%chk=000137780.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137780

0 1
 O    3.927500       1.317100     -2.4000001E-03
 O    1.514500      -2.674500     -1.7000000E-03
 N    1.613300       1.386400     -9.9999997E-05
 N    2.771900     -0.6970000      6.9999998E-04
 N  -0.7937000       1.380900      1.5000000E-03
 N  -0.7930000      -1.384400       0.000000    
 C   0.3734000      0.6989000      1.0000000E-03
 C   0.3511000     -0.6703000      6.0000003E-04
 C    2.846200      0.7184000     -3.9999999E-04
 C    1.590200      -1.449000      1.9999999E-04
 C   -1.951500      0.6965000      1.0000000E-03
 C   -1.950800     -0.7067000       0.000000    
 C    1.563900       2.846100     -1.4000000E-03
 C    4.032200      -1.432400      2.4999999E-03
 C   -3.168700       1.373500      1.2000001E-03
 C   -3.166200      -1.387300     -1.2000001E-03
 C   -4.380700      0.6853000       0.000000    
 C   -4.379500     -0.7016000     -1.4000000E-03
 H    2.567500       3.279600     -2.0999999E-03
 H    1.039700       3.190800      0.8956000    
 H    1.039100       3.189200     -0.8987000    
 H    4.602300      -1.151100     -0.8888000    
 H    3.887500      -2.515200      1.1900000E-02
 H    4.609200      -1.136700      0.8846000    
 H   -3.183700       2.461600      2.0999999E-03
 H   -3.178500      -2.475300     -2.0999999E-03
 H   -5.318600       1.232300       0.000000    
 H   -5.316300      -1.250300     -2.4000001E-03


%chk=000137780-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137780

0 1
O 3.917562 1.326702 -0.000645
O 1.697331 -2.789664 -0.000070
N 1.573683 1.369523 0.000357
N 2.788136 -0.716228 0.001352
N -0.777919 1.420968 0.000156
N -0.817061 -1.455960 0.000307
C 0.354060 0.684612 0.000576
C 0.337726 -0.764657 0.000707
C 2.821498 0.703338 0.000724
C 1.619607 -1.534860 0.001237
C -1.974373 0.726701 -0.000095
C -1.994201 -0.730699 -0.000064
C 1.569944 2.850400 -0.000566
C 4.112167 -1.384449 0.000992
C -3.211855 1.440356 -0.000390
C -3.245123 -1.423532 -0.000401
C -4.419178 0.735382 -0.000669
C -4.439001 -0.699069 -0.000699
H 2.617503 3.183074 -0.000662
H 1.043843 3.226148 0.891828
H 1.044038 3.225075 -0.893532
H 4.681797 -1.094059 -0.896541
H 3.931795 -2.469187 0.008901
H 4.688101 -1.081018 0.890001
H -3.179802 2.534036 -0.000376
H -3.225084 -2.517499 -0.000395
H -5.367407 1.284350 -0.000872
H -5.399489 -1.224984 -0.000961


