%chk=000075595.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075595

0 1
 O    1.774900      6.6600002E-02   1.764000    
 O    4.479000      -2.568500      -1.170400    
 O    2.857800      -2.339000      0.4062000    
 N    1.275100      0.5303000     -0.4860000    
 C   -3.191600     -0.2691000       1.649900    
 C   -2.206000      4.6900000E-02  0.5443000    
 C   -2.884700      0.2679000     -0.6752000    
 C   -4.513300     -0.2019000      0.9136000    
 C   -4.305600      0.1145000     -0.4477000    
 C  -0.8272000      0.1284000      0.6294000    
 C   -2.179900      0.5746000      -1.827100    
 C  -0.1169000      0.4377000     -0.5319000    
 C   -5.783800     -0.4061000       1.422900    
 C   -5.379300      0.2294000      -1.315000    
 C  -0.7864000      0.6589000      -1.747800    
 C   -6.865700     -0.2903000      0.5484000    
 C   -6.665600      2.4200000E-02 -0.8068000    
 C    2.115300      0.3463000      0.6196000    
 C    3.565400      0.5415000      0.3568000    
 C    4.349600     -0.5224000     -3.9600000E-02
 C    4.081200       1.811700      0.5237000    
 C    5.706900     -0.3083000     -0.2796000    
 C    5.438700       2.025600      0.2838000    
 C    6.251500      0.9657000     -0.1178000    
 C    3.810500      -1.864400     -0.2178000    
 H   -3.147500      0.4893000       2.436800    
 H   -3.019700      -1.273800       2.046700    
 H  -0.3868000     -5.4200001E-02   1.597600    
 H   -2.682600      0.7478000      -2.772700    
 H   -5.939800     -0.6486000       2.468100    
 H   -5.240700      0.4717000      -2.363300    
 H  -0.2239000      0.8996000      -2.647500    
 H   -7.876000     -0.4447000      0.9183000    
 H   -7.524100      0.1089000      -1.468000    
 H    1.726400      0.7635000      -1.368200    
 H    3.454200       2.641600      0.8363000    
 H    6.370000      -1.115200     -0.5805000    
 H    5.862800       3.017400      0.4105000    
 H    7.309000       1.132100     -0.3014000    
 H    4.109800      -3.470200      -1.284300    


%chk=000075595-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075595

0 1
O 1.686624 0.916758 1.773308
O 4.942577 -1.891757 -2.197646
O 2.803362 -1.080013 -2.196646
N 1.267078 0.086475 -0.368234
C -3.415941 0.674953 1.671107
C -2.349238 0.317923 0.641400
C -2.969224 -0.172060 -0.547719
C -4.716142 0.339894 0.947891
C -4.430266 -0.159633 -0.361399
C -0.955199 0.421697 0.758214
C -2.169121 -0.568176 -1.643972
C -0.152654 0.024048 -0.350713
C -6.044467 0.458586 1.391177
C -5.479814 -0.540962 -1.227756
C -0.769589 -0.469179 -1.540686
C -7.097382 0.075652 0.521044
C -6.814802 -0.419685 -0.776753
C 2.108430 0.503578 0.640492
C 3.627137 0.522071 0.381769
C 4.451103 -0.177979 -0.577780
C 4.299141 1.339235 1.333671
C 5.871347 -0.035901 -0.516062
C 5.696971 1.491658 1.360743
C 6.495962 0.793020 0.429216
C 3.958961 -1.048867 -1.680799
H -3.365937 1.742711 1.961572
H -3.298061 0.089916 2.604267
H -0.469851 0.792234 1.662482
H -2.621992 -0.949321 -2.565795
H -6.270178 0.840749 2.393657
H -5.269517 -0.924447 -2.232794
H -0.135767 -0.774910 -2.381671
H -8.138025 0.162766 0.853346
H -7.640733 -0.710774 -1.435760
H 1.720223 -0.269640 -1.234025
H 3.667623 1.835246 2.076303
H 6.474840 -0.591081 -1.237557
H 6.157531 2.144613 2.109745
H 7.586410 0.888372 0.439829
H 4.549581 -2.412369 -2.949167


