%chk=000024331.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024331

0 1
 O   -1.302800     -0.1232000      3.0000000E-03
 O  -0.5783000       2.061800      1.4000000E-03
 N    2.386300      -1.670900      8.9999998E-04
 C   -3.562400     -0.9131000      4.8000002E-03
 C   -2.656400      0.3087000      3.5999999E-03
 C   -5.030600     -0.5276000     -9.8000001E-03
 C    1.006400      0.2803000      9.9999997E-05
 C  -0.3604000      0.8602000      2.0000001E-03
 C    2.101700       1.109800     -2.4000001E-03
 C    1.171000      -1.078800      1.5000000E-03
 C    3.369100      0.5379000     -3.3000000E-03
 C    3.456600     -0.8450000     -1.5000000E-03
 H   -3.334000      -1.541200     -0.8647000    
 H   -3.347500      -1.529400      0.8859000    
 H   -2.845700      0.9153000     -0.8900000    
 H   -2.845600      0.9170000      0.8960000    
 H   -5.274300      5.5700000E-02 -0.9035000    
 H   -5.658300      -1.424200     -8.1000002E-03
 H   -5.288300      6.8999998E-02  0.8711000    
 H    2.006800       2.191100     -3.5000001E-03
 H   0.3503000      -1.787400      3.5999999E-03
 H    4.260300       1.154800     -5.2000000E-03
 H    4.422000      -1.340300     -2.0999999E-03


%chk=000024331-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000024331

0 1
O -1.324884 -0.159339 -0.001301
O -0.590612 2.054560 -0.003874
N 2.527067 -1.705633 0.002845
C -3.636259 -0.910971 -0.000233
C -2.737594 0.326100 -0.002775
C -5.129908 -0.515033 -0.002636
C 1.035036 0.237962 -0.000531
C -0.337221 0.823197 -0.002050
C 2.148762 1.116149 -0.001131
C 1.275878 -1.161918 0.001477
C 3.446557 0.567514 0.000273
C 3.587056 -0.840920 0.002225
H -3.404189 -1.528860 -0.887487
H -3.405808 -1.524135 0.890711
H -2.890446 0.954855 -0.899643
H -2.890920 0.959004 0.891079
H -5.387525 0.079964 -0.898620
H -5.771770 -1.413306 0.000213
H -5.388682 0.086416 0.888707
H 1.971987 2.196621 -0.002660
H 0.437236 -1.864219 0.001981
H 4.332887 1.208997 -0.000126
H 4.579251 -1.306503 0.003356


