%chk=000097787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097787

0 1
 O   0.1271000      -1.425800      0.6242000    
 O   -4.657400     -0.8874000     -0.4568000    
 O   -4.015700       1.301800     -0.4728000    
 N   0.8924000      0.7672000      0.6296000    
 C    3.094200      0.2659000     -0.3234000    
 C    4.562200     -2.1000000E-02 -5.7000001E-03
 C    2.283400      0.4751000      0.9544000    
 C    5.368900     -0.2654000      -1.271100    
 C  -5.9000000E-02 -0.2202000      0.4948000    
 C   -1.393800      0.3532000      0.1645000    
 C   -2.442400     -0.4612000     -4.9000001E-03
 C   -3.759900      0.1179000     -0.3328000    
 H    3.018600       1.157000     -0.9592000    
 H    2.669900     -0.5668000     -0.8983000    
 H    4.637500     -0.9016000      0.6429000    
 H    4.996200      0.8237000      0.5418000    
 H    2.323800     -0.4160000       1.590100    
 H    2.667800       1.327600       1.523800    
 H    6.415100     -0.4671000      -1.020700    
 H    4.980000      -1.126300      -1.824200    
 H    5.339500      0.6084000      -1.929800    
 H   0.6413000       1.742400      0.4957000    
 H   -1.483800       1.430200      6.7699999E-02
 H   -2.365600      -1.538900      8.8699996E-02
 H   -5.554000     -0.5546000     -0.6757000    


%chk=000097787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097787

0 1
O 0.016288 -1.415127 0.900711
O -4.905790 -0.868686 -0.219803
O -4.148527 1.284538 -0.681271
N 0.880659 0.720146 0.499366
C 3.196903 0.287009 -0.391568
C 4.650529 -0.061496 0.001868
C 2.268547 0.372624 0.843271
C 5.591466 -0.150005 -1.218686
C -0.151747 -0.208373 0.537203
C -1.480691 0.340935 0.118062
C -2.596014 -0.438013 0.114479
C -3.906331 0.112040 -0.300624
H 3.185319 1.253088 -0.938256
H 2.800509 -0.479664 -1.085016
H 4.658917 -1.026963 0.546657
H 5.033561 0.701293 0.710578
H 2.227283 -0.604980 1.354477
H 2.663220 1.119947 1.559979
H 6.622889 -0.404297 -0.913704
H 5.247859 -0.925874 -1.928031
H 5.627931 0.811724 -1.764483
H 0.681965 1.668087 0.173060
H -1.561571 1.392251 -0.193264
H -2.541710 -1.487523 0.420547
H -5.775164 -0.474578 -0.502753


