%chk=000122259.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122259

0 1
 I   -5.433200      -2.198800       1.134200    
 O   -4.418600       1.168600      0.5720000    
 N   -2.874300     -0.2319000     -0.5189000    
 C   0.7625000      0.4640000     -8.3499998E-02
 C    1.998900     -0.2229000      1.8000000E-03
 C  -0.4387000     -0.2617000     -0.2600000    
 C   0.7299000       1.875000      8.0000004E-03
 C    2.031400      -1.634000     -8.9599997E-02
 C    3.200000      0.5028000      0.1784000    
 C   -1.654500      0.4327000     -0.3427000    
 C  -0.3870000      -1.659400     -0.3486000    
 C   0.8314000      -2.336200     -0.2645000    
 C    1.929900       2.577300      0.1828000    
 C    3.148300       1.900400      0.2669000    
 C  -0.5018000       2.540300     -7.8199998E-02
 C   -1.684400       1.823300     -0.2523000    
 C    3.263100      -2.299200     -3.3000000E-03
 C    4.415700     -0.1916000      0.2609000    
 C    4.445700      -1.582200      0.1706000    
 C   -4.141300      0.1607000     -7.3200002E-02
 C   -5.223000     -0.8274000     -0.4609000    
 H   -1.273200      -2.274500     -0.4724000    
 H   0.8323000      -3.422200     -0.3349000    
 H    1.929500       3.663000      0.2559000    
 H    4.059300       2.479800      0.4028000    
 H  -0.5497000       3.625700     -1.9200001E-02
 H   -2.601900       2.394400     -0.3522000    
 H    3.312600      -3.383900     -7.1000002E-02
 H    5.352100      0.3454000      0.3966000    
 H    5.393600      -2.108800      0.2360000    
 H   -2.821300      -1.180500     -0.8761000    
 H   -6.150000     -0.2730000     -0.6410000    
 H   -4.961700      -1.333800      -1.395700    


%chk=000122259-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122259

0 1
I -4.914702 -2.962806 -0.446787
O -4.556217 1.450052 -0.370185
N -2.920442 -0.254540 -0.287573
C 0.771837 0.472344 -0.030820
C 2.028244 -0.227281 0.035970
C -0.467927 -0.262620 -0.129122
C 0.763621 1.915152 0.001551
C 2.061104 -1.668529 0.005321
C 3.266969 0.509219 0.134472
C -1.700182 0.474505 -0.192708
C -0.399626 -1.709917 -0.158090
C 0.808970 -2.380366 -0.093667
C 2.016708 2.629020 0.100241
C 3.222197 1.955094 0.164481
C -0.480919 2.593280 -0.064662
C -1.694360 1.893113 -0.159968
C 3.310246 -2.343872 0.072447
C 4.494553 -0.204472 0.199471
C 4.513945 -1.615243 0.168635
C -4.207816 0.227616 -0.365654
C -5.364385 -0.775309 -0.458657
H -1.310608 -2.315746 -0.233066
H 0.830411 -3.476061 -0.117393
H 1.989084 3.724560 0.123128
H 4.166749 2.506173 0.239591
H -0.495202 3.688826 -0.040719
H -2.644402 2.427389 -0.209991
H 3.328756 -3.439578 0.048851
H 5.433528 0.356283 0.274600
H 5.469975 -2.147272 0.220033
H -2.845123 -1.276696 -0.299164
H -6.040686 -0.623782 0.395962
H -5.912701 -0.607136 -1.397827


