%chk=000141257.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141257

0 1
 O   -3.190900      -1.455400      0.1093000    
 N    2.955400      0.3172000      0.4699000    
 C   -6.294000      0.6532000      0.3119000    
 C   -7.711400      0.5344000     -0.2551000    
 C   -5.381100     -0.5054000     -8.6400002E-02
 C   -8.617800       1.706300      0.1233000    
 C   -3.994600     -0.3604000      0.5267000    
 C   -10.03140       1.505800     -0.4018000    
 C   -1.842000      -1.231200      1.2600000E-02
 C   -1.238500     -0.2988000      0.8482000    
 C   -1.091900      -1.939900     -0.9187000    
 C   0.8941000     -0.7790000     -0.1807000    
 C   0.1344000     -7.1800001E-02  0.7513000    
 C   0.2810000      -1.713100      -1.015700    
 C    2.325800     -0.5435000     -0.2819000    
 C    4.340000      0.4397000      0.2629000    
 C    7.081800      0.6837000     -0.1459000    
 C    4.821100       1.363200     -0.6601000    
 C    5.219600     -0.3626000      0.9830000    
 C    6.195500       1.485400     -0.8651000    
 C    6.593900     -0.2404000      0.7781000    
 C    8.551100      0.8127000     -0.3658000    
 H   -5.850600       1.596700     -2.9899999E-02
 H   -6.351900      0.7092000       1.406100    
 H   -8.159200     -0.4010000      0.1036000    
 H   -7.656600      0.4593000      -1.348300    
 H   -5.820700      -1.459800      0.2290000    
 H   -5.295400     -0.5605000      -1.178800    
 H   -8.651600       1.812300       1.213700    
 H   -8.207500       2.638500     -0.2814000    
 H   -3.579200      0.5986000      0.1902000    
 H   -4.065500     -0.3633000       1.620500    
 H   -10.66290       2.355100     -0.1230000    
 H   -10.03600       1.422500      -1.493200    
 H   -10.47990      0.5981000      1.4500000E-02
 H   -1.788400      0.2510000       1.605800    
 H   -1.565900      -2.668300      -1.570500    
 H   0.5866000      0.6569000       1.418700    
 H   0.8595000      -2.272000      -1.746700    
 H    2.876800      -1.134800      -1.037700    
 H    4.137500       1.991900      -1.224200    
 H    4.847900      -1.084700       1.704900    
 H    6.563200       2.207600      -1.589200    
 H    7.274300     -0.8720000       1.343100    
 H    8.874900      0.1252000      -1.153500    
 H    8.819000       1.833500     -0.6591000    
 H    9.108800      0.5861000      0.5493000    


%chk=000141257-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000141257

0 1
O -3.232675 -1.000985 -0.422123
N 3.144268 0.390200 -0.094296
C -6.533530 0.835824 0.129521
C -8.006662 0.378166 0.036141
C -5.535444 -0.302333 -0.185429
C -9.016935 1.509459 0.333877
C -4.081204 0.158501 -0.074714
C -10.485774 1.042288 0.243732
C -1.844335 -0.839526 -0.389532
C -1.181510 0.368706 -0.035496
C -1.088950 -1.988399 -0.740493
C 0.996345 -0.727530 -0.383655
C 0.223820 0.414241 -0.034750
C 0.313191 -1.927397 -0.736412
C 2.463967 -0.694386 -0.385476
C 4.562678 0.379020 -0.023884
C 7.426107 0.533248 0.127050
C 5.247498 1.577595 -0.364259
C 5.330295 -0.734343 0.427604
C 6.652734 1.644967 -0.301971
C 6.735339 -0.648629 0.502564
C 8.942227 0.606275 0.178342
H -6.369571 1.680520 -0.571981
H -6.339658 1.232585 1.148218
H -8.176099 -0.459625 0.744108
H -8.201274 -0.027836 -0.978405
H -5.696142 -1.149941 0.508059
H -5.711163 -0.686355 -1.208606
H -8.819329 1.918118 1.346063
H -8.849257 2.344501 -0.376794
H -3.871994 0.992563 -0.776592
H -3.845562 0.493368 0.956922
H -11.187398 1.868295 0.461574
H -10.718818 0.659045 -0.767664
H -10.687920 0.228091 0.965016
H -1.749551 1.262804 0.237256
H -1.623357 -2.904411 -1.009252
H 0.756826 1.331889 0.234750
H 0.893320 -2.817884 -1.009487
H 2.963810 -1.645143 -0.673360
H 4.651646 2.440569 -0.678745
H 4.823019 -1.648019 0.759869
H 7.160186 2.577098 -0.579370
H 7.307605 -1.509857 0.869808
H 9.389909 0.281215 -0.781587
H 9.292353 1.636165 0.369502
H 9.354271 -0.046518 0.968257


