%chk=000170145.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170145

0 1
 I   -6.289700      -1.081800      -1.240800    
 O    3.390500       2.712500     -0.1425000    
 O    1.623800       2.469800      -1.546300    
 O  -0.4844000      0.6041000       2.296400    
 O    3.929300      -2.820700      -1.433300    
 O    4.230500      -2.409900      0.7776000    
 N   0.3490000      0.8138000      0.1421000    
 C    1.693600       1.174100      0.5147000    
 C    2.602200     -4.6200000E-02  0.7068000    
 C    2.825600     -0.9154000     -0.5374000    
 C    2.205200       2.161400     -0.5140000    
 C  -0.6418000      0.5552000       1.079300    
 C   -1.969200      0.1705000      0.5341000    
 C    3.718600      -2.112700     -0.2928000    
 C   -2.801700     -0.6171000       1.301800    
 C   -2.326900      0.6131000     -0.7226000    
 C   -4.047900     -0.9785000      0.7898000    
 C   -3.573100      0.2518000      -1.234400    
 C   -4.433600     -0.5440000     -0.4784000    
 H    1.633800       1.718100       1.466200    
 H    3.580600      0.2911000       1.073100    
 H    2.184900     -0.6777000       1.502400    
 H    3.289300     -0.3128000      -1.326200    
 H    1.863500      -1.292000     -0.9018000    
 H   0.1718000      0.6679000     -0.8462000    
 H   -2.514200     -0.9679000       2.288500    
 H   -1.702100       1.261800      -1.327600    
 H   -4.702700      -1.600300       1.395100    
 H   -3.857500      0.6074000      -2.221700    
 H    3.713100       3.363800     -0.8015000    
 H    4.522200      -3.587600      -1.283000    


%chk=000170145-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170145

0 1
I -6.570383 -0.988795 -1.071976
O 3.505384 2.722172 -0.086968
O 1.782783 2.447240 -1.620568
O -0.260949 0.139279 2.180183
O 3.918754 -2.807493 -1.409929
O 4.223370 -2.419873 0.859765
N 0.373357 0.853563 0.071789
C 1.717631 1.225266 0.527429
C 2.654437 0.000576 0.767342
C 2.870720 -0.845660 -0.498874
C 2.298207 2.180946 -0.509060
C -0.563250 0.357557 0.961646
C -1.942847 0.077236 0.424408
C 3.727375 -2.067849 -0.231622
C -2.815894 -0.669069 1.255524
C -2.413705 0.527011 -0.836522
C -4.126666 -0.978836 0.840146
C -3.725445 0.227701 -1.265233
C -4.571234 -0.528492 -0.423444
H 1.634115 1.754536 1.496539
H 3.619841 0.369181 1.154942
H 2.193039 -0.608570 1.562326
H 3.357467 -0.268667 -1.309654
H 1.904756 -1.192916 -0.913453
H 0.146810 1.067395 -0.902981
H -2.444795 -0.993820 2.232923
H -1.788682 1.136965 -1.499293
H -4.787763 -1.558139 1.490205
H -4.079613 0.584316 -2.236285
H 3.866668 3.334611 -0.783794
H 4.479210 -3.605573 -1.208112


