%chk=000072181.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072181

0 1
 O   -1.660600      0.8813000     -0.9073000    
 O   -3.330400       3.109600     -0.7092000    
 O    4.957900       1.296300      0.3685000    
 N   0.5233000      0.5138000     -6.3000001E-02
 N   -3.353200      -1.615000     -1.1000000E-02
 N    1.999300      -1.408600     -0.2747000    
 N    2.111400       2.062500      0.2985000    
 N   -4.557100      -1.909800      6.9200002E-02
 N    4.333600     -0.8996000     -3.1500001E-02
 N    3.573400      -3.093100     -0.4402000    
 N   -5.660600      -2.190300      0.1364000    
 C  -0.8027000     -6.4400002E-02 -0.2474000    
 C   -2.958400     -0.3699000      0.6604000    
 C   -1.499200     -0.4583000       1.046100    
 C   -2.985400      0.7736000     -0.3495000    
 C   -3.338900       2.108600      0.2930000    
 C    1.722900     -0.1162000     -8.2800001E-02
 C   0.8138000       1.841100      0.1726000    
 C    2.680400      0.8305000      0.1372000    
 C    4.081700      0.4626000      0.1734000    
 C    3.348700      -1.754600     -0.2387000    
 H  -0.6967000     -0.9238000     -0.9198000    
 H   -3.595400     -0.1914000       1.535100    
 H   -1.283800      0.2700000       1.837900    
 H   -1.185700      -1.444200       1.403700    
 H   -3.670300      0.5839000      -1.184300    
 H   -2.602900       2.391100       1.052500    
 H   -4.334000       2.074000      0.7474000    
 H   4.3200001E-02   2.596300      0.2473000    
 H    1.290100      -2.116400     -0.4349000    
 H   -3.558300       3.950200     -0.2769000    
 H    4.513500      -3.473500     -0.4375000    
 H    2.808700      -3.740100     -0.5985000    


%chk=000072181-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072181

0 1
O -1.258740 -0.515499 -0.269819
O -1.827757 1.409844 -2.375426
O 4.973418 1.178975 0.522414
N 0.444613 0.202099 1.253524
N -3.800222 -1.233168 1.385995
N 1.540925 -0.834558 -0.737795
N 2.261315 1.329564 2.079944
N -4.832658 -1.655180 0.779847
N 3.893707 -0.293832 -0.962634
N 2.844237 -1.697394 -2.517913
N -5.783891 -2.212841 0.341548
C -0.869602 -0.443955 1.167951
C -3.223032 0.095919 0.979089
C -1.995766 0.329166 1.886413
C -2.617654 0.081020 -0.447399
C -2.495689 1.481204 -1.080178
C 1.519354 -0.058867 0.409859
C 0.966963 1.057046 2.267773
C 2.630939 0.637909 0.906472
C 3.923541 0.569578 0.190477
C 2.802145 -0.915628 -1.376379
H -0.796478 -1.490574 1.517613
H -3.981631 0.894631 1.094507
H -1.758232 1.404875 1.931737
H -2.178896 -0.047173 2.903745
H -3.153661 -0.589350 -1.142445
H -1.970750 2.177716 -0.392497
H -3.500878 1.882063 -1.297920
H 0.359540 1.411204 3.096717
H 0.665697 -1.182776 -1.140012
H -0.899649 1.091324 -2.232843
H 3.744419 -1.745559 -2.989838
H 2.102673 -2.341583 -2.780527


