%chk=000032281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032281

0 1
 O   0.3238000       1.282900      -1.464300    
 O    3.474700       1.724300      -1.512100    
 O   -1.907700      0.1139000       1.423600    
 O   -5.507000       2.108400       1.092800    
 N    1.747500       1.165700      0.3566000    
 N   -1.060500     -0.7241000     -0.5779000    
 N   -4.358000      0.1232000      0.6229000    
 N    3.658000       3.953500     -0.9729000    
 N    2.156100      -3.839500     -3.5200000E-02
 N   0.4130000      -5.163100      0.3413000    
 C    2.181800       2.555900      0.3183000    
 C    2.849400       2.790500       1.668400    
 C    2.324300      0.4648000       1.501100    
 C    3.384600       1.410900       2.044100    
 C   0.3278000     -0.7452000     -0.2171000    
 C   0.7880000      0.6611000     -0.5072000    
 C   -3.422300     -0.3509000     -0.3573000    
 C    3.155900       2.683600     -0.8140000    
 C    1.146900      -1.745200      -1.023300    
 C   -3.574900      0.6281000      -1.505900    
 C   -2.069300     -0.2941000      0.2765000    
 C   -4.048300       1.920000     -0.8404000    
 C   -4.755800       1.437400      0.4021000    
 C    1.057800      -3.137700     -0.4456000    
 C  -5.5999998E-03  -3.975200     -0.2037000    
 C    1.719800      -5.049100      0.4292000    
 H    1.330300       3.221500      0.1408000    
 H    3.638300       3.547700       1.668000    
 H    2.092700       3.092200       2.403400    
 H    2.735500     -0.5036000       1.204600    
 H    1.531600      0.3119000       2.241600    
 H    3.543200       1.292700       3.119600    
 H    4.340500       1.233300       1.536900    
 H   0.3781000     -0.9619000      0.8535000    
 H   -3.665800      -1.380400     -0.6358000    
 H   0.8139000      -1.777200      -2.068800    
 H    2.201900      -1.442500      -1.046700    
 H   -4.361500      0.2723000      -2.183700    
 H   -2.673300      0.7873000      -2.104200    
 H   -1.310400      -1.008200      -1.521000    
 H   -4.727400       2.483600      -1.484500    
 H   -3.203200       2.548600     -0.5426000    
 H   -4.669000     -0.4252000       1.418700    
 H    4.332300       4.160100      -1.702500    
 H    3.368200       4.730900     -0.3881000    
 H    3.116800      -3.524700     -6.6799998E-02
 H   -1.052500      -3.787300     -0.3942000    
 H    2.399600      -5.795200      0.8152000    


%chk=000032281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032281

0 1
O 1.794102 0.846230 -1.880163
O 4.756774 3.415927 0.483337
O -1.421770 -0.111895 1.330929
O -5.637209 0.454930 1.722407
N 1.884721 1.454363 0.365064
N -0.540449 -0.670011 -0.747927
N -4.062950 -0.607290 0.322038
N 4.211104 2.238786 -1.456485
N 1.325974 -4.424685 -1.306430
N -0.124171 -5.064899 0.302036
C 2.374718 2.840224 0.066494
C 2.054278 3.615780 1.357897
C 1.665516 1.248880 1.837843
C 2.213705 2.549850 2.471475
C 0.854914 -0.737585 -0.274977
C 1.562223 0.587991 -0.639028
C -2.972859 -0.283602 -0.594032
C 3.902153 2.859231 -0.268302
C 1.615142 -1.917953 -0.924135
C -3.316854 1.193425 -1.014944
C -1.587636 -0.355096 0.095666
C -4.137218 1.746473 0.174559
C -4.730718 0.497889 0.852860
C 1.006765 -3.255471 -0.592572
C 0.110314 -3.681033 0.395525
C 0.625296 -5.484537 -0.733525
H 1.829200 3.210585 -0.821223
H 2.751706 4.456643 1.492988
H 1.018175 3.997837 1.321922
H 2.213776 0.357171 2.190574
H 0.587723 1.101860 2.034217
H 1.667554 2.809018 3.392973
H 3.283903 2.441024 2.716840
H 0.799647 -0.869169 0.817388
H -2.975783 -0.955304 -1.474350
H 1.653794 -1.745235 -2.018629
H 2.666309 -1.869850 -0.572895
H -3.936311 1.165094 -1.928118
H -2.409037 1.779203 -1.234970
H -0.709515 -0.822354 -1.744689
H -4.942242 2.435954 -0.124350
H -3.503004 2.263242 0.917028
H -4.185258 -1.534973 0.730720
H 5.186217 2.207067 -1.754564
H 3.463833 1.765403 -1.989663
H 1.963448 -4.480514 -2.100434
H -0.382181 -3.084343 1.160809
H 0.691982 -6.508282 -1.093782


