%chk=000077789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077789

0 1
 O   -1.765700      -2.470800     -0.4636000    
 O   -2.044900       2.098200      0.3980000    
 O    4.722200       1.199200     -0.3753000    
 O    4.829600     -0.8478000      0.4104000    
 N   -1.469300     -0.1652000     -1.7500000E-02
 N    4.168700      0.1425000      1.4000000E-02
 C   -3.661100      -1.065600     -0.1180000    
 C  -3.6899999E-02 -8.6999997E-02 -9.4999997E-03
 C   -2.182300      -1.346200     -0.2107000    
 C   -3.681400      0.4044000      6.7900002E-02
 C   -2.301700      0.9294000      0.1593000    
 C   0.6025000       1.077600     -0.4378000    
 C   0.7208000      -1.175400      0.4265000    
 C    1.995400       1.153600     -0.4300000    
 C    2.113600      -1.099300      0.4343000    
 C    2.750900      6.5099999E-02  6.0999999E-03
 C   -4.760400       1.187100      0.1458000    
 H   -4.078700      -1.595900      0.7419000    
 H   -4.149700      -1.368500      -1.047900    
 H   5.0799999E-02   1.932500     -0.8158000    
 H   0.2613000      -2.085000      0.8003000    
 H    2.458200       2.073700     -0.7776000    
 H    2.670000      -1.963800      0.7878000    
 H   -5.756500      0.7630000      7.3500000E-02
 H   -4.683000       2.260400      0.2818000    


%chk=000077789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077789

0 1
O -1.706611 -2.538602 -0.392032
O -1.989204 2.128292 0.321808
O 4.783147 1.254314 -0.391075
O 4.903668 -0.863107 0.449144
N -1.470409 -0.188276 -0.029217
N 4.239427 0.158989 0.023330
C -3.698398 -1.073264 -0.170040
C -0.036573 -0.101091 -0.015179
C -2.208085 -1.407607 -0.214618
C -3.754445 0.418444 0.068475
C -2.356184 0.944169 0.140748
C 0.606000 1.080130 -0.475371
C 0.736327 -1.196086 0.457322
C 2.008754 1.166985 -0.461074
C 2.139188 -1.111877 0.468758
C 2.759804 0.069397 0.010089
C -4.831985 1.228613 0.210479
H -4.180340 -1.662835 0.630369
H -4.165709 -1.382004 -1.122538
H 0.013806 1.925979 -0.826379
H 0.245296 -2.107814 0.799316
H 2.525512 2.064489 -0.809766
H 2.754870 -1.940344 0.827444
H -5.857505 0.847787 0.163293
H -4.687950 2.301518 0.380616


