%chk=000027149.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027149

1 1
 O   -3.746900      -1.942400     -0.4524000    
 O   -4.560000      0.4208000      0.7590000    
 N    1.612400      0.7910000     -0.5658000    
 C    3.830900     -7.9999998E-04  0.1502000    
 C    3.003400      0.6154000     -0.9748000    
 C    5.290700     -0.2434000     -0.2406000    
 C    6.058400     -0.9347000      0.8868000    
 C  -0.5919000     -7.4500002E-02 -0.4075000    
 C   0.7456000     -0.2060000     -0.7859000    
 C   -1.001700       1.127900      0.2086000    
 C    1.254300       1.941800      1.5300000E-02
 C  -5.8499999E-02   2.141800      0.4177000    
 C   -1.527200      -1.098600     -0.6232000    
 C   -2.343700       1.275900      0.5952000    
 C    7.500300      -1.210200      0.4909000    
 C   -2.856500     -0.9348000     -0.2332000    
 C   -3.263900      0.2500000      0.3747000    
 C   -3.896100      -2.911900      0.5829000    
 C   -5.449400      0.9927000     -0.1978000    
 H    3.793000      0.6517000       1.031400    
 H    3.373800     -0.9514000      0.4528000    
 H    3.404300       1.592700      -1.269200    
 H    3.021600     -1.6799999E-02  -1.870800    
 H    5.768800      0.7125000     -0.4856000    
 H    5.327500     -0.8648000      -1.143600    
 H    5.570800      -1.882300       1.144000    
 H    6.044000     -0.3075000       1.785700    
 H    1.135600      -1.100500      -1.258900    
 H    2.022100       2.692700      0.1591000    
 H  -0.3364000       3.080100      0.8897000    
 H   -1.220800      -2.028800      -1.098100    
 H   -2.676800       2.196000       1.072200    
 H    8.026900     -0.2798000      0.2558000    
 H    7.548500      -1.863800     -0.3859000    
 H    8.031100      -1.703100       1.311400    
 H   -4.243200      -2.438800       1.507000    
 H   -2.949700      -3.432700      0.7596000    
 H   -4.643300      -3.643000      0.2624000    
 H   -5.511600      0.3630000      -1.091000    
 H   -5.122400       2.001000     -0.4707000    
 H   -6.443000       1.057400      0.2540000    


%chk=000027149-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027149

1 1
O -3.808165 -1.880401 -0.584053
O -4.589653 0.638181 0.748192
N 1.700140 0.753435 -0.564206
C 3.971874 -0.088503 0.172311
C 3.134971 0.539959 -0.962926
C 5.447902 -0.268925 -0.253984
C 6.310262 -0.902344 0.863464
C -0.589085 -0.037815 -0.444934
C 0.756646 -0.184888 -0.857108
C -0.961177 1.148696 0.312397
C 1.367203 1.896335 0.163841
C 0.068440 2.105310 0.597107
C -1.575564 -1.033802 -0.727324
C -2.315440 1.326897 0.695994
C 7.784353 -1.078617 0.442063
C -2.894191 -0.865713 -0.304583
C -3.289086 0.372823 0.360468
C -4.474038 -2.522543 0.588896
C -5.689644 0.506019 -0.256044
H 3.923441 0.553604 1.073840
H 3.541297 -1.070353 0.451322
H 3.548506 1.521523 -1.254709
H 3.142760 -0.107009 -1.857342
H 5.880199 0.714072 -0.532928
H 5.502493 -0.906312 -1.160429
H 5.883838 -1.886924 1.142446
H 6.257044 -0.268389 1.771407
H 1.090071 -1.054856 -1.428881
H 2.180648 2.597553 0.355276
H -0.161973 3.014945 1.157946
H -1.312570 -1.960023 -1.248099
H -2.637956 2.229297 1.224081
H 8.247994 -0.106783 0.190451
H 7.871901 -1.734186 -0.444145
H 8.378165 -1.532645 1.254686
H -4.956144 -1.772975 1.239701
H -3.725057 -3.098839 1.159451
H -5.222141 -3.198965 0.153574
H -5.615378 -0.438157 -0.818397
H -5.637218 1.368509 -0.942158
H -6.614666 0.546608 0.334736


