%chk=000134426.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134426

0 1
 O   0.1152000     -0.3401000       1.836000    
 N   -3.926100      -2.286700     -0.1617000    
 C   2.4000001E-03 -0.6817000      0.4410000    
 C   0.2294000      0.7074000     -0.3639000    
 C    1.027200      -1.794200      0.1079000    
 C   -1.413200      -1.259300      0.2239000    
 C    1.521900       1.431400     -0.1904000    
 C  -0.9967000       1.652600     -0.2453000    
 C    1.477000      -1.885600      -1.179900    
 C    1.424400      -2.622700       1.120100    
 C    2.032600       2.206200      -1.231800    
 C   -1.977800       1.543700      -1.188600    
 C    2.220100       1.333300       1.013100    
 C   -1.020700       2.536400      0.7950000    
 C   -1.741800      -1.709400      -1.021700    
 C   -2.266500      -1.292500       1.288200    
 C    2.399500      -2.887900      -1.480100    
 C    2.347000      -3.625000      0.8201000    
 C    3.241600       2.882900      -1.069700    
 C   -3.079200       2.393100      -1.082300    
 C    3.428800       2.010200       1.175300    
 C   -2.122000       3.385700      0.9015000    
 C   -3.022200      -2.218800      -1.164800    
 C   -3.523600      -1.820500       1.041700    
 C    2.834600      -3.757400     -0.4801000    
 C    3.939600       2.784800      0.1339000    
 C   -3.151300       3.314100     -3.7400000E-02
 H   0.2210000      0.4321000      -1.427200    
 H  -0.4505000      0.4225000       2.033900    
 H    1.165600      -1.242200      -1.991400    
 H    1.048800      -2.547700       2.134700    
 H    1.500400       2.293500      -2.175500    
 H   -1.921900      0.8581000      -2.026000    
 H    1.903300      0.7686000       1.874100    
 H  -0.2395000       2.608600       1.542300    
 H   -1.092400      -1.669600      -1.884300    
 H   -2.043400     -0.9531000       2.290500    
 H    2.778100      -2.992900      -2.492800    
 H    2.683400      -4.304500       1.597800    
 H    3.639200       3.486500      -1.880400    
 H   -3.877100       2.342400      -1.817500    
 H    3.973000       1.936400       2.112600    
 H   -2.179200       4.101900       1.716000    
 H   -3.368000      -2.591700      -2.123400    
 H   -4.263900      -1.885900       1.832500    
 H    3.552000      -4.538500     -0.7141000    
 H    4.880600       3.312100      0.2603000    
 H   -4.008100       3.976300      4.4700000E-02


%chk=000134426-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134426

0 1
O -0.195494 -0.267888 1.846539
N -3.891185 -2.608065 -0.795069
C -0.128971 -0.616742 0.417143
C 0.071351 0.705055 -0.447548
C 1.014478 -1.638841 0.272642
C -1.449021 -1.317053 -0.009948
C 1.470249 1.330625 -0.369007
C -1.025034 1.731659 -0.099187
C 1.731721 -1.795715 -0.938548
C 1.302296 -2.505022 1.356607
C 1.934515 2.063599 -1.491748
C -2.245308 1.751713 -0.823935
C 2.298902 1.254937 0.779277
C -0.854399 2.661150 0.963020
C -1.639332 -1.802355 -1.329304
C -2.505379 -1.514917 0.907640
C 2.717885 -2.798344 -1.064784
C 2.291059 -3.505093 1.232091
C 3.192595 2.703885 -1.475387
C -3.270282 2.664850 -0.494198
C 3.560183 1.891936 0.797144
C -1.882697 3.572509 1.297850
C -2.856366 -2.427507 -1.671989
C -3.691244 -2.154400 0.477038
C 3.001087 -3.659728 0.019141
C 4.013065 2.620209 -0.326410
C -3.096012 3.575848 0.573454
H -0.096926 0.407564 -1.500219
H -0.790950 0.524720 1.938701
H 1.555465 -1.121030 -1.783022
H 0.754881 -2.378451 2.294711
H 1.300664 2.140057 -2.384932
H -2.394863 1.047331 -1.650154
H 1.958541 0.683353 1.648153
H 0.104811 2.708109 1.491029
H -0.849346 -1.726404 -2.084039
H -2.402042 -1.192334 1.946987
H 3.270450 -2.899247 -2.005654
H 2.505581 -4.164577 2.080742
H 3.532373 3.263555 -2.354335
H -4.202932 2.664948 -1.069269
H 4.190957 1.815336 1.690224
H -1.729410 4.285570 2.115804
H -3.021525 -2.808888 -2.686328
H -4.521488 -2.314098 1.174766
H 3.767282 -4.437028 -0.078497
H 4.991933 3.112611 -0.309716
H -3.890518 4.285500 0.829324


