%chk=000160511.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160511

0 1
 O    2.361800     -0.6529000       1.884500    
 O    3.093500      -1.575800     -5.2999999E-02
 N   -1.639800      -1.977100     -0.1988000    
 N    3.206700       1.310000     -0.6679000    
 C    1.019500      0.3023000      -1.230700    
 C  -0.2027000     -0.3823000     -0.7630000    
 C    2.038100      0.6226000     -0.1121000    
 C   -1.407000      0.2380000     -0.3271000    
 C   -2.292000     -0.7848000      2.1100000E-02
 C  -0.3766000      -1.744200     -0.6727000    
 C   -1.830200       1.575300     -0.1949000    
 C   -3.584300     -0.5358000      0.4967000    
 C    2.549200     -0.6519000      0.5385000    
 C   -3.120200       1.839500      0.2797000    
 C   -3.982000      0.7985000      0.6196000    
 C    4.165700       1.618500      0.3800000    
 H   0.7407000       1.234200      -1.740700    
 H    1.501100     -0.3200000      -1.998400    
 H    1.550000       1.251000      0.6443000    
 H   0.2821000      -2.569800     -0.9034000    
 H   -2.037000      -2.891700     -3.4100000E-02
 H    2.902900       2.176300      -1.112100    
 H   -1.170800       2.398800     -0.4538000    
 H   -4.255900      -1.345400      0.7615000    
 H   -3.451900       2.869100      0.3842000    
 H   -4.979600       1.026500      0.9862000    
 H    4.668200      0.7285000      0.7709000    
 H    3.708400       2.172700       1.206700    
 H    4.953200       2.254400     -3.8800001E-02
 H    2.704400      -1.472600       2.300100    


%chk=000160511-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000160511

0 1
O 2.664449 -0.636929 1.912607
O 2.882052 -1.776989 -0.098455
N -1.776839 -2.032033 -0.343023
N 3.148571 1.380571 -0.576037
C 1.052340 0.246192 -1.285577
C -0.223471 -0.430491 -0.851091
C 2.009433 0.562435 -0.107015
C -1.413321 0.222676 -0.327516
C -2.372161 -0.807148 -0.017349
C -0.485867 -1.800628 -0.842699
C -1.764613 1.579977 -0.097802
C -3.650499 -0.517384 0.508799
C 2.521578 -0.747258 0.521389
C -3.037538 1.875785 0.427420
C -3.969996 0.838287 0.728630
C 3.996516 2.017545 0.450855
H 0.837434 1.210433 -1.781551
H 1.595139 -0.388406 -2.011637
H 1.474148 1.131547 0.672863
H 0.159461 -2.621733 -1.149853
H -2.211619 -2.945796 -0.239269
H 3.685254 0.900866 -1.310933
H -1.058640 2.386232 -0.329065
H -4.372152 -1.309397 0.739242
H -3.322764 2.918076 0.609100
H -4.952708 1.100700 1.136371
H 4.542624 1.311010 1.116476
H 3.365894 2.656887 1.094364
H 4.736607 2.667630 -0.048473
H 3.056187 -1.480755 2.271731


