%chk=000019598.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019598

0 1
 O   0.8521000       1.301300      8.9999998E-04
 O    3.192600       1.706400     -5.0000002E-04
 O   -1.847500       2.105500     -8.9999998E-04
 O   -3.862300      0.3262000     -6.9999998E-04
 N    1.310400      -1.405700      3.0000001E-04
 C   9.6000005E-03 -0.9443000      5.0000002E-04
 C  -0.2018000      0.3875000      6.9999998E-04
 C    2.387700     -0.5379000      9.9999997E-05
 C   -1.086900      -1.888400      9.9999997E-05
 C    2.159800      0.7956000      3.9999999E-04
 C   -1.582300      0.9137000      3.9999999E-04
 C    3.752900      -1.158200     -1.2000001E-03
 C   -2.372600      -1.519000     -3.0000001E-04
 C   -2.711700     -8.2599998E-02  1.9999999E-04
 H    1.484200      -2.403300     -3.0000001E-04
 H  -0.8420000      -2.946800     -1.9999999E-04
 H    4.555200     -0.4141000     -1.6000000E-03
 H    3.882800      -1.785800     -0.8893000    
 H    3.884200      -1.786200      0.8865000    
 H   -3.177800      -2.243200     -6.9999998E-04
 H    2.770300       2.583100     -5.0000002E-04


%chk=000019598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019598

0 1
O 0.865060 1.337832 0.000722
O 3.124159 1.736353 -0.000438
O -1.791552 2.223634 -0.000826
O -3.934465 0.325226 -0.000879
N 1.305015 -1.465678 0.000038
C 0.008381 -0.982902 0.000273
C -0.239066 0.389944 0.000523
C 2.429517 -0.577270 -0.000370
C -1.097075 -1.943193 0.000092
C 2.153907 0.762074 -0.000083
C -1.562200 0.965426 0.000804
C 3.808956 -1.171332 -0.001123
C -2.394707 -1.511489 -0.000091
C -2.727436 -0.057988 0.000369
H 1.478181 -2.470541 -0.000198
H -0.852253 -3.012929 -0.000182
H 4.562133 -0.369040 -0.001382
H 3.983239 -1.799077 -0.897573
H 3.984104 -1.799304 0.894995
H -3.240477 -2.207640 -0.000569
H 2.693479 2.631692 -0.000201


