%chk=000121325.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121325

0 1
 O   0.8153000     -0.5284000     -0.6078000    
 N    4.012400      -1.708900      0.8586000    
 C    2.150200     -0.4126000     -0.1278000    
 C    3.046900      2.1700000E-02  -1.284100    
 C  -0.1322000     -0.2200000      0.4174000    
 C    2.609100      -1.751900      0.4504000    
 C    4.512300     -8.2999999E-03 -0.8670000    
 C    4.886100      -1.360900     -0.2629000    
 C  -0.3385000       1.275900      0.4854000    
 C   -1.387500      -1.065300      0.2805000    
 C  -0.9020000       1.987500     -0.5874000    
 C   -2.457900     -0.8012000     -0.5991000    
 C   -1.377200       1.259900      -1.815100    
 C   -2.599300      0.3973000      -1.515700    
 C   6.0800001E-02   1.980200       1.634100    
 C   -1.440900      -2.233100       1.076600    
 C   -1.051800       3.380100     -0.4958000    
 C   -3.551600      -1.697700     -0.6192000    
 C  -9.3599997E-02   3.364100       1.715200    
 C   -2.526000      -3.106400       1.031700    
 C  -0.6481000       4.064300      0.6493000    
 C   -3.586500      -2.836400      0.1827000    
 H    2.230600      0.3619000      0.6468000    
 H    2.765000       1.025900      -1.622600    
 H    2.889200     -0.6401000      -2.145700    
 H   0.2984000     -0.5090000       1.386900    
 H    1.999600      -2.013700       1.321900    
 H    2.445000      -2.557700     -0.2770000    
 H    5.148700      0.1992000      -1.734500    
 H    4.700200      0.7868000     -0.1344000    
 H    4.842100      -2.143500      -1.030300    
 H    5.921000      -1.320400      9.4200000E-02
 H    4.284300      -2.620200       1.226100    
 H   -1.651500       1.989800      -2.587900    
 H  -0.5664000      0.6685000      -2.253400    
 H   -2.964500      2.9300001E-02  -2.484700    
 H   -3.392500       1.035000      -1.101000    
 H   0.5018000       1.455000       2.478200    
 H  -0.6203000      -2.476000       1.749400    
 H   -1.491900       3.941600      -1.316300    
 H   -4.398300      -1.504100      -1.276000    
 H   0.2211000       3.894000       2.609400    
 H   -2.538300      -3.992800       1.658500    
 H  -0.7697000       5.141700      0.7100000    
 H   -4.439400      -3.506900      0.1410000    


%chk=000121325-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121325

0 1
O 0.767962 -0.639162 -0.525449
N 4.174720 -1.410162 0.890726
C 2.180059 -0.406107 -0.146718
C 2.968425 -0.188055 -1.448014
C -0.214335 -0.258866 0.543592
C 2.738134 -1.631460 0.617397
C 4.484615 -0.067377 -1.155012
C 4.981887 -1.283462 -0.343982
C -0.385444 1.255343 0.610098
C -1.472194 -1.092605 0.303355
C -0.849906 1.992214 -0.516926
C -2.499363 -0.795908 -0.642131
C -1.271640 1.256382 -1.775262
C -2.562532 0.430003 -1.559244
C -0.035308 1.941426 1.797024
C -1.586123 -2.270137 1.092410
C -0.945785 3.400331 -0.421459
C -3.595503 -1.697154 -0.745806
C -0.142140 3.348416 1.886487
C -2.678652 -3.150494 0.978708
C -0.596681 4.081572 0.768622
C -3.698805 -2.857150 0.045643
H 2.265518 0.492896 0.498312
H 2.590662 0.713835 -1.963250
H 2.779292 -1.052898 -2.115661
H 0.206564 -0.586969 1.517040
H 2.205657 -1.762318 1.578308
H 2.538837 -2.535334 -0.011127
H 5.049336 0.007929 -2.103748
H 4.680138 0.851646 -0.570074
H 4.913965 -2.195430 -0.992013
H 6.042535 -1.148446 -0.062917
H 4.562462 -2.090166 1.555639
H -1.458741 1.985812 -2.585513
H -0.461139 0.580223 -2.101912
H -2.919693 0.084780 -2.549609
H -3.350751 1.108925 -1.170772
H 0.323853 1.368556 2.661763
H -0.788312 -2.497215 1.810832
H -1.300473 3.969361 -1.289867
H -4.386462 -1.473163 -1.473437
H 0.132136 3.864115 2.813403
H -2.734256 -4.048158 1.604062
H -0.677616 5.173320 0.820511
H -4.560707 -3.524689 -0.065429


