%chk=000039779.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039779

0 1
 N   -1.551600      -2.465400     -0.1508000    
 N   0.1089000       2.637900      -2.484000    
 C  -0.1572000       1.155500     -0.3015000    
 C  -0.7804000     -0.2121000     -0.7487000    
 C  -0.9561000      -1.241700      0.3785000    
 C    1.159000      0.9253000      0.4663000    
 C   -1.206500       1.871400      0.6191000    
 C    2.226100      0.2946000     -0.1446000    
 C    1.180900       1.383700       1.763400    
 C   1.6000000E-03   1.989500      -1.527000    
 C   -2.535300       2.160600     -3.9000001E-02
 C   -1.669700      -3.475600      0.9010000    
 C   -2.862500      -2.185900     -0.7381000    
 C    3.406700      0.1135000      0.6145000    
 C    2.184500     -0.1667000      -1.470400    
 C    2.342100       1.205900       2.509700    
 C    3.448600      0.5751000       1.940200    
 C   -3.763500       1.790400      0.3713000    
 C  -0.3179000      -3.780200       1.524000    
 C   -3.467700      -3.437700      -1.350400    
 C    4.511100     -0.5235000      2.5400000E-02
 C    3.291000     -0.7978000      -2.039600    
 C    4.452100     -0.9759000      -1.293100    
 C   -4.982200       2.199600     -0.4130000    
 C   -4.061800      0.9595000       1.587100    
 H  -0.2622000     -0.7036000      -1.573100    
 H   -1.745900      4.3299999E-02  -1.194700    
 H   -1.564100     -0.8403000       1.194700    
 H   3.9600000E-02  -1.448900      0.7759000    
 H   -1.377800       1.310200       1.539300    
 H  -0.8286000       2.864600      0.9061000    
 H   0.3907000       1.893100       2.294800    
 H   -2.480600       2.784600     -0.9299000    
 H   -2.023900      -4.424500      0.4853000    
 H   -2.375800      -3.172200       1.684300    
 H   -2.792700      -1.495900      -1.581400    
 H   -3.558500      -1.756200     -8.5000005E-03
 H    1.376000      2.4999999E-03  -2.164300    
 H    2.390500       1.559800       3.535700    
 H    4.346000      0.4472000       2.542000    
 H  -0.3881000      -4.699900       2.116200    
 H   1.3600000E-02  -2.996100       2.212000    
 H   0.4550000      -3.942300      0.7647000    
 H   -4.325500      -3.163400      -1.975400    
 H   -3.845600      -4.132800     -0.5945000    
 H   -2.752300      -3.963400      -1.992300    
 H    5.429300     -0.6723000      0.5897000    
 H    3.254800      -1.131900      -3.072600    
 H    5.314900      -1.462800      -1.738400    
 H   -4.731600       2.799000      -1.294600    
 H   -5.524700       1.313400     -0.7587000    
 H   -5.653300       2.796100      0.2138000    
 H   -4.706000       1.522600       2.271200    
 H   -4.592700      4.7100000E-02   1.296600    
 H   -3.182400      0.6557000       2.155000    


%chk=000039779-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039779

0 1
N -1.712658 -2.507865 0.106247
N 0.194622 2.506863 -2.520940
C -0.225601 1.098267 -0.279019
C -0.822094 -0.309651 -0.670745
C -1.006992 -1.270878 0.525977
C 1.092117 0.937343 0.539412
C -1.322579 1.939423 0.495866
C 2.289211 0.352471 -0.045197
C 1.118558 1.303925 1.892074
C 0.042165 1.862524 -1.527228
C -2.582216 2.190493 -0.305716
C -1.285999 -3.708854 0.874621
C -3.189644 -2.333574 0.062629
C 3.454749 0.145870 0.801226
C 2.405404 -0.034066 -1.425942
C 2.269181 1.106552 2.714320
C 3.417282 0.529865 2.180868
C -3.872082 1.957086 0.075712
C 0.096025 -4.233707 0.440822
C -3.886918 -3.311154 -0.902497
C 4.643880 -0.439240 0.251947
C 3.577823 -0.597908 -1.933514
C 4.710390 -0.811591 -1.089930
C -5.024655 2.315872 -0.849865
C -4.299253 1.358716 1.405352
H -0.171776 -0.815368 -1.402981
H -1.792644 -0.131381 -1.168660
H -1.544933 -0.762190 1.364844
H -0.012168 -1.545729 0.917325
H -1.563862 1.412890 1.433871
H -0.864876 2.910553 0.773555
H 0.240685 1.756970 2.356975
H -2.421456 2.648076 -1.293213
H -2.033414 -4.503869 0.699489
H -1.288444 -3.510332 1.976977
H -3.395650 -1.300674 -0.274545
H -3.639620 -2.424915 1.085726
H 1.577614 0.138539 -2.116182
H 2.234767 1.411555 3.765664
H 4.306077 0.367089 2.801784
H 0.366987 -5.136507 1.019957
H 0.891794 -3.483367 0.599357
H 0.082783 -4.490057 -0.632712
H -4.975861 -3.117689 -0.928114
H -3.743205 -4.364688 -0.601618
H -3.480795 -3.190925 -1.921770
H 5.506978 -0.584136 0.912806
H 3.630747 -0.871456 -2.992811
H 5.623429 -1.255925 -1.500544
H -4.667998 2.742778 -1.802685
H -5.641955 1.424626 -1.080454
H -5.701185 3.053441 -0.373901
H -4.923905 2.079452 1.969518
H -4.926325 0.459368 1.243752
H -3.454206 1.069790 2.051309


