%chk=000122622.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122622

0 1
 O  -0.9513000     -0.8447000      0.8221000    
 O   -1.642600      -3.372400     -0.1398000    
 O    1.188900       2.712900     -9.6500002E-02
 O    5.086000      0.2806000     -0.3101000    
 N   -3.366200       1.062000      0.3391000    
 N    3.096000     -0.8447000      0.1545000    
 N    3.135200       1.481500     -0.2000000    
 N   -4.595300      0.9492000      0.1981000    
 N   -5.725400      0.8530000      7.7299997E-02
 C   -2.545700      0.2494000     -0.5679000    
 C  -0.4375000      0.4542000      0.4855000    
 C   -1.199000      0.9107000     -0.7503000    
 C   -2.191000      -1.061900      0.1214000    
 C    1.035100      0.3741000      0.2783000    
 C   -1.977000      -2.202700     -0.8656000    
 C    1.731800     -0.7671000      0.3459000    
 C    1.768600       1.632900     -1.9900000E-02
 C    3.866500      0.2906000     -0.1302000    
 C    3.722700      -2.157500      0.2581000    
 H   -3.060400      0.1102000      -1.526400    
 H  -0.6573000       1.110400       1.336700    
 H   -1.258200       2.000500     -0.8328000    
 H  -0.7268000      0.5285000      -1.664500    
 H   -2.935800      -1.361000      0.8681000    
 H   -1.144900      -1.994500      -1.545400    
 H   -2.876200      -2.399300      -1.457500    
 H    1.254500      -1.718000      0.5577000    
 H    3.663200       2.325300     -0.4052000    
 H   -2.395000      -3.587400      0.4374000    
 H    4.801100      -2.098800      8.8000000E-02
 H    3.283900      -2.823900     -0.4913000    
 H    3.545800      -2.560600       1.260300    


%chk=000122622-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122622

0 1
O -1.171277 -0.468681 1.067624
O -0.780335 -3.066274 -0.146469
O 1.406028 2.829428 -0.235007
O 5.000080 -0.167561 -0.391769
N -3.652291 1.081999 0.034906
N 2.866018 -1.009651 0.167482
N 3.167816 1.288704 -0.290853
N -4.771180 0.535631 0.268076
N -5.869608 0.201486 0.576255
C -2.602602 0.291455 -0.699691
C -0.517743 0.757572 0.529494
C -1.323638 1.158251 -0.748665
C -2.138692 -0.969219 0.080606
C 0.955295 0.494912 0.275176
C -1.521428 -2.026290 -0.868661
C 1.515913 -0.756561 0.393061
C 1.800559 1.631952 -0.089406
C 3.770516 0.023179 -0.185695
C 3.395515 -2.383260 0.320674
H -2.974001 0.039586 -1.713666
H -0.625286 1.534813 1.306796
H -1.568388 2.229952 -0.749418
H -0.746984 0.938217 -1.662549
H -2.954529 -1.431136 0.670896
H -0.773107 -1.571314 -1.538449
H -2.328952 -2.472797 -1.488315
H 0.894936 -1.618312 0.660531
H 3.799513 2.055125 -0.544756
H -1.359922 -3.457046 0.555810
H 4.424209 -2.396598 -0.068463
H 2.767433 -3.090397 -0.245733
H 3.409832 -2.675664 1.385276


