%chk=000226793.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226793

0 1
 O    1.973200       1.955100      0.4586000    
 O   -1.963600      -1.951600      0.4655000    
 O    1.048000      -2.554400      0.5077000    
 O   -1.062100       2.562800      0.4981000    
 N    1.181800     -0.2281000      0.6946000    
 N   -1.168900      0.2337000      0.7035000    
 N    2.754600      -1.298400     -0.4662000    
 N   -2.761900       1.294300     -0.4715000    
 C    3.158800      8.7300003E-02 -0.5637000    
 C   -3.158800     -9.3800001E-02 -0.5639000    
 C  -3.9999999E-04  8.8000000E-03   1.498800    
 C    2.047600      0.7499000      0.2540000    
 C   -2.044200     -0.7476000      0.2565000    
 C    1.589000      -1.480200      0.2795000    
 C   -1.597400       1.485000      0.2739000    
 C    3.122700      0.5719000      -2.007000    
 C    4.513900      0.3142000      9.3400002E-02
 C   -4.513000     -0.3248000      9.3500003E-02
 C   -3.119400     -0.5841000      -2.005200    
 H   0.1778000      0.8883000       2.126400    
 H  -0.1706000     -0.8657000       2.135500    
 H    3.264800      -2.064900     -0.8941000    
 H   -3.275900       2.056600     -0.9023000    
 H    3.831100      1.2500000E-02  -2.628200    
 H    2.126300      0.4435000      -2.446400    
 H    3.374400       1.636000      -2.074500    
 H    5.298100     -0.2589000     -0.4135000    
 H    4.794100       1.373100      6.9200002E-02
 H    4.505200      2.4000001E-03   1.144500    
 H   -4.787800      -1.385200      7.3500000E-02
 H   -4.506300     -8.8000000E-03   1.143400    
 H   -5.299900      0.2424000     -0.4159000    
 H   -2.123300     -0.4525000      -2.444500    
 H   -3.365500      -1.649800      -2.068400    
 H   -3.830200     -3.0999999E-02  -2.629100    


%chk=000226793-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226793

0 1
O 2.524508 1.555991 1.527322
O -2.519307 -1.534413 1.547463
O 0.406299 -1.982739 -0.757978
O -0.414661 1.983432 -0.781760
N 1.193236 -0.183710 0.620873
N -1.194847 0.198739 0.618823
N 2.507443 -0.899760 -1.054912
N -2.511423 0.888084 -1.066171
C 3.252512 0.248961 -0.487286
C -3.251433 -0.257063 -0.484638
C -0.000564 0.015682 1.443839
C 2.320128 0.651955 0.684565
C -2.318164 -0.640868 0.692882
C 1.283505 -1.135422 -0.455064
C -1.288790 1.136554 -0.468922
C 3.330135 1.435320 -1.484284
C 4.649776 -0.152623 0.036453
C -4.651221 0.144218 0.032451
C -3.322167 -1.456325 -1.466695
H 0.206006 0.903062 2.067937
H -0.205909 -0.859186 2.085711
H 2.800006 -1.418592 -1.880630
H -2.805672 1.394665 -1.898873
H 3.947824 1.159489 -2.358473
H 2.321704 1.724862 -1.826006
H 3.791441 2.304691 -0.985562
H 5.322858 -0.393137 -0.806308
H 5.084153 0.687793 0.604177
H 4.587164 -1.031562 0.700748
H -5.081708 -0.690796 0.611008
H -4.593870 1.032325 0.684914
H -5.324714 0.369701 -0.814123
H -2.311879 -1.745537 -1.803107
H -3.780184 -2.321416 -0.957603
H -3.939985 -1.194375 -2.345070


