# generated using pymatgen
data_Li6Sn5(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62673300
_cell_length_b   11.41976374
_cell_length_c   13.65259127
_cell_angle_alpha   77.44934400
_cell_angle_beta   74.83760837
_cell_angle_gamma   67.10070028
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Sn5(P2O7)4
_chemical_formula_sum   'Li12 Sn10 P16 O56'
_cell_volume   1323.16831823
_cell_formula_units_Z   2
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  0.03999400  0.87159200  0.57551200  1
  Li  Li1  1  0.43793900  0.65401700  0.67203900  1
  Li  Li2  1  0.00000000  0.50000000  0.50000000  1
  Li  Li3  1  0.56206100  0.34598300  0.32796100  1
  Li  Li4  1  0.96000600  0.12840800  0.42448800  1
  Li  Li5  1  0.17473700  0.05723100  0.24757400  1
  Li  Li6  1  0.05048000  0.87281300  0.05102700  1
  Li  Li7  1  0.41893700  0.70427300  0.15594700  1
  Li  Li8  1  0.00000000  0.50000000  0.00000000  1
  Li  Li9  1  0.58106300  0.29572700  0.84405300  1
  Li  Li10  1  0.94952000  0.12718700  0.94897300  1
  Li  Li11  1  0.82526300  0.94276900  0.75242600  1
  Sn  Sn12  1  0.59682100  0.29408200  0.59708000  1
  Sn  Sn13  1  0.19418200  0.00207600  0.75212300  1
  Sn  Sn14  1  0.26020900  0.26776200  0.57121300  1
  Sn  Sn15  1  0.73979100  0.73223800  0.42878700  1
  Sn  Sn16  1  0.80581800  0.99792400  0.24787700  1
  Sn  Sn17  1  0.40317900  0.70591800  0.40292000  1
  Sn  Sn18  1  0.58644400  0.30552700  0.10096900  1
  Sn  Sn19  1  0.26569700  0.25803600  0.07828000  1
  Sn  Sn20  1  0.73430300  0.74196400  0.92172000  1
  Sn  Sn21  1  0.41355600  0.69447300  0.89903100  1
  P  P22  1  0.22432000  0.58129100  0.59540900  1
  P  P23  1  0.67932000  0.78996500  0.65933400  1
  P  P24  1  0.89723900  0.29759900  0.71721100  1
  P  P25  1  0.71807600  0.00789500  0.51372700  1
  P  P26  1  0.28192400  0.99210500  0.48627300  1
  P  P27  1  0.10276100  0.70240100  0.28278900  1
  P  P28  1  0.32068000  0.21003500  0.34066600  1
  P  P29  1  0.77568000  0.41870900  0.40459100  1
  P  P30  1  0.22511700  0.58039400  0.09425500  1
  P  P31  1  0.66477100  0.81251500  0.15791900  1
  P  P32  1  0.89437100  0.30091100  0.21695700  1
  P  P33  1  0.71368500  0.01502600  0.99503900  1
  P  P34  1  0.28631500  0.98497400  0.00496100  1
  P  P35  1  0.10562900  0.69908900  0.78304300  1
  P  P36  1  0.33522900  0.18748500  0.84208100  1
  P  P37  1  0.77488300  0.41960600  0.90574500  1
  O  O38  1  0.04604900  0.83586300  0.72672300  1
  O  O39  1  0.11737100  0.60024200  0.70791700  1
  O  O40  1  0.25862600  0.16351600  0.76507100  1
  O  O41  1  0.39427400  0.53628700  0.60498900  1
  O  O42  1  0.54053400  0.74833900  0.70557700  1
  O  O43  1  0.84066400  0.00469900  0.56801900  1
  O  O44  1  0.61121700  0.93209300  0.59174800  1
  O  O45  1  0.73135400  0.32591900  0.70709800  1
  O  O46  1  0.18335300  0.71304900  0.52834400  1
  O  O47  1  0.18164900  0.48787400  0.55479300  1
  O  O48  1  0.61175100  0.14373800  0.48524400  1
  O  O49  1  0.00206500  0.33376500  0.61975300  1
  O  O50  1  0.79885400  0.70241100  0.58074100  1
  O  O51  1  0.20770800  0.06807300  0.58109400  1
  O  O52  1  0.79229200  0.93192700  0.41890600  1
  O  O53  1  0.20114600  0.29758900  0.41925900  1
  O  O54  1  0.99793500  0.66623500  0.38024700  1
  O  O55  1  0.38824900  0.85626200  0.51475600  1
  O  O56  1  0.81835100  0.51212600  0.44520700  1
  O  O57  1  0.81664700  0.28695100  0.47165600  1
  O  O58  1  0.26864600  0.67408100  0.29290200  1
  O  O59  1  0.38878300  0.06790700  0.40825200  1
  O  O60  1  0.15933600  0.99530100  0.43198100  1
  O  O61  1  0.45946600  0.25166100  0.29442300  1
  O  O62  1  0.03559300  0.84281600  0.23052100  1
  O  O63  1  0.60572600  0.46371300  0.39501100  1
  O  O64  1  0.74137400  0.83648400  0.23492900  1
  O  O65  1  0.11411400  0.60804000  0.20514800  1
  O  O66  1  0.88262900  0.39975800  0.29208300  1
  O  O67  1  0.25018500  0.18646200  0.26272800  1
  O  O68  1  0.39477400  0.53426300  0.10645400  1
  O  O69  1  0.95395100  0.16413700  0.27327700  1
  O  O70  1  0.52185900  0.78021700  0.21311100  1
  O  O71  1  0.85183500  0.00080400  0.04002200  1
  O  O72  1  0.60443200  0.95237700  0.08681900  1
  O  O73  1  0.72731700  0.33702600  0.20309000  1
  O  O74  1  0.19078400  0.70978700  0.02408100  1
  O  O75  1  0.17918000  0.48764400  0.05682300  1
  O  O76  1  0.61602900  0.15540000  0.97076700  1
  O  O77  1  0.00371100  0.32979900  0.11920400  1
  O  O78  1  0.78028600  0.71748500  0.08547800  1
  O  O79  1  0.23485800  0.06039400  0.09666800  1
  O  O80  1  0.76514200  0.93960500  0.90333200  1
  O  O81  1  0.21971400  0.28251500  0.91452200  1
  O  O82  1  0.99628900  0.67020100  0.88079600  1
  O  O83  1  0.38397100  0.84460000  0.02923300  1
  O  O84  1  0.82082000  0.51235600  0.94317700  1
  O  O85  1  0.80921600  0.29021300  0.97591900  1
  O  O86  1  0.27268300  0.66297400  0.79691000  1
  O  O87  1  0.39556800  0.04762300  0.91318100  1
  O  O88  1  0.14816500  0.99919600  0.95997800  1
  O  O89  1  0.47814100  0.21978300  0.78688900  1
  O  O90  1  0.60522600  0.46573700  0.89354600  1
  O  O91  1  0.74981500  0.81353800  0.73727200  1
  O  O92  1  0.88588600  0.39196000  0.79485200  1
  O  O93  1  0.96440700  0.15718400  0.76947900  1
