%chk=000161964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161964

0 1
 O   0.3085000       1.531500      -1.145600    
 O   -2.092300      0.3777000      -1.664900    
 O    1.907000       2.361800       1.023600    
 O   0.2970000      -1.254800      -1.612900    
 N    3.076400      0.3996000      0.8462000    
 C   0.9127000      0.5934000     -0.2356000    
 C  -0.5060000       1.078400     -7.1900003E-02
 C   -1.718800      0.3223000     -0.5002000    
 C    1.984600       1.210400      0.6029000    
 C    1.104600     -0.7540000     -0.8397000    
 C   -2.382800     -0.5087000      0.5799000    
 C   -3.903300     -0.6372000      0.4030000    
 C    2.338400      -1.463700     -0.4445000    
 C    3.239800     -0.8759000      0.3546000    
 C   -4.589100      0.7305000      0.4511000    
 C   -4.482600      -1.544000       1.490500    
 C    4.505900      -1.567300      0.7636000    
 H  -0.6997000       1.788300      0.7262000    
 H   -1.913300      -1.499200      0.5591000    
 H   -2.161200     -5.9799999E-02   1.555700    
 H   -4.114500      -1.091000     -0.5733000    
 H    3.822700      0.7743000       1.425600    
 H    2.482000      -2.465200     -0.8345000    
 H   -5.675100      0.6210000      0.3577000    
 H   -4.383100       1.244300       1.396400    
 H   -4.256100       1.378200     -0.3655000    
 H   -5.562500      -1.669200       1.358200    
 H   -4.309200      -1.129800       2.489600    
 H   -4.024500      -2.538000       1.451200    
 H    4.554300      -1.662500       1.853600    
 H    5.378800     -0.9984000      0.4262000    
 H    4.580900      -2.574000      0.3386000    


%chk=000161964-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161964

0 1
O 0.511825 1.386213 -1.401919
O -2.343408 0.641149 -1.761616
O 1.758977 2.255743 1.214508
O 0.072588 -1.611075 -1.168667
N 3.070313 0.367810 0.891138
C 0.872797 0.474040 -0.219210
C -0.473664 1.158713 -0.314503
C -1.790346 0.455945 -0.652390
C 1.903395 1.120820 0.686041
C 1.029535 -0.992489 -0.605316
C -2.403226 -0.355606 0.485396
C -3.934730 -0.554472 0.377943
C 2.321219 -1.597742 -0.308531
C 3.295221 -0.932193 0.406996
C -4.688114 0.777395 0.606141
C -4.403904 -1.639785 1.373139
C 4.642684 -1.519966 0.743646
H -0.586421 2.028102 0.355456
H -1.889778 -1.339796 0.457537
H -2.135359 0.105430 1.459946
H -4.148704 -0.895944 -0.653483
H 3.788579 0.823525 1.463004
H 2.497078 -2.617698 -0.656337
H -5.779232 0.632776 0.503196
H -4.494854 1.169890 1.624039
H -4.380851 1.541818 -0.129253
H -5.494023 -1.803956 1.289296
H -4.189594 -1.341077 2.418047
H -3.899544 -2.606199 1.184592
H 4.798070 -1.565880 1.838579
H 5.458681 -0.906855 0.315714
H 4.734290 -2.539638 0.341770


