%chk=000018623.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018623

0 1
 O   -1.759700     -0.4579000      0.9134000    
 O   -1.714200       2.635300     -0.9002000    
 O   -3.870400       1.613900      0.4211000    
 O   -2.611000      -2.933300     -9.4099998E-02
 O    1.045200       2.522100      0.9161000    
 O   0.9201000      -3.108300      0.5012000    
 O    5.151300      0.4129000     -8.7499999E-02
 N   0.2998000      0.4408000      0.2688000    
 N   0.8687000      -1.751600       1.008400    
 N    2.624500       1.014500      0.3012000    
 N    4.222300     -0.4004000     -0.6723000    
 C   -1.083400      0.7422000      0.5045000    
 C   -1.791800       1.233000     -0.7464000    
 C   -3.210100      0.7581000     -0.5111000    
 C   -2.987700     -0.5883000      0.1642000    
 C   0.6359000     -0.9106000     -0.1649000    
 C   -2.821700      -1.736400     -0.8224000    
 C    1.846500     -0.8543000      -1.081900    
 C    1.309100       1.388300      0.5116000    
 C    2.926700     -1.9800000E-02 -0.4296000    
 H   -1.163900       1.474800       1.316400    
 H   -1.387200      0.7619000      -1.650300    
 H   -3.821000      0.7115000      -1.417000    
 H   -3.774900     -0.8263000      0.8885000    
 H  -0.1787000      -1.313300     -0.7618000    
 H   -2.000300      -1.595700      -1.525700    
 H   -3.741000      -1.856000      -1.406100    
 H    1.583900     -0.3545000      -2.023400    
 H    2.225400      -1.849800      -1.336800    
 H  -0.7727000       2.870800     -0.9590000    
 H   -3.898400       2.502100      2.6000001E-02
 H   1.9900000E-02  -1.790300       1.571000    
 H   -2.529400      -3.653100     -0.7426000    
 H    4.530900      -1.161000      -1.265700    
 H    1.743200      -3.406300      0.9240000    
 H    5.733700     -0.2298000      0.3516000    


%chk=000018623-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018623

0 1
O -1.627476 -0.812808 0.365114
O -1.668198 2.746792 -0.474212
O -3.760923 1.667491 0.664388
O -3.472903 -2.950023 -0.305923
O 0.885105 2.460590 0.262194
O 1.404334 -3.285067 0.732303
O 5.249239 0.834657 0.103105
N 0.467507 0.206206 -0.104794
N 1.070201 -1.837278 1.021994
N 2.725203 1.050337 -0.024608
N 4.509302 -0.270558 -0.420364
C -0.943038 0.475743 0.282962
C -1.765229 1.321404 -0.724642
C -3.222420 0.862725 -0.423647
C -3.082886 -0.604204 0.054237
C 0.922896 -1.178165 -0.327961
C -3.530125 -1.643470 -0.968500
C 2.270856 -1.190244 -1.073977
C 1.354031 1.288024 0.054416
C 3.162788 -0.129999 -0.483758
H -0.948255 0.990744 1.267215
H -1.467935 1.060777 -1.760492
H -3.866763 0.950377 -1.321689
H -3.649923 -0.735957 0.992236
H 0.159982 -1.708140 -0.929464
H -2.870048 -1.609888 -1.862595
H -4.569763 -1.398063 -1.277571
H 2.099477 -0.967462 -2.143863
H 2.693339 -2.205637 -0.992947
H -0.715743 2.917190 -0.165057
H -3.288577 2.549331 0.589891
H 0.105976 -1.892773 1.413506
H -3.741821 -3.658789 -0.942192
H 5.092863 -1.030561 -0.761088
H 2.132727 -3.461388 1.383048
H 4.455799 1.473282 0.291935


