# generated using pymatgen
data_Li3P11(H3N)17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.99024100
_cell_length_b   12.58411455
_cell_length_c   12.59736594
_cell_angle_alpha   89.96228250
_cell_angle_beta   99.86720354
_cell_angle_gamma   99.64926506
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3P11(H3N)17
_chemical_formula_sum   'Li6 P22 H102 N34'
_cell_volume   1845.39154044
_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  0.74606700  0.97812400  0.23950300  1
  Li  Li1  1  0.25393300  0.02187600  0.76049700  1
  Li  Li2  1  0.87374800  0.39194100  0.28401500  1
  Li  Li3  1  0.12625200  0.60805900  0.71598500  1
  Li  Li4  1  0.78155100  0.74685200  0.91500400  1
  Li  Li5  1  0.21844900  0.25314800  0.08499600  1
  P  P6  1  0.73802100  0.23610800  0.57770300  1
  P  P7  1  0.26197900  0.76389200  0.42229700  1
  P  P8  1  0.59324400  0.31143700  0.78044100  1
  P  P9  1  0.40675600  0.68856300  0.21955900  1
  P  P10  1  0.70570200  0.06880400  0.80247800  1
  P  P11  1  0.29429800  0.93119600  0.19752200  1
  P  P12  1  0.75535000  0.41970500  0.76005000  1
  P  P13  1  0.24465000  0.58029500  0.23995000  1
  P  P14  1  0.89895800  0.21467400  0.68878900  1
  P  P15  1  0.10104200  0.78532600  0.31121100  1
  P  P16  1  0.78313900  0.19539500  0.92952200  1
  P  P17  1  0.21686100  0.80460500  0.07047800  1
  P  P18  1  0.88542700  0.31569300  0.83295400  1
  P  P19  1  0.11457300  0.68430700  0.16704600  1
  P  P20  1  0.85640800  0.04792100  0.73474600  1
  P  P21  1  0.14359200  0.95207900  0.26525400  1
  P  P22  1  0.74769600  0.40969800  0.58706400  1
  P  P23  1  0.25230400  0.59030200  0.41293600  1
  P  P24  1  0.60620300  0.16630500  0.68003200  1
  P  P25  1  0.39379700  0.83369500  0.31996800  1
  P  P26  1  0.63363700  0.26629500  0.94745000  1
  P  P27  1  0.36636300  0.73370500  0.05255000  1
  H  H28  1  0.89093900  0.93801900  0.92694600  1
  H  H29  1  0.10906100  0.06198100  0.07305400  1
  H  H30  1  0.96347400  0.87800300  0.02599600  1
  H  H31  1  0.03652600  0.12199700  0.97400400  1
  H  H32  1  0.85022900  0.92643900  0.04422100  1
  H  H33  1  0.14977100  0.07356100  0.95577900  1
  H  H34  1  0.99941200  0.46302000  0.13699100  1
  H  H35  1  0.00058800  0.53698000  0.86300900  1
  H  H36  1  0.98199300  0.33095000  0.13008400  1
  H  H37  1  0.01800700  0.66905000  0.86991600  1
  H  H38  1  0.87560700  0.39185300  0.07949400  1
  H  H39  1  0.12439300  0.60814700  0.92050600  1
  H  H40  1  0.86802200  0.13454800  0.15211300  1
  H  H41  1  0.13197800  0.86545200  0.84788700  1
  H  H42  1  0.91114900  0.13990500  0.28478800  1
  H  H43  1  0.08885100  0.86009500  0.71521200  1
  H  H44  1  0.95799200  0.05644200  0.20990800  1
  H  H45  1  0.04200800  0.94355800  0.79009200  1
  H  H46  1  0.73739200  0.78843800  0.15630300  1
  H  H47  1  0.26260800  0.21156200  0.84369700  1
  H  H48  1  0.86087600  0.80681200  0.23986600  1
  H  H49  1  0.13912400  0.19318800  0.76013400  1
  H  H50  1  0.73953300  0.77662000  0.28467300  1
  H  H51  1  0.26046700  0.22338000  0.71532700  1
  H  H52  1  0.94918300  0.38249000  0.48413800  1
  H  H53  1  0.05081700  0.61751000  0.51586200  1
  H  H54  1  0.01461700  0.29722500  0.42955800  1
  H  H55  1  0.98538300  0.70277500  0.57044200  1
  H  H56  1  0.05504500  0.42958100  0.41910000  1
  H  H57  1  0.94495500  0.57041900  0.58090000  1
  H  H58  1  0.54536000  0.92556700  0.11182700  1
  H  H59  1  0.45464000  0.07443300  0.88817300  1
  H  H60  1  0.57305800  0.05715100  0.12462300  1
  H  H61  1  0.42694200  0.94284900  0.87537700  1
  H  H62  1  0.63733900  0.99754300  0.04538500  1
  H  H63  1  0.36266100  0.00245700  0.95461500  1
  H  H64  1  0.87374500  0.75623500  0.72480700  1
  H  H65  1  0.12625500  0.24376500  0.27519300  1
  H  H66  1  0.77475800  0.65075700  0.73220400  1
  H  H67  1  0.22524200  0.34924300  0.26779600  1
  H  H68  1  0.73955200  0.77131900  0.71173900  1
  H  H69  1  0.26044800  0.22868100  0.28826100  1
  H  H70  1  0.75072000  0.60135500  0.05603200  1
  H  H71  1  0.24928000  0.39864500  0.94396800  1
  H  H72  1  0.88839400  0.62065700  0.04986200  1
  H  H73  1  0.11160600  0.37934300  0.95013800  1
  H  H74  1  0.79407600  0.54535200  0.95692800  1
  H  H75  1  0.20592400  0.45464800  0.04307200  1
  H  H76  1  0.90468000  0.60389900  0.30512600  1
  H  H77  1  0.09532000  0.39610100  0.69487400  1
  H  H78  1  0.80699200  0.55255700  0.37684800  1
  H  H79  1  0.19300800  0.44744300  0.62315200  1
  H  H80  1  0.77181200  0.54998700  0.24450400  1
  H  H81  1  0.22818800  0.45001300  0.75549600  1
  H  H82  1  0.71065200  0.21973500  0.31421200  1
  H  H83  1  0.28934800  0.78026500  0.68578800  1
  H  H84  1  0.66175300  0.33206400  0.28406500  1
  H  H85  1  0.33824700  0.66793600  0.71593500  1
  H  H86  1  0.68971900  0.25812100  0.18703800  1
  H  H87  1  0.31028100  0.74187900  0.81296200  1
  H  H88  1  0.61068600  0.98531300  0.38370600  1
  H  H89  1  0.38931400  0.01468700  0.61629400  1
  H  H90  1  0.73297800  0.06422000  0.43286700  1
  H  H91  1  0.26702200  0.93578000  0.56713300  1
  H  H92  1  0.72408900  0.93339900  0.43033600  1
  H  H93  1  0.27591100  0.06660100  0.56966400  1
  H  H94  1  0.55616200  0.75915900  0.94544900  1
  H  H95  1  0.44383800  0.24084100  0.05455100  1
  H  H96  1  0.61823900  0.85071700  0.87056700  1
  H  H97  1  0.38176100  0.14928300  0.12943300  1
  H  H98  1  0.56747900  0.72706700  0.82238500  1
  H  H99  1  0.43252100  0.27293300  0.17761500  1
  H  H100  1  0.46844500  0.33685600  0.35882900  1
  H  H101  1  0.53155500  0.66314400  0.64117100  1
  H  H102  1  0.57016100  0.43443700  0.41314100  1
  H  H103  1  0.42983900  0.56556300  0.58685900  1
  H  H104  1  0.45481700  0.46359400  0.33710000  1
  H  H105  1  0.54518300  0.53640600  0.66290000  1
  H  H106  1  0.61795900  0.67545300  0.37443000  1
  H  H107  1  0.38204100  0.32454700  0.62557000  1
  H  H108  1  0.63630200  0.71112500  0.50206900  1
  H  H109  1  0.36369800  0.28887500  0.49793100  1
  H  H110  1  0.74408800  0.73511200  0.43693300  1
  H  H111  1  0.25591200  0.26488800  0.56306700  1
  H  H112  1  0.51984100  0.85750100  0.66210300  1
  H  H113  1  0.48015900  0.14249900  0.33789700  1
  H  H114  1  0.63306800  0.91532400  0.61559200  1
  H  H115  1  0.36693200  0.08467600  0.38440800  1
  H  H116  1  0.52233800  0.84734900  0.53307100  1
  H  H117  1  0.47766200  0.15265100  0.46692900  1
  H  H118  1  0.91450900  0.91816600  0.58313500  1
  H  H119  1  0.08549100  0.08183400  0.41686500  1
  H  H120  1  0.85910200  0.81029100  0.50779100  1
  H  H121  1  0.14089800  0.18970900  0.49220900  1
  H  H122  1  0.97269800  0.88716800  0.47798300  1
  H  H123  1  0.02730200  0.11283200  0.52201700  1
  H  H124  1  0.58071800  0.46304900  0.20540000  1
  H  H125  1  0.41928200  0.53695100  0.79460000  1
  H  H126  1  0.56345800  0.57936100  0.15505800  1
  H  H127  1  0.43654200  0.42063900  0.84494200  1
  H  H128  1  0.58386200  0.48360200  0.07543200  1
  H  H129  1  0.41613800  0.51639800  0.92456800  1
  N  N130  1  0.88224100  0.88575900  0.98897800  1
  N  N131  1  0.11775900  0.11424100  0.01102200  1
  N  N132  1  0.94189800  0.39419400  0.14326900  1
  N  N133  1  0.05810200  0.60580600  0.85673100  1
  N  N134  1  0.88670100  0.08908500  0.21810800  1
  N  N135  1  0.11329900  0.91091500  0.78189200  1
  N  N136  1  0.77840000  0.82203700  0.22967300  1
  N  N137  1  0.22160000  0.17796300  0.77032700  1
  N  N138  1  0.98547800  0.36919800  0.41835200  1
  N  N139  1  0.01452200  0.63080200  0.58164800  1
  N  N140  1  0.61100800  0.99087500  0.11869500  1
  N  N141  1  0.38899200  0.00912500  0.88130500  1
  N  N142  1  0.79948500  0.73099800  0.75416400  1
  N  N143  1  0.20051500  0.26900200  0.24583600  1
  N  N144  1  0.80809600  0.61477300  0.00379600  1
  N  N145  1  0.19190400  0.38522700  0.99620400  1
  N  N146  1  0.83743700  0.54231000  0.30697400  1
  N  N147  1  0.16256300  0.45769000  0.69302600  1
  N  N148  1  0.71784900  0.28459000  0.26551700  1
  N  N149  1  0.28215100  0.71541000  0.73448300  1
  N  N150  1  0.69823500  0.99590100  0.38622200  1
  N  N151  1  0.30176500  0.00409900  0.61377800  1
  N  N152  1  0.61033400  0.77080000  0.89013800  1
  N  N153  1  0.38966600  0.22920000  0.10986200  1
  N  N154  1  0.51226700  0.41093100  0.34364900  1
  N  N155  1  0.48773300  0.58906900  0.65635100  1
  N  N156  1  0.67374700  0.67914700  0.44556500  1
  N  N157  1  0.32625300  0.32085300  0.55443500  1
  N  N158  1  0.57188500  0.84668500  0.60798400  1
  N  N159  1  0.42811500  0.15331500  0.39201600  1
  N  N160  1  0.93543300  0.85650500  0.54086000  1
  N  N161  1  0.06456700  0.14349500  0.45914000  1
  N  N162  1  0.60950900  0.51807700  0.15111500  1
  N  N163  1  0.39049100  0.48192300  0.84888500  1
