%chk=000018824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018824

0 1
 O   0.1472000       2.209200      5.2999998E-03
 O   -2.108700       2.543700     -3.9700001E-02
 O    5.716100     -0.7201000      1.0500000E-02
 O    4.381000      -2.462500     -1.3800000E-02
 N   -3.282900     -0.4981000       1.197900    
 N    4.566200      -1.221600     -8.9999998E-04
 C    1.037900     -4.8799999E-02 -1.0200000E-02
 C    1.242200       1.325600      5.1000002E-03
 C   -1.373800      0.2807000     -2.5400000E-02
 C  -0.3246000     -0.5557000     -1.9900000E-02
 C    2.148800     -0.8960000     -1.1500000E-02
 C    2.521700       1.877400      1.8300001E-02
 C    3.438800     -0.3577000      1.4000000E-03
 C   -2.737100     -0.2820000     -1.9500000E-02
 C   -1.168900       1.755300     -1.8200001E-02
 C    3.624500       1.026300      1.6100001E-02
 C   -3.377100     -0.5552000      -1.217200    
 C   -4.661500      -1.084900      -1.161900    
 C   -4.532500      -1.013900       1.211900    
 C   -5.257400      -1.321700      7.1800001E-02
 H  -0.4606000      -1.633500     -1.8800000E-02
 H    1.987600      -1.971900     -2.2500001E-02
 H    2.663300       2.953700      2.9500000E-02
 H    4.614500       1.474900      2.6300000E-02
 H   -2.905900     -0.3669000      -2.176500    
 H   -5.197200      -1.312600      -2.078500    
 H   -4.952300      -1.179800       2.198500    
 H   -6.257600      -1.734000      0.1388000    


%chk=000018824-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018824

0 1
O 0.259267 2.025329 -0.922707
O -1.963415 2.422606 -1.282952
O 5.803104 -0.606581 0.681408
O 4.390684 -2.302585 1.261263
N -2.825142 -1.581375 0.331242
N 4.624679 -1.123516 0.789760
C 1.068208 -0.072981 0.029706
C 1.312963 1.232892 -0.496263
C -1.371820 0.239240 -0.315826
C -0.295353 -0.531382 0.100910
C 2.177722 -0.849627 0.454502
C 2.618299 1.764859 -0.602869
C 3.468349 -0.310267 0.344361
C -2.755699 -0.313292 -0.204182
C -1.140174 1.591047 -0.862074
C 3.706584 0.988765 -0.179413
C -3.924576 0.387229 -0.607537
C -5.182476 -0.236810 -0.451131
C -4.041214 -2.163936 0.473273
C -5.253285 -1.534285 0.098073
H -0.528494 -1.526024 0.496957
H 2.041520 -1.854771 0.863735
H 2.752696 2.769177 -1.012480
H 4.733414 1.357355 -0.241812
H -3.840539 1.389899 -1.030033
H -6.092527 0.289690 -0.756647
H -4.041846 -3.172145 0.903095
H -6.209230 -2.048610 0.234544


