# generated using pymatgen
data_LiSi3H27C9N2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22274380
_cell_length_b   10.03127535
_cell_length_c   23.10733265
_cell_angle_alpha   100.79923481
_cell_angle_beta   92.19591622
_cell_angle_gamma   115.82827387
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiSi3H27C9N2
_chemical_formula_sum   'Li4 Si12 H108 C36 N8'
_cell_volume   1872.68463409
_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  0.87075994  0.94890469  0.97507904  1
  Li  Li1  1  0.12924006  0.05109531  0.02492096  1
  Li  Li2  1  0.51935415  0.89315508  0.49489824  1
  Li  Li3  1  0.48064585  0.10684492  0.50510176  1
  Si  Si4  1  0.21814891  0.14391906  0.90761360  1
  Si  Si5  1  0.78185109  0.85608094  0.09238640  1
  Si  Si6  1  0.80517234  0.83991431  0.84208679  1
  Si  Si7  1  0.19482766  0.16008569  0.15791321  1
  Si  Si8  1  0.01319670  0.70824172  0.89682674  1
  Si  Si9  1  0.98680330  0.29175828  0.10317326  1
  Si  Si10  1  0.70824734  0.16610690  0.40920378  1
  Si  Si11  1  0.29175266  0.83389310  0.59079622  1
  Si  Si12  1  0.28624354  0.81678875  0.35883852  1
  Si  Si13  1  0.71375646  0.18321125  0.64116148  1
  Si  Si14  1  0.58154831  0.74957494  0.37906462  1
  Si  Si15  1  0.41845169  0.25042506  0.62093538  1
  H  H16  1  0.43323184  0.18980431  0.98945565  1
  H  H17  1  0.56676816  0.81019569  0.01054435  1
  H  H18  1  0.47675511  0.35697062  0.96329110  1
  H  H19  1  0.52324489  0.64302938  0.03670890  1
  H  H20  1  0.33007074  0.30276547  0.01246901  1
  H  H21  1  0.66992926  0.69723453  0.98753099  1
  H  H22  1  0.08238880  0.23999714  0.83916827  1
  H  H23  1  0.91761120  0.76000286  0.16083173  1
  H  H24  1  0.12345982  0.34573544  0.91384619  1
  H  H25  1  0.87654018  0.65426456  0.08615381  1
  H  H26  1  0.28389289  0.37765501  0.86951161  1
  H  H27  1  0.71610711  0.62234499  0.13048839  1
  H  H28  1  0.36960763  0.00268878  0.86178923  1
  H  H29  1  0.63039237  0.99731122  0.13821077  1
  H  H30  1  0.24143869  0.01593082  0.80579059  1
  H  H31  1  0.75856131  0.98406918  0.19420941  1
  H  H32  1  0.42570103  0.17679607  0.83975440  1
  H  H33  1  0.57429897  0.82320393  0.16024560  1
  H  H34  1  0.64539135  0.93482925  0.90959507  1
  H  H35  1  0.35460865  0.06517075  0.09040493  1
  H  H36  1  0.80476324  0.08883023  0.88663857  1
  H  H37  1  0.19523676  0.91116977  0.11336143  1
  H  H38  1  0.62555377  0.96085813  0.83694835  1
  H  H39  1  0.37444623  0.03914187  0.16305165  1
  H  H40  1  0.77917981  0.87197024  0.73933345  1
  H  H41  1  0.22082019  0.12802976  0.26066655  1
  H  H42  1  0.97375528  0.00866448  0.77747182  1
  H  H43  1  0.02624472  0.99133552  0.22252818  1
  H  H44  1  0.93528262  0.81657130  0.75019728  1
  H  H45  1  0.06471738  0.18342870  0.24980272  1
  H  H46  1  0.54195598  0.64116451  0.78846977  1
  H  H47  1  0.45804402  0.35883549  0.21153023  1
  H  H48  1  0.66978718  0.55493755  0.79949008  1
  H  H49  1  0.33021282  0.44506245  0.20050992  1
  H  H50  1  0.57324709  0.60501011  0.85913675  1
  H  H51  1  0.42675291  0.39498989  0.14086325  1
  H  H52  1  0.29584279  0.88277351  0.94936378  1
  H  H53  1  0.70415721  0.11722649  0.05063622  1
  H  H54  1  0.16195128  0.79630495  0.99973615  1
  H  H55  1  0.83804872  0.20369505  0.00026385  1
  H  H56  1  0.23373712  0.68788425  0.95042680  1
  H  H57  1  0.76626288  0.31211575  0.04957320  1
  H  H58  1  0.17313597  0.73618361  0.81056817  1
  H  H59  1  0.82686403  0.26381639  0.18943183  1
  H  H60  1  0.10338887  0.55185307  0.82590963  1
  H  H61  1  0.89661113  0.44814693  0.17409037  1
  H  H62  1  0.96761679  0.59698450  0.78676166  1
  H  H63  1  0.03238321  0.40301550  0.21323834  1
  H  H64  1  0.82557791  0.55586579  0.96076000  1
  H  H65  1  0.17442209  0.44413421  0.03924000  1
  H  H66  1  0.73665452  0.48010303  0.88495601  1
  H  H67  1  0.26334548  0.51989697  0.11504399  1
  H  H68  1  0.89919101  0.44805190  0.91158671  1
  H  H69  1  0.10080899  0.55194810  0.08841329  1
  H  H70  1  0.94890479  0.11180072  0.38935974  1
  H  H71  1  0.05109521  0.88819928  0.61064026  1
  H  H72  1  0.00500941  0.30923010  0.40569399  1
  H  H73  1  0.99499059  0.69076990  0.59430601  1
  H  H74  1  0.97218730  0.21035967  0.46397462  1
  H  H75  1  0.02781270  0.78964033  0.53602538  1
  H  H76  1  0.59582853  0.34840630  0.44810699  1
  H  H77  1  0.40417147  0.65159370  0.55189301  1
  H  H78  1  0.72804618  0.34428146  0.50599480  1
  H  H79  1  0.27195382  0.65571854  0.49400520  1
  H  H80  1  0.81058609  0.44328526  0.45024411  1
  H  H81  1  0.18941391  0.55671474  0.54975589  1
  H  H82  1  0.54356880  0.17364466  0.32106362  1
  H  H83  1  0.45643120  0.82635534  0.67893638  1
  H  H84  1  0.75624714  0.28249823  0.32207745  1
  H  H85  1  0.24375286  0.71750177  0.67792255  1
  H  H86  1  0.66541316  0.08217324  0.29691682  1
  H  H87  1  0.33458684  0.91782676  0.70308318  1
  H  H88  1  0.09240149  0.64218827  0.41530905  1
  H  H89  1  0.90759851  0.35781173  0.58469095  1
  H  H90  1  0.00322089  0.62078366  0.34237684  1
  H  H91  1  0.99677911  0.37921634  0.65762316  1
  H  H92  1  0.13014446  0.53333134  0.35308083  1
  H  H93  1  0.86985554  0.46666866  0.64691917  1
  H  H94  1  0.32123177  0.08489379  0.38534436  1
  H  H95  1  0.67876823  0.91510621  0.61465564  1
  H  H96  1  0.11593695  0.94764390  0.35878708  1
  H  H97  1  0.88406305  0.05235610  0.64121292  1
  H  H98  1  0.19927155  0.97251579  0.43273158  1
  H  H99  1  0.80072845  0.02748421  0.56726842  1
  H  H100  1  0.37657313  0.89881113  0.26471307  1
  H  H101  1  0.62342687  0.10118887  0.73528693  1
  H  H102  1  0.31583177  0.70113405  0.25654220  1
  H  H103  1  0.68416823  0.29886595  0.74345780  1
  H  H104  1  0.16614214  0.76716161  0.25460385  1
  H  H105  1  0.83385786  0.23283839  0.74539615  1
  H  H106  1  0.76835400  0.72220687  0.30912067  1
  H  H107  1  0.23164600  0.27779313  0.69087933  1
  H  H108  1  0.61912770  0.75723928  0.27296983  1
  H  H109  1  0.38087230  0.24276072  0.72703017  1
  H  H110  1  0.78816307  0.91019119  0.32103691  1
  H  H111  1  0.21183693  0.08980881  0.67896309  1
  H  H112  1  0.51168854  0.47873764  0.34897911  1
  H  H113  1  0.48831146  0.52126236  0.65102089  1
  H  H114  1  0.37281843  0.50140653  0.39649157  1
  H  H115  1  0.62718157  0.49859347  0.60350843  1
  H  H116  1  0.34756223  0.50487433  0.32014421  1
  H  H117  1  0.65243777  0.49512567  0.67985579  1
  H  H118  1  0.66786994  0.74046024  0.48276239  1
  H  H119  1  0.33213006  0.25953976  0.51723761  1
  H  H120  1  0.79564605  0.71689451  0.43155363  1
  H  H121  1  0.20435395  0.28310549  0.56844637  1
  H  H122  1  0.81738107  0.90263410  0.46074360  1
  H  H123  1  0.18261893  0.09736590  0.53925640  1
  C  C124  1  0.37830129  0.25782332  0.97483731  1
  C  C125  1  0.62169871  0.74217668  0.02516269  1
  C  C126  1  0.17103039  0.28924147  0.87970489  1
  C  C127  1  0.82896961  0.71075853  0.12029511  1
  C  C128  1  0.32166710  0.07653172  0.84816262  1
  C  C129  1  0.67833290  0.92346828  0.15183738  1
  C  C130  1  0.71390940  0.96905705  0.87253807  1
  C  C131  1  0.28609060  0.03094295  0.12746193  1
  C  C132  1  0.88208069  0.88953163  0.77087029  1
  C  C133  1  0.11791931  0.11046837  0.22912971  1
  C  C134  1  0.63306529  0.64078193  0.82072957  1
  C  C135  1  0.36693471  0.35921807  0.17927043  1
  C  C136  1  0.19367262  0.77748568  0.95466167  1
  C  C137  1  0.80632738  0.22251432  0.04533833  1
  C  C138  1  0.06938252  0.64319031  0.82288170  1
  C  C139  1  0.93061748  0.35680969  0.17711830  1
  C  C140  1  0.85137426  0.53244593  0.91506025  1
  C  C141  1  0.14862574  0.46755407  0.08493975  1
  C  C142  1  0.92815245  0.20087522  0.41776451  1
  C  C143  1  0.07184755  0.79912478  0.58223549  1
  C  C144  1  0.70902810  0.34052677  0.45824966  1
  C  C145  1  0.29097190  0.65947323  0.54175034  1
  C  C146  1  0.66213207  0.17487991  0.32984693  1
  C  C147  1  0.33786793  0.82512009  0.67015307  1
  C  C148  1  0.11379947  0.63535552  0.36874504  1
  C  C149  1  0.88620053  0.36464448  0.63125496  1
  C  C150  1  0.22728816  0.97139632  0.38694813  1
  C  C151  1  0.77271184  0.02860368  0.61305187  1
  C  C152  1  0.28767146  0.79442819  0.27601389  1
  C  C153  1  0.71232854  0.20557181  0.72398611  1
  C  C154  1  0.70025056  0.78984522  0.31457896  1
  C  C155  1  0.29974944  0.21015478  0.68542104  1
  C  C156  1  0.43767842  0.53973986  0.35932978  1
  C  C157  1  0.56232158  0.46026014  0.64067022  1
  C  C158  1  0.72837924  0.78261636  0.44520051  1
  C  C159  1  0.27162076  0.21738364  0.55479949  1
  N  N160  1  0.06435600  0.00733392  0.93513502  1
  N  N161  1  0.93564400  0.99266608  0.06486498  1
  N  N162  1  0.94949056  0.85249390  0.89813454  1
  N  N163  1  0.05050944  0.14750610  0.10186546  1
  N  N164  1  0.56781163  0.01732365  0.43581143  1
  N  N165  1  0.43218837  0.98267635  0.56418857  1
  N  N166  1  0.47443176  0.85717395  0.39903635  1
  N  N167  1  0.52556824  0.14282605  0.60096365  1
