%chk=000007552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007552

0 1
 O    2.112800       2.462400     -0.3863000    
 O    2.132400      -2.298000      0.1391000    
 O    3.436100      0.1374000      0.3335000    
 N   -3.266300      -1.063800      0.3046000    
 N   -3.338700       1.188400     -1.4400000E-02
 C   -1.889100     -8.9400001E-02  -1.524300    
 C   -2.859000      3.1399999E-02 -0.3949000    
 C  -0.4723000     -2.8600000E-02  -1.029700    
 C   -4.158600     -0.6729000       1.353500    
 C   -4.247300      0.8432000       1.122300    
 C   0.1801000      -1.201600     -0.6707000    
 C   0.1708000       1.199600     -0.9364000    
 C    1.486700       1.255800     -0.4769000    
 C    1.495900      -1.145600     -0.2110000    
 C    2.149400      8.3099999E-02 -0.1142000    
 C    1.988300       3.166000      0.8479000    
 C    1.393700      -3.511200      1.0400000E-02
 C    3.685100     -0.3561000       1.647600    
 H   -2.074700      0.7147000      -2.246800    
 H   -2.069400      -1.030000      -2.058700    
 H   -3.740000     -0.9031000       2.337600    
 H   -5.135900      -1.153600       1.253100    
 H   -5.270700       1.141500      0.8706000    
 H   -3.939800       1.394500       2.017200    
 H   -2.969300      -2.018700      0.1455000    
 H  -0.3793000      -2.125800     -0.7664000    
 H  -0.3425000       2.115800      -1.217200    
 H    2.545300       4.103400      0.7655000    
 H    2.409200       2.580500       1.671100    
 H   0.9385000       3.399600       1.051600    
 H    1.126800      -3.713100      -1.032600    
 H   0.5231000      -3.526400      0.6751000    
 H    2.052500      -4.324600      0.3323000    
 H    4.027300      -1.393700       1.599900    
 H    2.804700     -0.2738000       2.294700    
 H    4.487300      0.2447000       2.086300    


%chk=000007552-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007552

0 1
O 1.321916 2.472657 0.416212
O 2.482738 -2.263890 -0.151745
O 3.307017 0.283957 0.539575
N -3.181862 -0.281842 0.882186
N -4.273437 0.595955 -0.951849
C -2.092396 -0.549381 -1.387351
C -3.206891 -0.035383 -0.499935
C -0.687929 -0.346291 -0.822653
C -4.312603 0.437423 1.517348
C -5.153368 0.840512 0.246779
C 0.205498 -1.442169 -0.723540
C -0.258833 0.930761 -0.413724
C 1.050412 1.139024 0.091309
C 1.517676 -1.243628 -0.239863
C 1.963164 0.048338 0.179169
C 2.442707 2.844472 1.295337
C 2.129080 -3.578015 -0.693559
C 3.808299 -0.429805 1.732651
H -2.205912 -0.036026 -2.358554
H -2.263578 -1.627408 -1.573679
H -3.960941 1.326232 2.080781
H -4.876656 -0.214656 2.207274
H -6.062068 0.215842 0.153289
H -5.472169 1.896846 0.268767
H -2.311597 -0.482205 1.375358
H -0.127127 -2.434898 -1.041188
H -0.923352 1.798375 -0.478745
H 2.287109 3.917590 1.489345
H 3.412486 2.669756 0.805101
H 2.405597 2.283920 2.249216
H 1.859614 -3.508371 -1.764741
H 1.294569 -4.038028 -0.129190
H 3.036264 -4.189161 -0.576980
H 3.746401 -1.520569 1.586566
H 3.234737 -0.131942 2.633776
H 4.858534 -0.115993 1.836158


