# generated using pymatgen
data_Li3Ti2(PO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.84293473
_cell_length_b   9.84293473
_cell_length_c   9.82348233
_cell_angle_alpha   85.73049773
_cell_angle_beta   85.73049773
_cell_angle_gamma   85.23916635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2(PO4)3
_chemical_formula_sum   'Li12 Ti8 P12 O48'
_cell_volume   943.58197992
_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  0.01093900  0.49496900  0.77119700  1
  Li  Li1  1  0.37491400  0.25078100  0.20250000  1
  Li  Li2  1  0.21275600  0.44444900  0.53250000  1
  Li  Li3  1  0.23679200  0.26372300  0.81753200  1
  Li  Li4  1  0.70713900  0.06521200  0.02445300  1
  Li  Li5  1  0.99943400  0.74134700  0.60459900  1
  Li  Li6  1  0.25865300  0.00056600  0.39540100  1
  Li  Li7  1  0.93478800  0.29286100  0.97554700  1
  Li  Li8  1  0.73627700  0.76320800  0.18246800  1
  Li  Li9  1  0.55555100  0.78724400  0.46750000  1
  Li  Li10  1  0.74921900  0.62508600  0.79750000  1
  Li  Li11  1  0.50503100  0.98906100  0.22880300  1
  Ti  Ti12  1  0.03528800  0.74899000  0.21234600  1
  Ti  Ti13  1  0.74847700  0.04045500  0.71123700  1
  Ti  Ti14  1  0.53565200  0.46434800  0.50000000  1
  Ti  Ti15  1  0.74839200  0.25160800  0.50000000  1
  Ti  Ti16  1  0.24846800  0.75153200  0.00000000  1
  Ti  Ti17  1  0.46214000  0.53786000  0.00000000  1
  Ti  Ti18  1  0.95954500  0.25152300  0.28876300  1
  Ti  Ti19  1  0.25101000  0.96471200  0.78765400  1
  P  P20  1  0.17256300  0.05738100  0.09867600  1
  P  P21  1  0.05458400  0.17940700  0.59715700  1
  P  P22  1  0.15508200  0.44464200  0.07282400  1
  P  P23  1  0.44005900  0.16122900  0.57218800  1
  P  P24  1  0.65111700  0.31862600  0.19378900  1
  P  P25  1  0.34189900  0.68175700  0.30496300  1
  P  P26  1  0.31824300  0.65810100  0.69503700  1
  P  P27  1  0.68137400  0.34888300  0.80621100  1
  P  P28  1  0.83877100  0.55994100  0.42781200  1
  P  P29  1  0.55535800  0.84491800  0.92717600  1
  P  P30  1  0.82059300  0.94541600  0.40284300  1
  P  P31  1  0.94261900  0.82743700  0.90132400  1
  O  O32  1  0.03168300  0.13046400  0.13623000  1
  O  O33  1  0.11782900  0.04042500  0.65450400  1
  O  O34  1  0.08318800  0.18436900  0.43819600  1
  O  O35  1  0.20344600  0.09162000  0.94212600  1
  O  O36  1  0.28633800  0.09039700  0.18682200  1
  O  O37  1  0.10719400  0.30291400  0.65876700  1
  O  O38  1  0.09054600  0.38235900  0.20755900  1
  O  O39  1  0.39938500  0.09496800  0.44794800  1
  O  O40  1  0.37027400  0.11357000  0.71170000  1
  O  O41  1  0.10122400  0.39423200  0.94325300  1
  O  O42  1  0.12277300  0.60377200  0.07426400  1
  O  O43  1  0.31347000  0.41140100  0.07385700  1
  O  O44  1  0.58222300  0.19323600  0.15503400  1
  O  O45  1  0.40748500  0.32054500  0.55830500  1
  O  O46  1  0.59952900  0.12903600  0.58249800  1
  O  O47  1  0.19127100  0.59968800  0.64681700  1
  O  O48  1  0.18344700  0.68896500  0.33062000  1
  O  O49  1  0.69706500  0.19157200  0.84318600  1
  O  O50  1  0.39535200  0.54379800  0.37337600  1
  O  O51  1  0.62197100  0.32954600  0.35373400  1
  O  O52  1  0.82329700  0.10470100  0.36981800  1
  O  O53  1  0.16108300  0.89824100  0.12498100  1
  O  O54  1  0.54399600  0.40847700  0.86884900  1
  O  O55  1  0.37980900  0.67550800  0.14578700  1
  O  O56  1  0.32449200  0.62019100  0.85421300  1
  O  O57  1  0.59152300  0.45600400  0.13115100  1
  O  O58  1  0.10175900  0.83891700  0.87501900  1
  O  O59  1  0.89529900  0.17670300  0.63018200  1
  O  O60  1  0.67045400  0.37802900  0.64626600  1
  O  O61  1  0.45620200  0.60464800  0.62662400  1
  O  O62  1  0.80842800  0.30293500  0.15681400  1
  O  O63  1  0.31103500  0.81655300  0.66938000  1
  O  O64  1  0.40031200  0.80872900  0.35318300  1
  O  O65  1  0.87096400  0.40047100  0.41750200  1
  O  O66  1  0.67945500  0.59251500  0.44169500  1
  O  O67  1  0.80676400  0.41777700  0.84496600  1
  O  O68  1  0.58859900  0.68653000  0.92614300  1
  O  O69  1  0.39622800  0.87722700  0.92573600  1
  O  O70  1  0.60576800  0.89877600  0.05674700  1
  O  O71  1  0.88643000  0.62972600  0.28830000  1
  O  O72  1  0.90503200  0.60061500  0.55205200  1
  O  O73  1  0.61764100  0.90945400  0.79244100  1
  O  O74  1  0.69708600  0.89280600  0.34123300  1
  O  O75  1  0.90960300  0.71366200  0.81317800  1
  O  O76  1  0.90838000  0.79655400  0.05787400  1
  O  O77  1  0.81563100  0.91681200  0.56180400  1
  O  O78  1  0.95957500  0.88217100  0.34549600  1
  O  O79  1  0.86953600  0.96831700  0.86377000  1
