%chk=000102688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102688

0 1
 O   -1.357000     -0.9712000     -0.4905000    
 O   -2.642200      8.2800001E-02   1.107800    
 N   -2.451300       2.367000     -0.4326000    
 C  -0.1259000       1.930100      0.2050000    
 C   -1.368400       1.385000     -0.5123000    
 C    1.047200      0.9794000      0.1637000    
 C   -1.872300      0.1170000      0.1561000    
 C    1.200800      4.6999998E-02   1.176800    
 C    1.947500       1.058000     -0.8863000    
 C    2.284300     -0.8308000       1.139000    
 C    3.031000      0.1802000     -0.9243000    
 C    3.199300     -0.7641000      8.8500001E-02
 C   -1.773500      -2.243900      1.3700000E-02
 C   -1.119300      -3.336500     -0.8047000    
 H  -0.3586000       2.156400       1.255300    
 H   0.1752000       2.888500     -0.2399000    
 H   -1.159600       1.182900      -1.569400    
 H   0.4972000     -1.2100000E-02   2.002200    
 H    1.823200       1.788500      -1.680500    
 H   -3.249300       2.040400     -0.9766000    
 H   -2.152600       3.240300     -0.8653000    
 H    2.415400      -1.566000       1.927600    
 H    3.743100      0.2315000      -1.742700    
 H   -1.472300      -2.337000       1.063100    
 H   -2.863500      -2.327400     -6.0899999E-02
 H    4.042700      -1.447700      5.8800001E-02
 H   -1.415800      -4.325700     -0.4451000    
 H   -1.396500      -3.245800      -1.860100    
 H  -2.8400000E-02  -3.253800     -0.7545000    


%chk=000102688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102688

0 1
O -1.989312 -1.362213 -0.739901
O -1.223969 -0.697174 1.356579
N -2.177670 1.475140 -1.028790
C -0.044842 1.715172 0.226089
C -0.927152 0.781073 -0.643486
C 1.394401 1.233996 0.364258
C -1.358908 -0.472604 0.134641
C 1.788659 0.393802 1.438014
C 2.370301 1.609232 -0.596132
C 3.123698 -0.057142 1.547133
C 3.705519 1.158107 -0.491394
C 4.087027 0.321876 0.583492
C -2.537227 -2.614487 -0.128820
C -3.130656 -3.438815 -1.266187
H -0.527863 1.821908 1.212650
H -0.050452 2.711951 -0.258250
H -0.325425 0.435689 -1.517592
H 1.038984 0.089493 2.176157
H 2.083355 2.268457 -1.426016
H -2.800339 0.909450 -1.613210
H -2.029590 2.420527 -1.393542
H 3.412116 -0.702977 2.384525
H 4.446338 1.461972 -1.240031
H -1.710607 -3.134994 0.387384
H -3.289718 -2.327624 0.627866
H 5.122586 -0.026353 0.670582
H -3.544569 -4.382837 -0.867219
H -3.944391 -2.890483 -1.771238
H -2.359895 -3.687143 -2.015660


