%chk=000016461.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016461

0 1
 I   -2.729400       2.259600       0.000000    
 O    3.150500     -0.8300000      7.9999998E-04
 O    2.839100       1.421500     -1.9999999E-04
 N   -3.140800      -1.021400      3.0000001E-04
 C   0.9459000     -4.1299999E-02 -1.9999999E-04
 C   -1.773800     -0.6623000     -9.9999997E-05
 C  -3.0000000E-03  0.9811000      9.9999997E-05
 C   0.5349000      -1.374200     -3.9999999E-04
 C   -1.362700      0.6706000      9.9999997E-05
 C  -0.8249000      -1.684800     -3.0000001E-04
 C    2.364100      0.2811000     -3.0000001E-04
 H   0.3220000       2.019400      1.9999999E-04
 H    1.239400      -2.201300     -6.9999998E-04
 H   -1.130600      -2.728100     -1.9999999E-04
 H   -3.848500     -0.2989000     -3.9999999E-04
 H   -3.411600      -1.995800     -7.9999998E-04
 H    4.104700     -0.6018000      1.3000000E-03


%chk=000016461-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016461

0 1
I -2.789505 2.290087 -0.000114
O 3.245275 -0.831654 0.000199
O 2.864215 1.461354 0.000334
N -3.176118 -1.003476 -0.000404
C 0.967581 -0.076049 0.000127
C -1.831434 -0.687142 -0.000231
C 0.004433 0.969438 0.000093
C 0.524801 -1.425916 -0.000029
C -1.361733 0.666771 -0.000079
C -0.842071 -1.723314 -0.000202
C 2.395959 0.293958 0.000317
H 0.360875 2.003902 0.000208
H 1.267383 -2.228249 -0.000004
H -1.179435 -2.766539 -0.000322
H -3.880341 -0.266847 -0.000417
H -3.480598 -1.973007 -0.000509
H 4.186013 -0.509918 0.000235


