%chk=000022658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022658

0 1
 O    4.593500     -3.3000000E-03  -1.097500    
 O    4.592800     -4.6999999E-03   1.097800    
 N   -1.813100       2.252600     -1.9999999E-04
 N    3.985200     -2.3300000E-02   0.000000    
 C   -1.668800     -0.1907000      5.0000002E-04
 C  -0.2225000     -0.1498000      9.9999997E-05
 C   -2.429900      0.9804000      5.0000002E-04
 C   0.4743000     -0.1296000      -1.208000    
 C   0.4749000     -0.1290000       1.208000    
 C   -2.307800      -1.432500      9.9999997E-05
 C    2.566100     -6.7800000E-02 -3.9999999E-04
 C    1.868600     -8.8699996E-02  -1.208300    
 C    1.869200     -8.8000000E-02   1.207800    
 C   -3.823200      0.9097000       0.000000    
 C   -3.700800      -1.503100     -1.9999999E-04
 C   -4.458500     -0.3321000     -1.9999999E-04
 H  -5.4299999E-02 -0.1446000      -2.158300    
 H  -5.3399999E-02 -0.1435000       2.158500    
 H   -1.734500      -2.356800      9.9999997E-05
 H    2.378200     -7.3200002E-02  -2.168300    
 H    2.378900     -7.2099999E-02   2.167800    
 H   -4.426400       1.814100     -3.0000001E-04
 H   -4.195700      -2.469900     -3.9999999E-04
 H   -5.543100     -0.3874000     -5.0000002E-04
 H  -0.8068000       2.344000      2.2000000E-03
 H   -2.386500       3.086100      1.5000000E-03


%chk=000022658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022658

0 1
O 4.695116 -0.003328 -1.140384
O 4.695050 -0.002185 1.140331
N -1.846503 2.248464 0.001167
N 4.088359 -0.019872 -0.000033
C -1.711863 -0.206134 -0.000084
C -0.212446 -0.147569 -0.000087
C -2.479735 1.003849 0.000659
C 0.512709 -0.121048 -1.223983
C 0.512631 -0.119219 1.223818
C -2.380579 -1.452815 -0.000810
C 2.605704 -0.061646 -0.000057
C 1.921221 -0.082246 -1.234813
C 1.921143 -0.080426 1.234685
C -3.902135 0.916776 0.000695
C -3.791048 -1.532611 -0.000762
C -4.545363 -0.335543 0.000008
H -0.039231 -0.141782 -2.169282
H -0.039362 -0.138615 2.169117
H -1.780777 -2.370459 -0.001372
H 2.492517 -0.069720 -2.166727
H 2.492379 -0.066596 2.166618
H -4.496073 1.839187 0.001245
H -4.289477 -2.506789 -0.001297
H -5.640536 -0.376962 0.000063
H -0.832933 2.319374 0.001464
H -2.392367 3.104717 0.002121


