%chk=000048782.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048782

0 1
 O    1.228200       1.645900      1.3800000E-02
 O  -0.9799000     -0.1603000       2.325600    
 O  -0.9258000     -0.2508000      -2.369000    
 O    2.565000      -1.984100      5.3300001E-02
 N   0.8342000     -0.9819000       1.187000    
 N   0.8616000      -1.026500      -1.158100    
 C  -0.8018000      0.3816000     -3.1300001E-02
 C   -2.332100      0.5070000     -5.1399998E-02
 C  -0.1759000       1.787700     -5.0999999E-02
 C  -0.3620000     -0.2848000       1.268500    
 C  -0.3323000     -0.3340000      -1.294000    
 C   -2.972100     -0.8480000      7.7100001E-02
 C    1.503300      -1.359100      2.8899999E-02
 C    1.889600       2.907300      3.9999999E-04
 H   -2.674300      0.9855000     -0.9775000    
 H   -2.680800       1.143500      0.7718000    
 H  -0.5212000       2.375600      0.8090000    
 H  -0.4491000       2.320100     -0.9708000    
 H   -2.662000      -1.536400     -0.7150000    
 H   -2.778200      -1.329600       1.039100    
 H   -4.060300     -0.7444000     -2.7999999E-03
 H    1.222700      -1.320900       2.062700    
 H    1.270400      -1.398500      -2.010800    
 H    1.667100       3.445700     -0.9258000    
 H    2.967000       2.729800      5.2200001E-02
 H    1.590800       3.504800      0.8670000    


%chk=000048782-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048782

0 1
O 1.236671 1.872441 -0.021179
O -0.591237 0.274502 2.435843
O -0.549365 0.156955 -2.432470
O 2.093732 -2.708172 0.095426
N 0.709093 -1.207453 1.230573
N 0.729343 -1.264839 -1.134990
C -0.712712 0.458475 -0.005461
C -2.277055 0.436308 -0.018591
C -0.225331 1.931917 -0.036968
C -0.205998 -0.147787 1.315263
C -0.183630 -0.210626 -1.286397
C -2.886006 -0.980606 0.011324
C 1.243745 -1.784459 0.065552
C 1.854935 3.198492 -0.049722
H -2.606007 0.965956 -0.931271
H -2.621734 1.010564 0.860725
H -0.611323 2.464518 0.857163
H -0.593389 2.419602 -0.963697
H -2.581823 -1.575471 -0.869382
H -2.595648 -1.531656 0.924585
H -3.988346 -0.916945 0.001280
H 1.069470 -1.582876 2.113925
H 1.104713 -1.682305 -1.992862
H 1.577290 3.750339 -0.971580
H 2.942640 3.031002 -0.034978
H 1.560072 3.797325 0.836788


