%chk=000099674.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099674

0 1
 O   -1.514500     -6.8099998E-02 -0.3609000    
 O    5.387100       1.088700     -0.5062000    
 O    5.409100      -1.100500     -0.3457000    
 N    4.802400     -3.0000000E-03 -0.3028000    
 C   0.6804000      1.9099999E-02  0.5505000    
 C  -0.7798000      2.7500000E-02  0.8532000    
 C    1.351600       1.220000      0.3211000    
 C    1.375200      -1.189400      0.4973000    
 C    3.412200      4.3000001E-03 -1.4900000E-02
 C    2.717500       1.212600      3.8199998E-02
 C    2.741000      -1.196800      0.2146000    
 C   -2.880500     -3.4899998E-02 -0.2598000    
 C   -3.475600      8.7300003E-02  0.9908000    
 C   -3.658200     -0.1249000      -1.408800    
 C   -4.866400      0.1200000       1.093800    
 C   -5.048900     -9.2100002E-02  -1.305900    
 C   -5.652900      3.0200001E-02 -5.4400001E-02
 H   -1.006700     -0.8209000       1.512800    
 H   -1.013000      0.9623000       1.380500    
 H   0.8214000       2.168100      0.3572000    
 H   0.8630000      -2.132000      0.6719000    
 H    3.207200       2.167300     -0.1358000    
 H    3.249600      -2.156900      0.1807000    
 H   -2.930600      0.1580000       1.925200    
 H   -3.191800     -0.2206000      -2.385200    
 H   -5.337900      0.2143000       2.067800    
 H   -5.661400     -0.1620000      -2.200000    
 H   -6.735700      5.5399999E-02  2.5599999E-02


%chk=000099674-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099674

0 1
O -1.516716 -0.014821 -0.245722
O 5.456747 1.083360 -0.691988
O 5.453229 -1.190716 -0.518995
N 4.868283 -0.041357 -0.455242
C 0.720311 0.048942 0.640589
C -0.744723 0.078270 1.012782
C 1.413243 1.253887 0.361041
C 1.410201 -1.186430 0.550191
C 3.430540 -0.010660 -0.079977
C 2.773627 1.236261 -0.001918
C 2.770456 -1.229019 0.189086
C -2.924309 -0.007355 -0.136716
C -3.635197 0.077057 1.085638
C -3.619030 -0.093609 -1.368867
C -5.050062 0.073291 1.061032
C -5.027056 -0.095993 -1.374423
C -5.752246 -0.012680 -0.159715
H -1.005816 -0.776566 1.668838
H -1.005289 1.020849 1.535257
H 0.880510 2.208994 0.422306
H 0.874956 -2.119261 0.758161
H 3.329640 2.150844 -0.222148
H 3.323763 -2.168244 0.112791
H -3.113487 0.144937 2.044688
H -3.039752 -0.157492 -2.294970
H -5.600453 0.138495 2.006350
H -5.560656 -0.163180 -2.328874
H -6.846913 -0.014803 -0.168395


