%chk=000091482.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091482

0 1
 O    1.396100      -2.312300      0.3195000    
 O   -1.756500       1.476600       1.181500    
 O   -3.344500       1.033900     -0.3850000    
 N   -2.781100      -1.656700     -3.5799999E-02
 C  -0.6696000     -0.7578000     -0.8953000    
 C   -1.717500     -0.6844000      0.2237000    
 C   0.6639000     -0.1762000     -0.4834000    
 C    1.623100     -0.9866000      0.1016000    
 C   0.8960000       1.171800     -0.7047000    
 C   -2.375600      0.6802000      0.2721000    
 C    2.848000     -0.4341000      0.4760000    
 C    2.120800       1.724300     -0.3304000    
 C    3.096700      0.9214000      0.2601000    
 H   -1.027700     -0.2413000      -1.797000    
 H  -0.5158000      -1.799000      -1.210100    
 H   -1.286300     -0.9208000       1.203100    
 H   0.1453000       1.806500      -1.166500    
 H   -3.227800      -1.458100     -0.9303000    
 H   -3.505100      -1.579700      0.6773000    
 H    3.617400      -1.047800      0.9369000    
 H    2.314900       2.779500     -0.4991000    
 H    4.050400       1.351700      0.5514000    
 H    2.182600      -2.704700      0.7360000    
 H   -2.173600       2.362800       1.235500    


%chk=000091482-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091482

0 1
O 1.173729 -2.102000 0.683597
O -2.078661 0.815853 1.916898
O -2.411215 1.552096 -0.261653
N -2.931581 -1.534556 -0.290320
C -0.670499 -0.805105 -1.010761
C -1.718235 -0.807820 0.133629
C 0.641539 -0.148731 -0.620782
C 1.558774 -0.820558 0.232394
C 0.997357 1.142595 -1.076952
C -2.077208 0.634928 0.525321
C 2.789074 -0.233121 0.605334
C 2.222593 1.748381 -0.712656
C 3.120725 1.055158 0.129023
H -1.103672 -0.281534 -1.883615
H -0.514279 -1.864706 -1.277518
H -1.292367 -1.319371 1.010507
H 0.293332 1.677676 -1.724796
H -3.421912 -1.096073 -1.077723
H -3.563334 -1.793004 0.473511
H 3.483727 -0.773974 1.262060
H 2.472276 2.748142 -1.082563
H 4.074562 1.510187 0.417503
H 1.885553 -2.505246 1.239441
H -2.356178 1.749984 2.127222


