%chk=000117190.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117190

0 1
 O   -2.042500      0.1386000     -0.2755000    
 O    2.847000      0.1172000     -0.3160000    
 O   -3.287500      -1.456300      0.8113000    
 O    4.105000      -1.489100      0.7501000    
 N   -4.290300      0.2689000     -0.3718000    
 N    5.098300      0.2106000     -0.4378000    
 C   0.4024000      0.2575000     -0.3490000    
 C   0.4128000       1.743700      0.1119000    
 C  -0.8475000     -0.4954000      0.1619000    
 C    1.654000     -0.5064000      0.1412000    
 C   0.3896000      0.2609000      -1.895500    
 C   0.4263000       1.961500       1.620100    
 C   -3.218300     -0.4454000      0.1201000    
 C    4.020400     -0.4781000      6.0899999E-02
 C   -5.669700     -8.8100001E-02 -0.1321000    
 H    1.287000       2.254000     -0.3127000    
 H  -0.4638000       2.261700     -0.2982000    
 H  -0.8379000      -1.524600     -0.2204000    
 H  -0.8438000     -0.5480000       1.257200    
 H    1.629000      -1.535500     -0.2407000    
 H    1.668000     -0.5591000       1.236400    
 H  -0.4938000      0.7757000      -2.289400    
 H    1.270700      0.7681000      -2.304100    
 H   0.3819000     -0.7612000      -2.291000    
 H  -0.4605000       1.537300       2.098700    
 H   0.4328000       3.035000       1.837400    
 H    1.317000       1.529300       2.084000    
 H   -4.099700       1.092500     -0.9342000    
 H    4.976900       1.043400      -1.004200    
 H    6.049200     -9.2000000E-02 -0.2553000    
 H   -5.747100     -0.9887000      0.4813000    
 H   -6.151600     -0.2545000      -1.098600    
 H   -6.155400      0.7492000      0.3747000    


%chk=000117190-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117190

0 1
O -2.037728 0.166311 -0.307389
O 2.857223 0.154449 -0.331353
O -3.339700 -1.446708 0.824511
O 4.162683 -1.455993 0.794471
N -4.301586 0.333279 -0.381814
N 5.123348 0.309742 -0.422661
C 0.409136 0.228432 -0.389708
C 0.414153 1.710230 0.102207
C -0.819220 -0.542279 0.149931
C 1.638391 -0.547019 0.139688
C 0.402699 0.206498 -1.940758
C 0.418629 1.928088 1.631265
C -3.255258 -0.413027 0.112485
C 4.071837 -0.427284 0.080216
C -5.698662 -0.016700 -0.116364
H 1.303436 2.201549 -0.335701
H -0.475538 2.205139 -0.330626
H -0.844676 -1.578686 -0.237946
H -0.830979 -0.590200 1.254402
H 1.656329 -1.584262 -0.246095
H 1.661998 -0.592056 1.243967
H -0.495619 0.717409 -2.327465
H 1.298825 0.715071 -2.335666
H 0.399470 -0.831396 -2.325050
H -0.476447 1.497260 2.115884
H 0.422458 3.010114 1.858145
H 1.313356 1.492011 2.111918
H -4.069361 1.149063 -0.948149
H 4.952155 1.132093 -0.995630
H 6.070784 0.012343 -0.209139
H -5.706243 -0.925841 0.505712
H -6.247088 -0.225485 -1.053778
H -6.219904 0.790556 0.431190


