%chk=000021402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021402

0 1
 O  -0.3223000      -2.764000      9.9999997E-05
 O  -0.3235000       2.764000     -3.0000001E-04
 N    2.271600      -2.806300      1.1000000E-03
 N    2.270700       2.806600      6.9999998E-04
 C   0.9468000     -0.7060000     -3.9999999E-04
 C   0.9467000      0.7062000     -9.9999997E-05
 C   -1.503400     -0.7061000     -9.9999997E-05
 C   -1.503500      0.7059000      9.9999997E-05
 C  -0.2782000      -1.393700     -3.9999999E-04
 C  -0.2785000       1.393700      9.9999997E-05
 C    2.172300      -1.392700     -5.0000002E-04
 C    2.172100       1.393100       0.000000    
 C   -2.728700      -1.393200     -9.9999997E-05
 C   -2.728900       1.392700      1.9999999E-04
 C    3.380400     -0.6954000     -3.9999999E-04
 C    3.380300      0.6958000     -9.9999997E-05
 C   -3.937000     -0.6959000       0.000000    
 C   -3.937100      0.6953000      1.9999999E-04
 H   -2.788000      -2.478100     -1.7500000E-02
 H   -2.788400       2.477800     -1.6799999E-02
 H    4.331500      -1.222400     -1.9999999E-04
 H    4.331300       1.223000      1.9999999E-04
 H   -4.877500      -1.239100     -4.9000001E-03
 H   -4.877600       1.238300     -4.6000001E-03
 H    1.444700      -3.385400     -2.9000000E-03
 H    3.182500      -3.246700     -1.4000000E-03
 H    1.443500       3.385400     -8.9999998E-04
 H    3.181300       3.247400       0.000000    
 H  -0.9876000      -3.059500      0.6439000    
 H  -0.9877000       3.059400      0.6445000    


%chk=000021402-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021402

0 1
O -0.275358 -2.828553 0.136890
O -0.275877 2.828470 0.137354
N 2.327630 -2.851173 -0.018592
N 2.327048 2.851629 -0.017669
C 0.983012 -0.739977 0.035355
C 0.982870 0.740145 0.035543
C -1.524444 -0.727534 0.051218
C -1.524578 0.727234 0.051350
C -0.277863 -1.408239 0.076969
C -0.278126 1.408163 0.077255
C 2.251710 -1.455043 0.009347
C 2.251421 1.455473 0.009745
C -2.792427 -1.412672 0.020557
C -2.792683 1.412150 0.020787
C 3.443730 -0.705496 -0.003847
C 3.443590 0.706170 -0.003655
C -3.998061 -0.718661 0.013747
C -3.998191 0.717921 0.013857
H -2.837333 -2.509272 -0.034553
H -2.837781 2.508751 -0.034149
H 4.402394 -1.238594 -0.019517
H 4.402149 1.239463 -0.019149
H -4.947714 -1.262620 -0.017547
H -4.947942 1.261713 -0.017354
H 1.474185 -3.403666 0.018982
H 3.239798 -3.294908 -0.056097
H 1.473496 3.403935 0.020187
H 3.239118 3.295567 -0.055180
H -1.162703 -3.167879 0.403558
H -1.163270 3.167602 0.404109


