%chk=000167782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167782

0 1
 O   -2.050900       3.129200      0.7765000    
 O   -3.757500      -2.223900       1.029900    
 O   -2.227300       2.422800      -1.375700    
 O   -3.221700      -2.091000      -1.174200    
 O    5.766700     -0.8812000     -0.4003000    
 O    4.815400      0.8939000      0.6514000    
 N   -1.408700     -7.0400000E-02 -7.5199999E-02
 N    2.315000      0.1000000      0.1260000    
 C  -9.9399999E-02  0.4630000      0.2993000    
 C    1.008600     -0.4414000     -0.2322000    
 C   -2.474500      0.8112000      0.3996000    
 C   -1.583800      -1.419300      0.4617000    
 C    3.383700     -0.7658000     -0.3513000    
 C   -2.255700       2.183400     -0.1751000    
 C   -2.913300      -1.951100      2.6000000E-03
 C    4.703700     -0.1594000      3.7099998E-02
 H  -1.4000000E-02  0.5629000       1.390200    
 H   6.7000002E-02   1.457100     -0.1321000    
 H   0.9245000     -0.5311000      -1.322300    
 H   0.9578000      -1.442900      0.2029000    
 H   -2.498000      0.8694000       1.495200    
 H   -3.471000      0.5023000      6.4800002E-02
 H   -1.527400      -1.440000       1.557100    
 H  -0.8685000      -2.150300      7.4600004E-02
 H    2.376600      0.1929000       1.140000    
 H    3.355300     -0.8456000      -1.443100    
 H    3.317100      -1.760500      0.1022000    
 H   -1.890200       4.013900      0.3842000    
 H   -4.626300      -2.550800      0.7124000    
 H    6.619200     -0.4626000     -0.1547000    


%chk=000167782-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167782

0 1
O -2.915077 3.256158 -0.463294
O -3.275790 -3.174646 0.646660
O -1.068897 2.189640 -1.387697
O -3.743667 -1.327333 -0.681561
O 5.817294 -0.491195 -0.878478
O 4.955769 -0.730587 1.267736
N -1.405478 0.015367 0.483270
N 2.375076 -0.130769 0.328715
C -0.000015 0.302669 0.856455
C 0.994072 -0.329694 -0.139287
C -2.329244 1.148840 0.502330
C -1.923973 -1.237123 1.029379
C 3.420505 -0.444421 -0.644359
C -1.994879 2.197536 -0.553253
C -3.056513 -1.857144 0.214877
C 4.768363 -0.559364 0.043113
H 0.225622 -0.048107 1.893198
H 0.167656 1.392360 0.850508
H 0.856915 0.177903 -1.110286
H 0.735091 -1.408138 -0.299465
H -2.388021 1.680032 1.485017
H -3.349090 0.794258 0.269398
H -2.300640 -1.157435 2.083060
H -1.109012 -1.981169 1.062847
H 2.576679 -0.532397 1.253745
H 3.483429 0.332351 -1.429531
H 3.265315 -1.415597 -1.184838
H -2.704612 3.931844 -1.163083
H -4.038144 -3.565807 0.139586
H 6.683667 -0.613331 -0.403264


