%chk=000066744.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066744

0 1
 O   -4.395800      -1.887900      6.8200000E-02
 N    1.223400       1.267500     -0.1351000    
 N    4.901500      -1.898600     -0.1787000    
 C    2.307500      0.4164000     -0.5839000    
 C  -9.7700000E-02  0.7761000     -8.7800004E-02
 C    2.919300     -0.3472000      0.5859000    
 C    1.516600       2.625700      0.2774000    
 C   -1.171900       1.665300     -5.3900000E-02
 C  -0.3302000     -0.5993000     -7.4800000E-02
 C   -2.478500       1.179400     -7.0000002E-03
 C   -1.636900      -1.085200     -2.7899999E-02
 C   -2.711000     -0.1958000      6.0000001E-03
 C    4.027100      -1.214000      0.1574000    
 C   -4.073300     -0.7025000      5.4099999E-02
 H    3.085200       1.036000      -1.052100    
 H    1.987700     -0.2636000      -1.384700    
 H    3.300300      0.3694000       1.324800    
 H    2.178900     -0.9508000       1.118900    
 H    1.171700       3.345500     -0.4725000    
 H    2.595000       2.779600      0.3987000    
 H    1.056700       2.858600       1.244400    
 H   -1.034600       2.742400     -7.3600002E-02
 H   0.4611000      -1.338700     -0.1124000    
 H   -3.305000       1.885200      1.6500000E-02
 H   -1.798000      -2.160100     -2.1400001E-02
 H   -4.861700      7.0000000E-02  7.9000004E-02


%chk=000066744-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066744

0 1
O -4.492418 -1.912255 -0.047427
N 1.244677 1.268489 -0.260705
N 4.990144 -1.901937 0.179350
C 2.381506 0.386763 -0.546069
C -0.060295 0.771745 -0.159766
C 2.908695 -0.336831 0.740445
C 1.518002 2.686243 0.028797
C -1.150617 1.649672 0.148765
C -0.356762 -0.620094 -0.366161
C -2.461461 1.157646 0.233964
C -1.670284 -1.093544 -0.280108
C -2.750093 -0.216901 0.022399
C 4.057547 -1.207703 0.449868
C -4.135088 -0.710368 0.118486
H 3.200458 0.986533 -0.978627
H 2.107897 -0.365674 -1.305782
H 3.207691 0.417101 1.492515
H 2.096784 -0.939066 1.188479
H 0.989629 3.352531 -0.680584
H 2.598303 2.877183 -0.070330
H 1.213710 2.966422 1.056752
H -0.971315 2.714744 0.315055
H 0.440746 -1.331454 -0.599842
H -3.281703 1.848845 0.468022
H -1.894649 -2.154008 -0.441603
H -4.893706 0.079319 0.359604


