%chk=000047390.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047390

0 1
 N   0.5256000     -0.6555000       1.098900    
 C   0.1252000      0.1017000     -9.8600000E-02
 C    1.142700      -1.932200      0.6634000    
 C  -0.6446000      -1.431100       1.578300    
 C    1.410500      0.3631000     -0.9382000    
 C  -0.4409000       1.486200      0.3386000    
 C  -0.9191000     -0.7626000     -0.8557000    
 C   0.2747000      -2.654200       1.703700    
 C    2.539000       1.111000     -0.2155000    
 C   -1.720500       1.457800       1.184700    
 C   -1.427900     -0.1619000      -2.171300    
 C    3.763600       1.254800      -1.108300    
 C   -2.124300       2.860500       1.617300    
 C   -2.504000      -1.037800      -2.797200    
 H    2.216000      -1.991800      0.8841000    
 H    1.023800      -2.324200     -0.3491000    
 H   -1.537400      -1.763600       1.055000    
 H  -0.9993000      -1.105800       2.565200    
 H    1.133900      0.9695000      -1.811700    
 H    1.807500     -0.5661000      -1.364400    
 H  -0.6151000       2.110500     -0.5471000    
 H   0.3094000       2.017600      0.9364000    
 H  -0.6169000      -1.783300      -1.096400    
 H   -1.872900     -0.7962000     -0.3262000    
 H  -0.1448000      -3.614400       1.393600    
 H   0.7480000      -2.762500       2.686400    
 H    2.835700      0.5866000      0.6985000    
 H    2.220400       2.117800      7.0500001E-02
 H   -1.578500      0.8834000       2.100600    
 H   -2.551300       1.016400      0.6270000    
 H  -0.6028000     -6.5800004E-02  -2.885100    
 H   -1.841200      0.8394000      -2.011500    
 H    3.521400       1.808200      -2.021200    
 H    4.157900      0.2744000      -1.394000    
 H    4.554700       1.798000     -0.5818000    
 H   -1.340500       3.327700       2.222100    
 H   -3.038800       2.823700       2.217700    
 H   -2.314600       3.498500      0.7482000    
 H   -2.843700     -0.6007000      -3.741400    
 H   -2.122000      -2.041800      -3.008000    
 H   -3.372400      -1.130800      -2.137200    


%chk=000047390-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047390

0 1
N 0.530042 -0.809567 0.994621
C 0.082833 0.044103 -0.155076
C 1.237995 -2.121713 0.776695
C -0.400438 -1.444948 1.997383
C 1.362822 0.334815 -1.004148
C -0.477996 1.391477 0.405883
C -0.973724 -0.699265 -1.045273
C 0.597613 -2.643789 2.105109
C 2.518573 1.044649 -0.262169
C -1.902993 1.391919 1.010789
C -1.506282 0.062637 -2.283719
C 3.789226 1.145365 -1.133977
C -2.290399 2.789086 1.545067
C -2.608027 -0.730819 -3.021436
H 2.340326 -2.046562 0.736003
H 0.885356 -2.701806 -0.106508
H -1.385618 -1.762259 1.586627
H -0.568625 -0.845822 2.910217
H 1.071831 0.945186 -1.881433
H 1.741038 -0.627662 -1.410167
H -0.452329 2.143721 -0.410003
H 0.230808 1.743424 1.179660
H -0.529300 -1.655104 -1.393699
H -1.842432 -0.976130 -0.413921
H 0.159479 -3.653018 2.075861
H 1.276669 -2.556405 2.967797
H 2.736201 0.497149 0.673779
H 2.203084 2.062318 0.039200
H -1.973062 0.657707 1.834513
H -2.644393 1.080316 0.249250
H -0.677461 0.269228 -2.988178
H -1.910013 1.048267 -1.978894
H 3.591744 1.706591 -2.067704
H 4.154994 0.140590 -1.420772
H 4.607283 1.661181 -0.597716
H -1.587888 3.120843 2.332928
H -3.308613 2.790849 1.976358
H -2.264300 3.544139 0.736162
H -2.974739 -0.184687 -3.910301
H -2.229015 -1.713628 -3.360588
H -3.473770 -0.917876 -2.357921


