%chk=000156590.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156590

0 1
 O   0.2775000       1.027200       1.161700    
 O    4.060300      -2.987900      0.4902000    
 O    4.179400       1.930500      -2.305200    
 O    4.192400      -1.358400       2.068000    
 O    4.011700       2.614600     -0.1450000    
 N    2.602800      5.1800001E-02  4.9100000E-02
 N   -2.485900       1.008200      0.7739000    
 N  -0.9264000     -0.6078000     -2.6500000E-02
 N   -3.662400      -2.814300      -1.788900    
 C    1.441800     -0.8305000      0.1601000    
 C   -2.236600     -0.1363000      8.9100003E-02
 C   -4.428800      0.2381000      2.3100000E-02
 C   -3.834100       1.251400      0.7421000    
 C   -3.401900     -0.6455000     -0.3915000    
 C    3.810700     -0.7253000     -0.2263000    
 C    2.387700       1.050400     -0.9972000    
 C   0.2121000     -8.0000004E-03  0.5072000    
 C   -5.874400      0.1056000     -0.2574000    
 C   -4.409700       2.435900       1.407500    
 C    4.026700      -1.695100      0.9024000    
 C    3.602300       1.933400      -1.076600    
 C   -3.545200      -1.838000      -1.160000    
 H    1.544400      -1.552000      0.9789000    
 H    1.285200      -1.391600     -0.7699000    
 H   -1.798400       1.589700       1.233500    
 H    3.734500      -1.271100      -1.175400    
 H    4.722200     -0.1188000     -0.2689000    
 H    2.217500      0.5763000      -1.972600    
 H    1.543000       1.721400     -0.8130000    
 H  -0.8265000      -1.475000     -0.5484000    
 H   -6.277700     -0.7872000      0.2317000    
 H   -6.445100      0.9685000      9.9900000E-02
 H   -6.051100      1.6500000E-02  -1.334300    
 H   -3.646900       3.023300       1.929400    
 H   -4.892100       3.090200      0.6742000    
 H   -5.160700       2.134800       2.145000    
 H    4.218900      -3.605400       1.235600    
 H    4.959300       2.524300      -2.344300    


%chk=000156590-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156590

0 1
O -0.485483 1.323044 -2.576660
O 3.182325 -3.224551 0.701617
O 3.261626 2.440692 1.492709
O 1.161065 -2.160122 0.360905
O 2.912066 0.157366 1.758475
N 2.497560 -0.085235 -1.099249
N -2.536586 1.085579 -0.854930
N -0.404162 -0.087566 -0.704353
N -1.486125 -2.029904 2.685398
C 1.559057 0.002281 -2.219686
C -1.687311 0.198077 -0.219840
C -3.674074 0.328133 0.954060
C -3.752482 1.179391 -0.155586
C -2.359501 -0.301555 0.921973
C 3.191510 -1.325598 -0.798214
C 2.970677 1.162972 -0.517433
C 0.135777 0.475243 -1.842659
C -4.722621 0.077627 2.005716
C -4.851645 2.080386 -0.640919
C 2.391181 -2.237041 0.142888
C 3.021344 1.150900 1.011176
C -1.864923 -1.240030 1.865828
H 1.476349 -0.996514 -2.689471
H 1.899541 0.704280 -3.008769
H -2.238843 1.561246 -1.717230
H 3.404246 -1.915108 -1.716283
H 4.168290 -1.132927 -0.321968
H 3.990315 1.456478 -0.865436
H 2.301688 1.987648 -0.820627
H 0.164485 -0.806243 -0.201451
H -4.353155 0.340312 3.014807
H -5.634747 0.669077 1.816699
H -5.013482 -0.989175 2.039018
H -4.534587 3.140804 -0.673829
H -5.194845 1.804867 -1.656940
H -5.722828 2.016246 0.031128
H 2.638260 -3.792120 1.313564
H 3.316535 2.424939 2.486776


