# generated using pymatgen
data_Li3As7(H3N)13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.97534885
_cell_length_b   13.17335914
_cell_length_c   23.18452701
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3As7(H3N)13
_chemical_formula_sum   'Li12 As28 H156 N52'
_cell_volume   3046.65210052
_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  0.78626632  0.13009491  0.08537149  1
  Li  Li1  1  0.21373368  0.63009491  0.91462851  1
  Li  Li2  1  0.28626632  0.63009491  0.41462851  1
  Li  Li3  1  0.71373368  0.13009491  0.58537149  1
  Li  Li4  1  0.84975686  0.52670925  0.34135773  1
  Li  Li5  1  0.15024314  0.02670925  0.65864227  1
  Li  Li6  1  0.34975686  0.02670925  0.15864227  1
  Li  Li7  1  0.65024314  0.52670925  0.84135773  1
  Li  Li8  1  0.82866841  0.70810568  0.11694149  1
  Li  Li9  1  0.17133159  0.20810568  0.88305851  1
  Li  Li10  1  0.32866841  0.20810568  0.38305851  1
  Li  Li11  1  0.67133159  0.70810568  0.61694149  1
  As  As12  1  0.90287429  0.98804383  0.43333469  1
  As  As13  1  0.09712571  0.48804383  0.56666531  1
  As  As14  1  0.40287429  0.48804383  0.06666531  1
  As  As15  1  0.59712571  0.98804383  0.93333469  1
  As  As16  1  0.71607606  0.87667713  0.40637286  1
  As  As17  1  0.28392394  0.37667713  0.59362714  1
  As  As18  1  0.21607606  0.37667713  0.09362714  1
  As  As19  1  0.78392394  0.87667713  0.90637286  1
  As  As20  1  0.07284881  0.93890617  0.36257864  1
  As  As21  1  0.92715119  0.43890617  0.63742136  1
  As  As22  1  0.57284881  0.43890617  0.13742136  1
  As  As23  1  0.42715119  0.93890617  0.86257864  1
  As  As24  1  0.82544094  0.15115645  0.39339337  1
  As  As25  1  0.17455906  0.65115645  0.60660663  1
  As  As26  1  0.32544094  0.65115645  0.10660663  1
  As  As27  1  0.67455906  0.15115645  0.89339337  1
  As  As28  1  0.70458578  0.91326787  0.30591173  1
  As  As29  1  0.29541422  0.41326787  0.69408827  1
  As  As30  1  0.20458578  0.41326787  0.19408827  1
  As  As31  1  0.79541422  0.91326787  0.80591173  1
  As  As32  1  0.94476557  0.95507006  0.27618136  1
  As  As33  1  0.05523443  0.45507006  0.72381864  1
  As  As34  1  0.44476557  0.45507006  0.22381864  1
  As  As35  1  0.55523443  0.95507006  0.77618136  1
  As  As36  1  0.78023105  0.09905819  0.29677074  1
  As  As37  1  0.21976895  0.59905819  0.70322926  1
  As  As38  1  0.28023105  0.59905819  0.20322926  1
  As  As39  1  0.71976895  0.09905819  0.79677074  1
  H  H40  1  0.19056212  0.94875751  0.55689854  1
  H  H41  1  0.80943788  0.44875751  0.44310146  1
  H  H42  1  0.69056212  0.44875751  0.94310146  1
  H  H43  1  0.30943788  0.94875751  0.05689854  1
  H  H44  1  0.08364407  0.87705353  0.59043495  1
  H  H45  1  0.91635593  0.37705353  0.40956505  1
  H  H46  1  0.58364407  0.37705353  0.90956505  1
  H  H47  1  0.41635593  0.87705353  0.09043495  1
  H  H48  1  0.03155560  0.97238390  0.55098527  1
  H  H49  1  0.96844440  0.47238390  0.44901473  1
  H  H50  1  0.53155560  0.47238390  0.94901473  1
  H  H51  1  0.46844440  0.97238390  0.05098527  1
  H  H52  1  0.46591238  0.07327398  0.32253333  1
  H  H53  1  0.53408762  0.57327398  0.67746667  1
  H  H54  1  0.96591238  0.57327398  0.17746667  1
  H  H55  1  0.03408762  0.07327398  0.82253333  1
  H  H56  1  0.49614925  0.04498125  0.38859015  1
  H  H57  1  0.50385075  0.54498125  0.61140985  1
  H  H58  1  0.99614925  0.54498125  0.11140985  1
  H  H59  1  0.00385075  0.04498125  0.88859015  1
  H  H60  1  0.34666180  0.02032716  0.36106873  1
  H  H61  1  0.65333820  0.52032716  0.63893127  1
  H  H62  1  0.84666180  0.52032716  0.13893127  1
  H  H63  1  0.15333820  0.02032716  0.86106873  1
  H  H64  1  0.83387305  0.34107310  0.29662460  1
  H  H65  1  0.16612695  0.84107310  0.70337540  1
  H  H66  1  0.33387305  0.84107310  0.20337540  1
  H  H67  1  0.66612695  0.34107310  0.79662460  1
  H  H68  1  0.77316492  0.42227048  0.25009568  1
  H  H69  1  0.22683508  0.92227048  0.74990432  1
  H  H70  1  0.27316492  0.92227048  0.24990432  1
  H  H71  1  0.72683508  0.42227048  0.75009568  1
  H  H72  1  0.93593240  0.40733811  0.25615490  1
  H  H73  1  0.06406760  0.90733811  0.74384510  1
  H  H74  1  0.43593240  0.90733811  0.24384510  1
  H  H75  1  0.56406760  0.40733811  0.75615490  1
  H  H76  1  0.55779777  0.13370107  0.20581363  1
  H  H77  1  0.44220223  0.63370107  0.79418637  1
  H  H78  1  0.05779777  0.63370107  0.29418637  1
  H  H79  1  0.94220223  0.13370107  0.70581363  1
  H  H80  1  0.47385009  0.21041884  0.16334622  1
  H  H81  1  0.52614991  0.71041884  0.83665378  1
  H  H82  1  0.97385009  0.71041884  0.33665378  1
  H  H83  1  0.02614991  0.21041884  0.66334622  1
  H  H84  1  0.41154617  0.17624023  0.22436339  1
  H  H85  1  0.58845383  0.67624023  0.77563661  1
  H  H86  1  0.91154617  0.67624023  0.27563661  1
  H  H87  1  0.08845383  0.17624023  0.72436339  1
  H  H88  1  0.56859757  0.27048946  0.38035993  1
  H  H89  1  0.43140243  0.77048946  0.61964007  1
  H  H90  1  0.06859757  0.77048946  0.11964007  1
  H  H91  1  0.93140243  0.27048946  0.88035993  1
  H  H92  1  0.48545591  0.35170297  0.33989120  1
  H  H93  1  0.51454409  0.85170297  0.66010880  1
  H  H94  1  0.98545591  0.85170297  0.16010880  1
  H  H95  1  0.01454409  0.35170297  0.83989120  1
  H  H96  1  0.49477715  0.36863154  0.41005525  1
  H  H97  1  0.50522285  0.86863154  0.58994475  1
  H  H98  1  0.99477715  0.86863154  0.08994475  1
  H  H99  1  0.00522285  0.36863154  0.91005525  1
  H  H100  1  0.11734398  0.07701525  0.11136998  1
  H  H101  1  0.88265602  0.57701525  0.88863002  1
  H  H102  1  0.61734398  0.57701525  0.38863002  1
  H  H103  1  0.38265602  0.07701525  0.61136998  1
  H  H104  1  0.09404777  0.06591808  0.18108838  1
  H  H105  1  0.90595223  0.56591808  0.81891162  1
  H  H106  1  0.59404777  0.56591808  0.31891162  1
  H  H107  1  0.40595223  0.06591808  0.68108838  1
  H  H108  1  0.16900560  0.16766131  0.15373666  1
  H  H109  1  0.83099440  0.66766131  0.84626334  1
  H  H110  1  0.66900560  0.66766131  0.34626334  1
  H  H111  1  0.33099440  0.16766131  0.65373666  1
  H  H112  1  0.77649168  0.98684193  0.16611946  1
  H  H113  1  0.22350832  0.48684193  0.83388054  1
  H  H114  1  0.27649168  0.48684193  0.33388054  1
  H  H115  1  0.72350832  0.98684193  0.66611946  1
  H  H116  1  0.63485228  0.99050671  0.13069461  1
  H  H117  1  0.36514772  0.49050671  0.86930539  1
  H  H118  1  0.13485228  0.49050671  0.36930539  1
  H  H119  1  0.86514772  0.99050671  0.63069461  1
  H  H120  1  0.76305401  0.93006150  0.10354691  1
  H  H121  1  0.23694599  0.43006150  0.89645309  1
  H  H122  1  0.26305401  0.43006150  0.39645309  1
  H  H123  1  0.73694599  0.93006150  0.60354691  1
  H  H124  1  0.68896900  0.77229385  0.21233077  1
  H  H125  1  0.31103100  0.27229385  0.78766923  1
  H  H126  1  0.18896900  0.27229385  0.28766923  1
  H  H127  1  0.81103100  0.77229385  0.71233077  1
  H  H128  1  0.58672711  0.74506912  0.15854354  1
  H  H129  1  0.41327289  0.24506912  0.84145646  1
  H  H130  1  0.08672711  0.24506912  0.34145646  1
  H  H131  1  0.91327289  0.74506912  0.65854354  1
  H  H132  1  0.65865066  0.65363497  0.19211916  1
  H  H133  1  0.34134934  0.15363497  0.80788084  1
  H  H134  1  0.15865066  0.15363497  0.30788084  1
  H  H135  1  0.84134934  0.65363497  0.69211916  1
  H  H136  1  0.97109527  0.14916448  0.55903187  1
  H  H137  1  0.02890473  0.64916448  0.44096813  1
  H  H138  1  0.47109527  0.64916448  0.94096813  1
  H  H139  1  0.52890473  0.14916448  0.05903187  1
  H  H140  1  0.88193751  0.20223680  0.50866058  1
  H  H141  1  0.11806249  0.70223680  0.49133942  1
  H  H142  1  0.38193751  0.70223680  0.99133942  1
  H  H143  1  0.61806249  0.20223680  0.00866058  1
  H  H144  1  0.91183347  0.26307945  0.57011185  1
  H  H145  1  0.08816653  0.76307945  0.42988815  1
  H  H146  1  0.41183347  0.76307945  0.92988815  1
  H  H147  1  0.58816653  0.26307945  0.07011185  1
  H  H148  1  0.42884133  0.77874616  0.36513846  1
  H  H149  1  0.57115867  0.27874616  0.63486154  1
  H  H150  1  0.92884133  0.27874616  0.13486154  1
  H  H151  1  0.07115867  0.77874616  0.86513846  1
  H  H152  1  0.37990630  0.69957610  0.31452828  1
  H  H153  1  0.62009370  0.19957610  0.68547172  1
  H  H154  1  0.87990630  0.19957610  0.18547172  1
  H  H155  1  0.12009370  0.69957610  0.81452828  1
  H  H156  1  0.27215137  0.77852671  0.34364497  1
  H  H157  1  0.72784863  0.27852671  0.65635503  1
  H  H158  1  0.77215137  0.27852671  0.15635503  1
  H  H159  1  0.22784863  0.77852671  0.84364497  1
  H  H160  1  0.62061181  0.12005190  0.48204293  1
  H  H161  1  0.37938819  0.62005190  0.51795707  1
  H  H162  1  0.12061181  0.62005190  0.01795707  1
  H  H163  1  0.87938819  0.12005190  0.98204293  1
  H  H164  1  0.52350917  0.04141532  0.51673826  1
  H  H165  1  0.47649083  0.54141532  0.48326174  1
  H  H166  1  0.02350917  0.54141532  0.98326174  1
  H  H167  1  0.97649083  0.04141532  0.01673826  1
  H  H168  1  0.49723907  0.16357223  0.52266306  1
  H  H169  1  0.50276093  0.66357223  0.47733694  1
  H  H170  1  0.99723907  0.66357223  0.97733694  1
  H  H171  1  0.00276093  0.16357223  0.02266306  1
  H  H172  1  0.87296868  0.68581557  0.55104080  1
  H  H173  1  0.12703132  0.18581557  0.44895920  1
  H  H174  1  0.37296868  0.18581557  0.94895920  1
  H  H175  1  0.62703132  0.68581557  0.05104080  1
  H  H176  1  0.74904524  0.62408923  0.52180544  1
  H  H177  1  0.25095476  0.12408923  0.47819456  1
  H  H178  1  0.24904524  0.12408923  0.97819456  1
  H  H179  1  0.75095476  0.62408923  0.02180544  1
  H  H180  1  0.77132919  0.74423573  0.50565766  1
  H  H181  1  0.22867081  0.24423573  0.49434234  1
  H  H182  1  0.27132919  0.24423573  0.99434234  1
  H  H183  1  0.72867081  0.74423573  0.00565766  1
  H  H184  1  0.28251030  0.88804074  0.45525314  1
  H  H185  1  0.71748970  0.38804074  0.54474686  1
  H  H186  1  0.78251030  0.38804074  0.04474686  1
  H  H187  1  0.21748970  0.88804074  0.95525314  1
  H  H188  1  0.44538576  0.89655467  0.46272613  1
  H  H189  1  0.55461424  0.39655467  0.53727387  1
  H  H190  1  0.94538576  0.39655467  0.03727387  1
  H  H191  1  0.05461424  0.89655467  0.96272613  1
  H  H192  1  0.35771124  0.82426042  0.50619285  1
  H  H193  1  0.64228876  0.32426042  0.49380715  1
  H  H194  1  0.85771124  0.32426042  0.99380715  1
  H  H195  1  0.14228876  0.82426042  0.00619285  1
  N  N196  1  0.10353120  0.95165752  0.58048994  1
  N  N197  1  0.89646880  0.45165752  0.41951006  1
  N  N198  1  0.60353120  0.45165752  0.91951006  1
  N  N199  1  0.39646880  0.95165752  0.08048994  1
  N  N200  1  0.42193767  0.07355455  0.36240263  1
  N  N201  1  0.57806233  0.57355455  0.63759737  1
  N  N202  1  0.92193767  0.57355455  0.13759737  1
  N  N203  1  0.07806233  0.07355455  0.86240263  1
  N  N204  1  0.84868724  0.41207775  0.27955495  1
  N  N205  1  0.15131276  0.91207775  0.72044505  1
  N  N206  1  0.34868724  0.91207775  0.22044505  1
  N  N207  1  0.65131276  0.41207775  0.77955495  1
  N  N208  1  0.46370338  0.14818133  0.18991133  1
  N  N209  1  0.53629662  0.64818133  0.81008867  1
  N  N210  1  0.96370338  0.64818133  0.31008867  1
  N  N211  1  0.03629662  0.14818133  0.68991133  1
  N  N212  1  0.48343893  0.31447157  0.37882619  1
  N  N213  1  0.51656107  0.81447157  0.62117381  1
  N  N214  1  0.98343893  0.81447157  0.12117381  1
  N  N215  1  0.01656107  0.31447157  0.87882619  1
  N  N216  1  0.16117589  0.09014454  0.15047562  1
  N  N217  1  0.83882411  0.59014454  0.84952438  1
  N  N218  1  0.66117589  0.59014454  0.34952438  1
  N  N219  1  0.33882411  0.09014454  0.65047562  1
  N  N220  1  0.73661017  0.99421841  0.12558541  1
  N  N221  1  0.26338983  0.49421841  0.87441459  1
  N  N222  1  0.23661017  0.49421841  0.37441459  1
  N  N223  1  0.76338983  0.99421841  0.62558541  1
  N  N224  1  0.67670309  0.72573331  0.17721960  1
  N  N225  1  0.32329691  0.22573331  0.82278040  1
  N  N226  1  0.17670309  0.22573331  0.32278040  1
  N  N227  1  0.82329691  0.72573331  0.67721960  1
  N  N228  1  0.88819490  0.19330719  0.55245726  1
  N  N229  1  0.11180510  0.69330719  0.44754274  1
  N  N230  1  0.38819490  0.69330719  0.94754274  1
  N  N231  1  0.61180510  0.19330719  0.05245726  1
  N  N232  1  0.35190639  0.73189150  0.35286849  1
  N  N233  1  0.64809361  0.23189150  0.64713151  1
  N  N234  1  0.85190639  0.23189150  0.14713151  1
  N  N235  1  0.14809361  0.73189150  0.85286849  1
  N  N236  1  0.57108249  0.10982279  0.52081753  1
  N  N237  1  0.42891751  0.60982279  0.47918247  1
  N  N238  1  0.07108249  0.60982279  0.97918247  1
  N  N239  1  0.92891751  0.10982279  0.02081753  1
  N  N240  1  0.77431498  0.69299870  0.53903500  1
  N  N241  1  0.22568502  0.19299870  0.46096500  1
  N  N242  1  0.27431498  0.19299870  0.96096500  1
  N  N243  1  0.72568502  0.69299870  0.03903500  1
  N  N244  1  0.35736212  0.89325993  0.48560098  1
  N  N245  1  0.64263788  0.39325993  0.51439902  1
  N  N246  1  0.85736212  0.39325993  0.01439902  1
  N  N247  1  0.14263788  0.89325993  0.98560098  1
