%chk=000170964.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170964

0 1
 O   -6.580800     -0.8579000     -0.2398000    
 O   -5.017600      -2.388800     -0.4644000    
 O    6.209200      -1.622300      0.5298000    
 O    6.693900      0.2218000     -0.5665000    
 N   -5.375700      -1.204500     -0.2583000    
 N    5.868300     -0.5477000     -1.9600000E-02
 C   -2.068300      0.3999000      0.1643000    
 C    1.795100      0.5159000     -3.1399999E-02
 C  -0.6434000      2.4700001E-02  0.1501000    
 C   0.3877000      0.8825000     -3.6400001E-02
 C   -3.029300     -0.5743000     -5.2499998E-02
 C    2.203500     -0.6733000      0.5722000    
 C    2.736100       1.352800     -0.6312000    
 C   -2.419200       1.720200      0.3949000    
 C   -4.378000     -0.2184000     -3.8300000E-02
 C    4.494400     -0.1888000     -2.3600001E-02
 C    3.553200      -1.025600      0.5763000    
 C    4.085800       1.000500     -0.6273000    
 C   -3.767700       2.076200      0.4092000    
 C   -4.747100       1.106900      0.1927000    
 H  -0.4623000      -1.037700      0.2893000    
 H   0.2003000       1.935700     -0.2272000    
 H   -2.720600      -1.601500     -0.2323000    
 H    1.511500      -1.345400       1.070800    
 H    2.436400       2.283000      -1.108200    
 H   -1.693500       2.502900      0.5911000    
 H    3.835600      -1.957100       1.060200    
 H    4.790400       1.676800      -1.104600    
 H   -4.055600       3.107100      0.5942000    
 H   -5.787500       1.421000      0.2123000    


%chk=000170964-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000170964

0 1
O -6.709738 -0.916332 0.281202
O -5.053280 -2.478086 0.410522
O 6.325655 -1.799181 0.128566
O 6.869317 0.406030 -0.107455
N -5.466736 -1.261283 0.292529
N 6.008412 -0.551757 0.006981
C -2.088203 0.461965 0.048323
C 1.824531 0.468424 -0.018874
C -0.675425 0.053056 0.064268
C 0.414593 0.878908 -0.035671
C -3.084036 -0.544977 0.170609
C 2.247438 -0.890139 0.112049
C 2.828649 1.475984 -0.139886
C -2.518063 1.817698 -0.082399
C -4.444892 -0.186720 0.161332
C 4.571862 -0.198898 -0.002175
C 3.608733 -1.228137 0.121209
C 4.196412 1.156000 -0.133201
C -3.886444 2.151659 -0.089501
C -4.875141 1.150383 0.033002
H -0.513145 -1.028418 0.169035
H 0.253004 1.960680 -0.140115
H -2.813895 -1.600650 0.273452
H 1.507513 -1.690656 0.207629
H 2.523212 2.523878 -0.241123
H -1.778008 2.618610 -0.179425
H 3.944878 -2.263489 0.221239
H 4.970878 1.921640 -0.225924
H -4.189755 3.198458 -0.191209
H -5.943526 1.379948 0.030808


