%chk=000071954.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071954

1 1
 O  -0.1104000      0.4758000     -0.5562000    
 N   -3.011000       2.694200      0.2126000    
 C   -1.797600       2.183200     -0.5506000    
 C   -1.265800      0.9378000      0.1309000    
 C   -2.614800       2.998800       1.650100    
 C   -3.529600       3.962300     -0.4502000    
 C   -4.101800       1.633100      0.2010000    
 C   0.4239000     -0.6936000      4.9500000E-02
 C    1.719600      -1.087900     -0.6785000    
 C  -0.6349000      -1.773000      1.5500000E-02
 C    2.899500     -0.2214000     -0.3171000    
 C   -1.545800      -1.794800      -1.027000    
 C  -0.6715000      -2.717100       1.027800    
 C    3.155300      0.9238000      -1.056200    
 C    3.710000     -0.5839000      0.7482000    
 C   -2.522400      -2.790400      -1.058100    
 C   -1.648000      -3.712700      0.9965000    
 C   -2.573300      -3.749400     -4.6399999E-02
 C    4.247000       1.725300     -0.7220000    
 C    4.801500      0.2176000       1.082600    
 C    5.070100       1.372200      0.3474000    
 H   -2.100000       1.975400      -1.584000    
 H   -1.042700       2.978500     -0.5731000    
 H  -0.9381000       1.168900       1.149200    
 H   -2.046400      0.1867000      0.1978000    
 H   -1.708400       3.611300       1.644100    
 H   -3.435600       3.555700       2.114300    
 H   -2.469500       2.071300       2.209500    
 H   -3.807900       3.723100      -1.480900    
 H   -4.401100       4.318800      0.1071000    
 H   -2.733000       4.712000     -0.4315000    
 H   -4.231800       1.270700     -0.8230000    
 H   -3.851700      0.8194000      0.8859000    
 H   -5.029200       2.100200      0.5489000    
 H   0.6577000     -0.4571000       1.097300    
 H    1.568300      -1.052200      -1.766200    
 H    1.978200      -2.131300     -0.4518000    
 H   -1.511300      -1.083600      -1.847300    
 H   4.6300001E-02  -2.697300       1.842700    
 H    2.519900       1.208300      -1.890100    
 H    3.507700      -1.479700       1.328500    
 H   -3.238500      -2.823700      -1.874100    
 H   -1.687100      -4.459900       1.783700    
 H   -3.332500      -4.525600     -7.1900003E-02
 H    4.455900       2.624500      -1.294100    
 H    5.441900     -5.6800000E-02   1.915700    
 H    5.919800       1.996500      0.6079000    


%chk=000071954-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071954

1 1
O -0.217559 0.258851 -0.346928
N -2.797821 2.906383 0.375906
C -1.549425 2.148338 -0.134055
C -1.342477 0.737156 0.441949
C -2.774953 3.018715 1.899389
C -2.770705 4.312629 -0.227409
C -4.080369 2.203547 -0.069167
C 0.367055 -1.024490 0.159753
C 1.653231 -1.238966 -0.673633
C -0.639937 -2.160768 0.048731
C 2.697369 -0.154662 -0.449989
C -1.283348 -2.434215 -1.186954
C -0.935888 -2.968967 1.174061
C 2.838273 0.921724 -1.361626
C 3.547429 -0.198419 0.685445
C -2.201576 -3.500712 -1.293567
C -1.849635 -4.043026 1.067006
C -2.485404 -4.309993 -0.166836
C 3.802601 1.932282 -1.144832
C 4.510223 0.811701 0.909082
C 4.640123 1.882150 -0.006263
H -1.642874 2.074426 -1.231088
H -0.671517 2.773332 0.101240
H -1.080772 0.763116 1.521883
H -2.227670 0.079879 0.306423
H -1.818608 3.465977 2.210372
H -3.611305 3.657676 2.222284
H -2.881600 2.018349 2.341884
H -2.758327 4.230774 -1.324741
H -3.666608 4.863407 0.097824
H -1.864710 4.833878 0.116737
H -4.071094 2.105177 -1.165229
H -4.134432 1.207748 0.392273
H -4.945154 2.807244 0.246553
H 0.646524 -0.873487 1.225617
H 1.369617 -1.298400 -1.740499
H 2.054970 -2.230618 -0.393044
H -1.061439 -1.810855 -2.061306
H -0.440281 -2.770480 2.133217
H 2.197239 0.960302 -2.250562
H 3.473865 -1.039081 1.387888
H -2.687118 -3.711420 -2.252767
H -2.061970 -4.669930 1.939622
H -3.189777 -5.144242 -0.252624
H 3.912402 2.748203 -1.868264
H 5.168187 0.755866 1.783347
H 5.396146 2.657900 0.157295


