%chk=000076758.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076758

0 1
 O   -2.191500       1.732200      1.9999999E-04
 O   -1.730900      -2.320300     -1.9999999E-04
 O   -3.064900     -0.5770000      6.0000003E-04
 N   -1.916800      -1.080400       0.000000    
 N    3.992300     -0.9584000      7.9999998E-04
 C  -0.7873000     -0.2162000     -3.0000001E-04
 C  -0.9498000       1.169100      9.9999997E-05
 C   0.4937000     -0.7682000     -6.0000003E-04
 C    1.612200      6.5300003E-02 -6.0000003E-04
 C   0.1686000       2.002500      9.9999997E-05
 C    1.449700       1.450600     -3.9999999E-04
 C    2.924800     -0.4992000      9.9999997E-05
 H   0.6458000      -1.845900     -6.0000003E-04
 H   5.7300001E-02   3.083600      3.9999999E-04
 H    2.311900       2.113400     -1.9999999E-04
 H   -2.102000       2.700700      3.9999999E-04


%chk=000076758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076758

0 1
O -2.230976 1.791674 0.000715
O -1.657364 -2.408105 -0.002336
O -3.144859 -0.683055 -0.001612
N -1.944941 -1.145113 0.001681
N 4.050252 -1.001690 -0.000465
C -0.802493 -0.193285 0.000952
C -0.968798 1.225542 0.000540
C 0.488793 -0.761044 0.000621
C 1.639348 0.058883 0.000040
C 0.199812 2.038096 -0.000052
C 1.481350 1.474770 -0.000296
C 2.953543 -0.525183 -0.000207
H 0.567916 -1.851248 0.000923
H 0.088503 3.129593 -0.000337
H 2.365319 2.119064 -0.000744
H -2.172305 2.782903 0.000378


