%chk=000161240.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161240

0 1
 O   -1.520800       2.027900       1.812400    
 O  -0.5525000      -2.422000     -0.5782000    
 O   -1.278400      -2.004200       1.529200    
 N  -0.8650000       2.544600     -0.3559000    
 N    2.258500      -1.027800       1.727200    
 N   -3.882900      -2.363300      0.6533000    
 C   -2.109500      0.1067000      -1.667400    
 C   -2.351000       1.567200      -2.070200    
 C   -3.119800     -0.4411000     -0.6543000    
 C   -2.173000       2.582100     -0.9446000    
 C   -2.874300      -1.916400     -0.3111000    
 C    1.494800      0.9739000       1.220800    
 C   0.8386000       2.313500       1.337400    
 C    2.108300      0.4498000      6.2500000E-02
 C    2.584200     -0.8174000      0.4062000    
 C  -0.6394000       2.267400      0.9910000    
 C    1.594900      5.9500001E-02   2.228900    
 C    2.312500      0.9176000      -1.250900    
 C   -1.513500      -2.118500      0.3327000    
 C    3.256900      -1.643300     -0.5014000    
 C    2.983800      0.1023000      -2.169400    
 C    3.447800      -1.158100      -1.798200    
 H   -1.089200      1.4100000E-02  -1.281100    
 H   -2.154700     -0.5083000      -2.575100    
 H   -1.650400       1.813200      -2.878500    
 H   -3.359700       1.668400      -2.488100    
 H   -3.071200      0.1574000      0.2634000    
 H   -4.132200     -0.3208000      -1.060700    
 H   -2.940700       2.443600     -0.1769000    
 H   -2.304800       3.591500      -1.349700    
 H   -2.947000      -2.543700      -1.206700    
 H   0.9250000       2.687600       2.365300    
 H    1.351500       3.049400      0.7066000    
 H  -7.7699997E-02   2.775200     -0.9538000    
 H    1.258300      7.2400004E-02   3.256200    
 H    2.477100      -1.864700       2.249800    
 H    1.963800       1.898600      -1.558700    
 H   -4.813400      -2.241600      0.2550000    
 H   -3.775400      -3.363400      0.8202000    
 H    3.617900      -2.625000     -0.2136000    
 H    3.145100      0.4584000      -3.183400    
 H    3.966500      -1.774700      -2.527800    
 H   0.3226000      -2.552800     -0.1557000    


%chk=000161240-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000161240

0 1
O -1.182568 2.818449 2.010509
O -0.304698 -2.176354 -1.323281
O -0.706961 -2.695851 0.908386
N -0.983287 2.768441 -0.309044
N 1.501692 -0.969086 1.744747
N -3.545167 -2.761490 0.343172
C -2.201886 0.274962 -1.650106
C -2.720961 1.728289 -1.780011
C -2.894899 -0.534689 -0.530553
C -2.428381 2.652349 -0.574321
C -2.613437 -2.070490 -0.560621
C 1.466003 1.226423 1.099656
C 1.081760 2.691387 1.049614
C 2.167172 0.458785 0.085356
C 2.156250 -0.920593 0.514422
C -0.455670 2.795302 0.969267
C 1.066552 0.318315 2.082117
C 2.780115 0.782328 -1.154845
C -1.134312 -2.353363 -0.224042
C 2.709312 -1.962827 -0.268031
C 3.334724 -0.249597 -1.938850
C 3.299077 -1.607475 -1.503516
H -1.106919 0.278523 -1.497183
H -2.370244 -0.239093 -2.617505
H -2.284327 2.182358 -2.694701
H -3.818292 1.720510 -1.936022
H -2.621993 -0.135460 0.467062
H -3.993985 -0.444690 -0.626004
H -2.892298 2.277974 0.355125
H -2.864030 3.653788 -0.767352
H -2.788677 -2.424749 -1.593070
H 1.393691 3.224810 1.963611
H 1.566375 3.188616 0.188873
H -0.343638 2.739022 -1.105427
H 0.479461 0.502296 2.979841
H 1.124511 -1.826609 2.149302
H 2.826370 1.821270 -1.503603
H -3.526777 -3.783046 0.243375
H -3.404547 -2.494826 1.325550
H 2.726332 -2.998950 0.088244
H 3.805515 -0.010117 -2.898550
H 3.745082 -2.386785 -2.131086
H 0.669557 -2.222857 -1.073806


