%chk=000173422.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173422

0 1
 O   -2.227700       1.099100      -1.399400    
 O   -2.426200      -2.201200      0.3052000    
 O   -1.681600       2.138100       2.073300    
 O   0.1907000      -2.816000      0.4658000    
 O    1.427500       2.295500     -0.4398000    
 O    4.249000      0.8612000      0.8353000    
 N    2.807600      -2.243200      0.3308000    
 N    4.133600      0.4343000      -1.431000    
 C   -2.061400     -0.8501000      0.1131000    
 C   -1.424000       1.585300     -0.2986000    
 C   -2.596800      1.5300000E-02   1.279000    
 C   -2.598800     -0.2953000      -1.238800    
 C   -2.302600       1.498300      0.9677000    
 C  -0.5567000     -0.6182000      6.9899999E-02
 C  -0.2360000      0.6615000     -0.1573000    
 C   -4.109900     -0.4090000      -1.413000    
 C   0.4849000      -1.643600      0.2486000    
 C    1.155500       1.116100     -0.2407000    
 C    1.923000      -1.212200      0.1586000    
 C    2.218200      8.3400004E-02 -7.1300000E-02
 C    3.631700      0.5008000     -0.1572000    
 H   -1.127000       2.617000     -0.5078000    
 H   -2.147600     -0.2949000       2.232100    
 H   -3.674900     -0.1390000       1.409300    
 H   -2.138200     -0.8480000      -2.069000    
 H   -3.253300       2.013400      0.7861000    
 H   -4.647700      0.2206000     -0.6973000    
 H   -4.399200     -5.2800000E-02  -2.408100    
 H   -4.451400      -1.442300      -1.304700    
 H   -2.079700      -2.489000       1.166900    
 H  -0.8542000       1.667800       2.271200    
 H    3.804100      -2.071100      0.2898000    
 H    2.464300      -3.180900      0.4981000    
 H    5.094800      0.6945000      -1.626300    
 H    3.577700      0.1281000      -2.223600    


%chk=000173422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173422

0 1
O -2.215364 0.876157 -1.558076
O -2.593974 -2.153320 0.659132
O -1.528417 2.478566 1.791472
O 0.047635 -2.951494 0.696707
O 1.527711 2.102660 -0.869811
O 4.590780 -0.823108 -0.232459
N 2.688312 -2.451830 0.369919
N 4.110380 1.364191 -0.834948
C -2.111999 -0.845817 0.256792
C -1.323077 1.501192 -0.523776
C -2.589828 0.241498 1.273648
C -2.690778 -0.489224 -1.171158
C -2.187802 1.659380 0.771639
C -0.603915 -0.702734 0.126097
C -0.185870 0.549618 -0.278625
C -4.217180 -0.533847 -1.253338
C 0.372048 -1.761970 0.344054
C 1.252301 0.898494 -0.493353
C 1.837809 -1.426897 0.139857
C 2.257881 -0.135648 -0.263642
C 3.722435 0.113012 -0.442586
H -1.005199 2.469175 -0.931731
H -2.126773 0.030768 2.254319
H -3.679401 0.146590 1.402555
H -2.253264 -1.201115 -1.898706
H -3.072227 2.251669 0.489349
H -4.684389 0.226287 -0.604453
H -4.537637 -0.337120 -2.290431
H -4.573420 -1.533267 -0.950325
H -1.815024 -2.775753 0.754993
H -0.744601 1.990491 2.152897
H 3.702033 -2.220603 0.230832
H 2.302926 -3.356620 0.655620
H 5.106483 1.541175 -0.959828
H 3.389103 2.082945 -0.995735


