%chk=000147044.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147044

0 1
 O    4.148500       1.436900      -1.407900    
 O    5.123900      0.1733000      0.8669000    
 N   -2.684800      0.2086000      0.1602000    
 C  -0.3499000     -0.2938000     -0.5203000    
 C   -1.271800      0.3098000      0.5587000    
 C  -0.7396000      -1.750800     -0.8146000    
 C   -2.227400      -1.846000      -1.139000    
 C   -3.078000      -1.191500     -4.9899999E-02
 C   -3.545500      0.8368000       1.162400    
 C    1.117100     -0.1667000     -0.1513000    
 C   -4.997000      0.8363000      0.6895000    
 C    1.971900      0.5839000     -0.9553000    
 C    1.603100     -0.8015000      0.9895000    
 C   -5.151100       1.583900     -0.6260000    
 C    3.320100      0.7002000     -0.6165000    
 C    2.951000     -0.6852000       1.328200    
 C    3.809500      6.5700002E-02  0.5253000    
 H  -0.5175000      0.2779000      -1.445300    
 H   -1.116200     -0.1829000       1.527700    
 H   -1.004800       1.366500      0.6924000    
 H  -0.5253000      -2.396700      4.6000000E-02
 H  -0.1520000      -2.141300      -1.654400    
 H   -2.423600      -1.359300      -2.103000    
 H   -2.512600      -2.898500      -1.249500    
 H   -4.109600      -1.282600     -0.4000000    
 H   -2.993400      -1.767400      0.8811000    
 H   -3.475200      0.3237000       2.130100    
 H   -3.231400       1.875800       1.325300    
 H   -5.438500     -0.1624000      0.6296000    
 H   -5.591300       1.364300       1.446800    
 H    1.599300       1.082000      -1.846800    
 H   0.9524000      -1.390600       1.629400    
 H   -4.730500       2.592800     -0.5614000    
 H   -4.667700       1.059200      -1.455600    
 H   -6.212900       1.681400     -0.8754000    
 H    3.319100      -1.184200       2.220600    
 H    5.042500       1.408900      -1.024700    
 H    5.280800     -0.3299000       1.684300    


%chk=000147044-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147044

0 1
O 4.033813 1.692099 -1.363836
O 5.181844 0.446735 0.741102
N -2.741191 0.022676 0.215015
C -0.385734 -0.443207 -0.508801
C -1.313298 0.144182 0.590784
C -0.765037 -1.927078 -0.764768
C -2.270329 -2.049699 -1.086636
C -3.125208 -1.395967 0.017941
C -3.635490 0.744504 1.155953
C 1.084903 -0.250473 -0.150516
C -5.038203 1.040961 0.576397
C 1.894571 0.623774 -0.919702
C 1.667021 -0.915486 0.960806
C -4.988686 1.929783 -0.683775
C 3.247718 0.827697 -0.592857
C 3.026293 -0.716364 1.297355
C 3.811944 0.154083 0.521342
H -0.600942 0.121929 -1.437522
H -1.094859 -0.377735 1.561486
H -1.076686 1.214636 0.735522
H -0.532295 -2.528878 0.137710
H -0.150971 -2.335429 -1.589329
H -2.487571 -1.544965 -2.047851
H -2.557239 -3.113635 -1.193871
H -4.193087 -1.442826 -0.259676
H -3.004551 -1.978163 0.972375
H -3.744646 0.185453 2.122464
H -3.148888 1.709841 1.399020
H -5.563919 0.093515 0.345746
H -5.634862 1.536274 1.368744
H 1.482462 1.156790 -1.782956
H 1.064937 -1.597836 1.570206
H -4.560472 2.922835 -0.448929
H -4.347476 1.463645 -1.452011
H -5.997675 2.085859 -1.107986
H 3.465163 -1.237453 2.158077
H 4.952125 1.708873 -0.985086
H 5.538123 -0.034349 1.525164


