# generated using pymatgen
data_Li3Ti(Si2O5)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.06392670
_cell_length_b   11.06392670
_cell_length_c   10.20658900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   100.10404034
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti(Si2O5)3
_chemical_formula_sum   'Li12 Ti4 Si24 O60'
_cell_volume   1230.01631927
_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  0.23448400  0.23448400  0.00000000  1
  Li  Li1  1  0.47868300  0.02131700  0.25000000  1
  Li  Li2  1  0.02131700  0.47868300  0.75000000  1
  Li  Li3  1  0.26551600  0.26551600  0.50000000  1
  Li  Li4  1  0.06302000  0.93698000  0.80087200  1
  Li  Li5  1  0.56302000  0.43698000  0.69912800  1
  Li  Li6  1  0.43698000  0.56302000  0.30087200  1
  Li  Li7  1  0.93698000  0.06302000  0.19912800  1
  Li  Li8  1  0.73448400  0.73448400  0.50000000  1
  Li  Li9  1  0.52131700  0.97868300  0.75000000  1
  Li  Li10  1  0.97868300  0.52131700  0.25000000  1
  Li  Li11  1  0.76551600  0.76551600  0.00000000  1
  Ti  Ti12  1  0.15602900  0.34397100  0.25000000  1
  Ti  Ti13  1  0.34397100  0.15602900  0.75000000  1
  Ti  Ti14  1  0.84397100  0.65602900  0.75000000  1
  Ti  Ti15  1  0.65602900  0.84397100  0.25000000  1
  Si  Si16  1  0.03990500  0.18957100  0.80691000  1
  Si  Si17  1  0.18957100  0.03990500  0.19309000  1
  Si  Si18  1  0.46009500  0.31042900  0.30691000  1
  Si  Si19  1  0.31042900  0.46009500  0.69309000  1
  Si  Si20  1  0.01679700  0.76534200  0.48340300  1
  Si  Si21  1  0.26534200  0.51679700  0.98340300  1
  Si  Si22  1  0.51679700  0.26534200  0.01659700  1
  Si  Si23  1  0.76534200  0.01679700  0.51659700  1
  Si  Si24  1  0.20008200  0.58169700  0.45514800  1
  Si  Si25  1  0.70008200  0.08169700  0.04485200  1
  Si  Si26  1  0.08169700  0.70008200  0.95514800  1
  Si  Si27  1  0.58169700  0.20008200  0.54485200  1
  Si  Si28  1  0.41830300  0.79991800  0.45514800  1
  Si  Si29  1  0.29991800  0.91830300  0.95514800  1
  Si  Si30  1  0.91830300  0.29991800  0.04485200  1
  Si  Si31  1  0.79991800  0.41830300  0.54485200  1
  Si  Si32  1  0.73465800  0.48320300  0.01659700  1
  Si  Si33  1  0.23465800  0.98320300  0.48340300  1
  Si  Si34  1  0.48320300  0.73465800  0.98340300  1
  Si  Si35  1  0.98320300  0.23465800  0.51659700  1
  Si  Si36  1  0.53990500  0.68957100  0.69309000  1
  Si  Si37  1  0.68957100  0.53990500  0.30691000  1
  Si  Si38  1  0.81042900  0.96009500  0.80691000  1
  Si  Si39  1  0.96009500  0.81042900  0.19309000  1
  O  O40  1  0.28308800  0.01122500  0.07734900  1
  O  O41  1  0.01122500  0.28308800  0.92265100  1
  O  O42  1  0.03119500  0.26572900  0.66976400  1
  O  O43  1  0.26572900  0.03119500  0.33023600  1
  O  O44  1  0.14026200  0.16561900  0.16591000  1
  O  O45  1  0.16561900  0.14026200  0.83409000  1
  O  O46  1  0.09734100  0.25567700  0.41815600  1
  O  O47  1  0.25567700  0.09734100  0.58184400  1
  O  O48  1  0.13927800  0.51198800  0.32792800  1
  O  O49  1  0.63927800  0.01198800  0.17207200  1
  O  O50  1  0.01198800  0.63927800  0.82792800  1
  O  O51  1  0.51198800  0.13927800  0.67207200  1
  O  O52  1  0.24432300  0.40265900  0.08184400  1
  O  O53  1  0.40265900  0.24432300  0.91815600  1
  O  O54  1  0.35973800  0.33438100  0.66591000  1
  O  O55  1  0.33438100  0.35973800  0.33409000  1
  O  O56  1  0.46880500  0.23427100  0.16976400  1
  O  O57  1  0.23427100  0.46880500  0.83023600  1
  O  O58  1  0.21691200  0.48877500  0.57734900  1
  O  O59  1  0.48877500  0.21691200  0.42265100  1
  O  O60  1  0.11448000  0.67368200  0.51566300  1
  O  O61  1  0.17368200  0.61448000  0.01566300  1
  O  O62  1  0.67368200  0.11448000  0.48433700  1
  O  O63  1  0.61448000  0.17368200  0.98433700  1
  O  O64  1  0.59294800  0.40705200  0.00787800  1
  O  O65  1  0.33979800  0.66020200  0.41770600  1
  O  O66  1  0.06630200  0.93369800  0.19482700  1
  O  O67  1  0.16020200  0.83979800  0.91770600  1
  O  O68  1  0.09294800  0.90705200  0.49212200  1
  O  O69  1  0.43369800  0.56630200  0.69482700  1
  O  O70  1  0.56630200  0.43369800  0.30517300  1
  O  O71  1  0.40705200  0.59294800  0.99212200  1
  O  O72  1  0.90705200  0.09294800  0.50787800  1
  O  O73  1  0.66020200  0.33979800  0.58229400  1
  O  O74  1  0.93369800  0.06630200  0.80517300  1
  O  O75  1  0.83979800  0.16020200  0.08229400  1
  O  O76  1  0.32631800  0.88552000  0.51566300  1
  O  O77  1  0.38552000  0.82631800  0.01566300  1
  O  O78  1  0.88552000  0.32631800  0.48433700  1
  O  O79  1  0.82631800  0.38552000  0.98433700  1
  O  O80  1  0.51122500  0.78308800  0.57734900  1
  O  O81  1  0.78308800  0.51122500  0.42265100  1
  O  O82  1  0.53119500  0.76572900  0.83023600  1
  O  O83  1  0.76572900  0.53119500  0.16976400  1
  O  O84  1  0.64026200  0.66561900  0.33409000  1
  O  O85  1  0.66561900  0.64026200  0.66591000  1
  O  O86  1  0.59734100  0.75567700  0.08184400  1
  O  O87  1  0.75567700  0.59734100  0.91815600  1
  O  O88  1  0.36072200  0.98801200  0.82792800  1
  O  O89  1  0.48801200  0.86072200  0.32792800  1
  O  O90  1  0.98801200  0.36072200  0.17207200  1
  O  O91  1  0.86072200  0.48801200  0.67207200  1
  O  O92  1  0.74432300  0.90265900  0.41815600  1
  O  O93  1  0.90265900  0.74432300  0.58184400  1
  O  O94  1  0.83438100  0.85973800  0.16591000  1
  O  O95  1  0.85973800  0.83438100  0.83409000  1
  O  O96  1  0.96880500  0.73427100  0.33023600  1
  O  O97  1  0.73427100  0.96880500  0.66976400  1
  O  O98  1  0.71691200  0.98877500  0.92265100  1
  O  O99  1  0.98877500  0.71691200  0.07734900  1
