1
  O  O62  1  0.22269100  0.77701900  0.09997000  1
  O  O63  1  0.55449100  0.77373400  0.10523300  1
  O  O64  1  0.06131600  0.77244700  0.39684600  1
  O  O65  1  0.72145400  0.77841600  0.40117100  1
