%chk=000019669.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019669

0 1
 O   -4.630100      -1.478000      -1.053700    
 O    1.177800      -1.218200      0.6393000    
 O   -1.828200       2.468100      0.7027000    
 O    4.113100       1.054000      -1.019400    
 N   -2.157600     -0.9147000      0.2388000    
 C   -1.355100     -0.2706000       1.276800    
 C   -2.834900      8.8399999E-02 -0.5946000    
 C   -3.145600      -1.825600      0.8333000    
 C  -0.3107000      0.6117000      0.6702000    
 C   -3.675600     -0.6069000      -1.661700    
 C   -3.977900      -2.476200     -0.2679000    
 C   0.9518000      0.1024000      0.3634000    
 C  -0.6018000       1.950900      0.4105000    
 C    1.916700      0.9286000     -0.2008000    
 C   0.3675000       2.779400     -0.1554000    
 C    1.630000       2.271100     -0.4633000    
 C    3.236800      0.3644000     -0.5130000    
 C    3.447900      -1.075600     -0.1864000    
 C    2.421800      -1.763900      0.3546000    
 C    4.818500      -1.612100     -0.4793000    
 C    2.473400      -3.223900      0.7022000    
 C   -2.037700       3.846700      0.4037000    
 H  -0.8777000      -1.030400       1.909000    
 H   -1.985100      0.3054000       1.969100    
 H   -2.134800      0.7104000      -1.156700    
 H   -3.495000      0.7188000      1.3800000E-02
 H   -3.808400      -1.276300       1.514700    
 H   -2.641700      -2.610800       1.408400    
 H   -4.229000      0.1364000      -2.244700    
 H   -3.052300      -1.178800      -2.360200    
 H   -3.363400      -3.110700     -0.9182000    
 H   -4.753000      -3.109300      0.1756000    
 H    2.372400       2.931000     -0.9037000    
 H   0.2128000       3.828000     -0.3848000    
 H    4.963300      -1.708000      -1.560200    
 H    5.006000      -2.587000     -2.2900000E-02
 H    5.586500     -0.9364000     -8.6900003E-02
 H    1.514300      -3.700700      0.4698000    
 H    2.663700      -3.348900       1.772600    
 H    3.234000      -3.773100      0.1418000    
 H   -3.064100       4.087200      0.7001000    
 H   -1.964900       4.042100     -0.6717000    
 H   -1.378100       4.493100      0.9925000    


%chk=000019669-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019669

0 1
O -4.419398 -1.993167 -1.205447
O 1.046480 -1.114752 0.621536
O -1.760784 2.747451 0.823117
O 4.231321 1.013073 -1.026303
N -2.165012 -0.853197 0.227502
C -1.476911 -0.037165 1.269889
C -2.965299 -0.035125 -0.719172
C -3.008607 -1.913067 0.836386
C -0.363085 0.819383 0.694999
C -3.575571 -0.940644 -1.800400
C -3.615139 -2.793606 -0.268192
C 0.892913 0.256846 0.362446
C -0.511325 2.215023 0.475505
C 1.965885 1.006512 -0.186316
C 0.546949 3.002513 -0.066519
C 1.764389 2.393278 -0.395638
C 3.253863 0.357226 -0.525334
C 3.335864 -1.095706 -0.247909
C 2.257555 -1.756228 0.303606
C 4.632178 -1.803546 -0.587986
C 2.168626 -3.213975 0.654200
C -1.972778 4.188806 0.654313
H -1.036877 -0.749234 1.991675
H -2.193384 0.615852 1.818618
H -2.304986 0.712343 -1.195339
H -3.782045 0.519013 -0.191616
H -3.838725 -1.480961 1.452531
H -2.378515 -2.536672 1.499521
H -4.243933 -0.370836 -2.467159
H -2.761443 -1.408343 -2.395276
H -2.798550 -3.308007 -0.820158
H -4.308598 -3.540923 0.152483
H 2.596256 2.965103 -0.819281
H 0.416228 4.075251 -0.230877
H 4.487127 -2.594920 -1.346479
H 5.101149 -2.265757 0.300005
H 5.331702 -1.056914 -0.998935
H 1.300570 -3.676391 0.150158
H 2.021801 -3.344622 1.742544
H 3.081624 -3.749023 0.355862
H -3.001678 4.365251 0.999925
H -1.879229 4.488110 -0.406998
H -1.265007 4.773745 1.271916


